*HEADER    TRANSCRIPTION                           05-JUL-05   2A7O              
*TITLE     SOLUTION STRUCTURE OF THE HSET2/HYPB SRI DOMAIN                       
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: HUNTINGTIN INTERACTING PROTEIN B;                          
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: SET2 RPB1-INTERACTING (SRI) DOMAIN, HSET2/HYBP             
*COMPND   5 SRI DOMAIN, RESIDUES 1954-2061;                                      
*COMPND   6 ENGINEERED: YES;                                                     
*COMPND   7 OTHER_DETAILS: ISOFORM 1                                             
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 GENE: HSET2/HYPB;                                                    
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3)STAR;                             
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET-15B                                   
*KEYWDS    SRI DOMAIN, SRI, HSRI, SET2, HSET2, PHOSPHOCTD ASSOCIATING            
*KEYWDS   2 PROTEIN, SET2 RPB1-INTERACTING DOMAIN, PCID, PCAP                    
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    M.LI, H.P.PHATNANI, Z.GUAN, H.SAGE, A.GREENLEAF, P.ZHOU               
*REVDAT   1   01-NOV-05 2A7O    0                                                

! NOE distance constraints
assign ( resid    4 and name  HB# )  ( resid    5 and name   HN ) 4.09 2.29 0.00 
assign ( resid    5 and name   HA )  ( resid    5 and name HG2# ) 4.13 2.33 0.00 
assign ( resid    5 and name   HN )  ( resid    5 and name HG2# ) 5.50 3.70 0.00 
assign ( resid    5 and name   HN )  ( resid    6 and name   HN ) 4.61 2.81 0.00 
assign ( resid    5 and name HG2# )  ( resid    6 and name   HN ) 5.50 3.70 0.00 
assign ( resid    6 and name   HA )  ( resid    7 and name   HN ) 2.89 1.09 0.00 
assign ( resid    6 and name   HN )  ( resid    6 and name  HB# ) 3.67 1.87 0.00 
assign ( resid    6 and name  HB# )  ( resid    7 and name   HN ) 3.88 2.08 0.00 
assign ( resid    7 and name   HA )  ( resid    7 and name  HG# ) 3.84 2.04 0.00 
assign ( resid    7 and name   HA )  ( resid    8 and name   HN ) 3.10 1.30 0.00 
assign ( resid    7 and name   HN )  ( resid    7 and name  HB# ) 3.07 1.27 0.00 
assign ( resid    7 and name   HN )  ( resid    7 and name  HG# ) 4.43 2.63 0.00 
assign ( resid    8 and name   HA )  ( resid    9 and name   HN ) 2.94 1.14 0.00 
assign ( resid    8 and name   HN )  ( resid    8 and name  HB# ) 3.21 1.41 0.00 
assign ( resid    8 and name  HB# )  ( resid    9 and name   HN ) 3.55 1.75 0.00 
assign ( resid    9 and name   HA )  ( resid   11 and name   HN ) 5.50 3.70 0.00 
assign ( resid    9 and name   HN )  ( resid    9 and name  HB1 ) 3.61 1.81 0.00 
assign ( resid    9 and name   HN )  ( resid    9 and name  HB2 ) 3.61 1.81 0.00 
assign ( resid    9 and name   HN )  ( resid    9 and name  HB# ) 3.10 1.30 0.00 
assign ( resid    9 and name  HB1 )  ( resid   10 and name   HN ) 5.05 3.25 0.00 
assign ( resid    9 and name  HB2 )  ( resid   10 and name   HN ) 5.05 3.25 0.00 
assign ( resid    9 and name  HB# )  ( resid   10 and name   HN ) 4.33 2.53 0.00 
assign ( resid   10 and name   HA )  ( resid   10 and name   HB ) 2.59 0.79 0.00 
assign ( resid   10 and name   HA )  ( resid   10 and name HG2# ) 3.37 1.57 0.00 
assign ( resid   10 and name   HA )  ( resid   11 and name   HN ) 3.08 1.28 0.00 
assign ( resid   10 and name   HN )  ( resid   10 and name HG2# ) 3.66 1.86 0.00 
assign ( resid   10 and name   HN )  ( resid   11 and name   HN ) 3.73 1.93 0.00 
assign ( resid   11 and name   HA )  ( resid   13 and name   HN ) 4.11 2.31 0.00 
assign ( resid   11 and name   HA )  ( resid   14 and name   HN ) 3.84 2.04 0.00 
assign ( resid   11 and name   HA )  ( resid   14 and name  HB1 ) 4.77 2.97 0.00  
assign ( resid   11 and name   HA )  ( resid   14 and name  HB2 ) 4.58 2.78 0.00 
assign ( resid   11 and name   HA )  ( resid   14 and name  HD# ) 5.44 3.64 0.00 
assign ( resid   11 and name   HA )  ( resid   15 and name   HN ) 4.15 2.35 0.00 
assign ( resid   11 and name   HA )  ( resid   15 and name  HB# ) 5.50 3.70 0.00 
assign ( resid   11 and name   HA )  ( resid   75 and name  HG# ) 4.60 2.80 0.00 
assign ( resid   11 and name   HN )  ( resid   11 and name  HB# ) 3.36 1.56 0.00 
assign ( resid   11 and name   HN )  ( resid   12 and name  HB# ) 4.35 2.55 0.00 
assign ( resid   11 and name   HN )  ( resid   13 and name   HN ) 5.20 3.40 0.00 
assign ( resid   11 and name  HB# )  ( resid   12 and name  HB# ) 4.18 2.38 0.00 
assign ( resid   11 and name  HB# )  ( resid   13 and name  HG# ) 5.34 3.54 0.00 
assign ( resid   11 and name  HB# )  ( resid   14 and name  HB1 ) 5.50 3.70 0.00
assign ( resid   11 and name  HB# )  ( resid   14 and name  HB2 ) 5.21 3.41 0.00 
assign ( resid   11 and name  HB# )  ( resid   14 and name  HD# ) 5.44 3.64 0.00 
assign ( resid   11 and name  HB# )  ( resid   15 and name  HB# ) 4.03 2.23 0.00 
assign ( resid   11 and name  HB# )  ( resid   75 and name  HB2 ) 5.09 3.29 0.00 
assign ( resid   11 and name  HB# )  ( resid   75 and name  HG# ) 5.50 3.70 0.00 
assign ( resid   12 and name   HA )  ( resid   15 and name  HB# ) 4.18 2.38 0.00 
assign ( resid   12 and name   HA )  ( resid   75 and name  HG# ) 4.07 2.27 0.00 
assign ( resid   12 and name  HB# )  ( resid   75 and name  HG# ) 5.26 3.46 0.00 
assign ( resid   13 and name   HN )  ( resid   13 and name  HB# ) 3.14 1.34 0.00 
assign ( resid   13 and name   HN )  ( resid   13 and name  HG1 ) 4.22 2.42 0.00 
assign ( resid   13 and name   HN )  ( resid   13 and name  HG2 ) 4.22 2.42 0.00 
assign ( resid   13 and name   HN )  ( resid   13 and name  HG# ) 3.64 1.84 0.00 
assign ( resid   13 and name   HN )  ( resid   14 and name   HN ) 3.20 1.40 0.00 
assign ( resid   13 and name  HB# )  ( resid   14 and name   HN ) 3.53 1.73 0.00 
assign ( resid   13 and name  HG# )  ( resid   14 and name   HN ) 4.29 2.49 0.00 
assign ( resid   14 and name   HA )  ( resid   14 and name   HG ) 3.86 2.06 0.00 
assign ( resid   14 and name   HA )  ( resid   14 and name  HD# ) 3.26 1.46 0.00 
assign ( resid   14 and name   HA )  ( resid   14 and name HD1# ) 3.90 2.10 0.00 
assign ( resid   14 and name   HA )  ( resid   14 and name HD2# ) 3.90 2.10 0.00 
assign ( resid   14 and name   HA )  ( resid   15 and name   HA ) 5.50 3.70 0.00 
assign ( resid   14 and name   HN )  ( resid   14 and name  HB2 ) 2.55 0.75 0.00 
assign ( resid   14 and name   HN )  ( resid   14 and name  HD# ) 4.46 2.66 0.00 
assign ( resid   14 and name   HN )  ( resid   16 and name   HN ) 4.34 2.54 0.00 
assign ( resid   14 and name  HB2 )  ( resid   15 and name   HN ) 3.42 1.62 0.00 
assign ( resid   14 and name  HD# )  ( resid   15 and name   HN ) 5.24 3.44 0.00 
assign ( resid   15 and name   HA )  ( resid   16 and name   HN ) 3.52 1.72 0.00 
assign ( resid   15 and name   HA )  ( resid   18 and name   HN ) 3.64 1.84 0.00 
assign ( resid   15 and name   HA )  ( resid   18 and name  HB# ) 3.50 1.70 0.00 
assign ( resid   15 and name   HA )  ( resid   19 and name  HG# ) 4.74 2.94 0.00 
assign ( resid   15 and name   HA )  ( resid   75 and name  HB1 ) 5.50 3.70 0.00 
assign ( resid   15 and name   HA )  ( resid   75 and name  HB2 ) 4.67 2.87 0.00 
assign ( resid   15 and name   HA )  ( resid   75 and name  HG# ) 4.58 2.78 0.00
assign ( resid   15 and name   HN )  ( resid   15 and name   HA ) 2.82 1.02 0.00 
assign ( resid   15 and name   HN )  ( resid   15 and name  HB# ) 2.86 1.06 0.00 
assign ( resid   15 and name   HN )  ( resid   16 and name   HN ) 3.08 1.28 0.00 
assign ( resid   15 and name   HN )  ( resid   19 and name  HG# ) 5.34 3.54 0.00 
assign ( resid   15 and name  HB# )  ( resid   16 and name   HN ) 3.69 1.89 0.00 
assign ( resid   15 and name  HB# )  ( resid   18 and name   HN ) 3.80 2.00 0.00 
assign ( resid   15 and name  HB# )  ( resid   18 and name  HB# ) 4.25 2.45 0.00 
assign ( resid   15 and name  HB# )  ( resid   19 and name   HN ) 4.91 3.11 0.00 
assign ( resid   15 and name  HB# )  ( resid   19 and name  HE# ) 5.16 3.36 0.00 
assign ( resid   15 and name  HB# )  ( resid   19 and name  HG# ) 2.99 1.19 0.00 
assign ( resid   15 and name  HB# )  ( resid   75 and name   HA ) 4.64 2.84 0.00 
assign ( resid   15 and name  HB# )  ( resid   75 and name  HB1 ) 3.90 2.10 0.00 
assign ( resid   15 and name  HB# )  ( resid   75 and name  HB2 ) 3.63 1.83 0.00 
assign ( resid   15 and name  HB# )  ( resid   75 and name  HG# ) 3.99 2.19 0.00 
assign ( resid   15 and name  HB# )  ( resid   76 and name   HN ) 3.79 1.99 0.00 
assign ( resid   16 and name   HA )  ( resid   17 and name  HD# ) 4.63 2.83 0.00 
assign ( resid   16 and name   HA )  ( resid   19 and name  HG# ) 4.32 2.52 0.00 
assign ( resid   16 and name   HN )  ( resid   17 and name   HN ) 2.78 0.98 0.00 
assign ( resid   16 and name   HN )  ( resid   18 and name   HN ) 4.43 2.63 0.00 
assign ( resid   17 and name   HA )  ( resid   17 and name  HB# ) 2.85 1.05 0.00 
assign ( resid   17 and name   HA )  ( resid   17 and name  HD# ) 3.65 1.85 0.00 
assign ( resid   17 and name   HA )  ( resid   17 and name  HE# ) 5.25 3.45 0.00 
assign ( resid   17 and name   HA )  ( resid   17 and name  HG1 ) 3.95 2.15 0.00 
assign ( resid   17 and name   HA )  ( resid   17 and name  HG2 ) 3.95 2.15 0.00 
assign ( resid   17 and name   HA )  ( resid   17 and name  HG# ) 3.44 1.64 0.00 
assign ( resid   17 and name   HA )  ( resid   20 and name  HG# ) 3.43 1.63 0.00 
assign ( resid   17 and name   HA )  ( resid   21 and name  HG# ) 5.26 3.46 0.00 
assign ( resid   17 and name   HN )  ( resid   17 and name  HB# ) 2.64 0.84 0.00 
assign ( resid   17 and name   HN )  ( resid   17 and name  HG# ) 4.39 2.59 0.00 
assign ( resid   17 and name   HN )  ( resid   18 and name   HN ) 2.82 1.02 0.00 
assign ( resid   17 and name  HB# )  ( resid   17 and name  HD# ) 3.26 1.46 0.00 
assign ( resid   17 and name  HB# )  ( resid   17 and name  HE# ) 4.75 2.95 0.00 
assign ( resid   17 and name  HB# )  ( resid   18 and name   HN ) 3.40 1.60 0.00 
assign ( resid   17 and name  HB# )  ( resid   21 and name  HG# ) 4.46 2.66 0.00 
assign ( resid   17 and name  HD# )  ( resid   17 and name  HE# ) 2.84 1.04 0.00 
assign ( resid   17 and name  HG1 )  ( resid   17 and name  HD# ) 2.89 1.09 0.00 
assign ( resid   17 and name  HG1 )  ( resid   17 and name  HE# ) 3.60 1.80 0.00 
assign ( resid   17 and name  HG2 )  ( resid   17 and name  HD# ) 2.89 1.09 0.00 
assign ( resid   17 and name  HG2 )  ( resid   17 and name  HE# ) 3.60 1.80 0.00 
assign ( resid   17 and name  HG# )  ( resid   17 and name  HE# ) 3.00 1.20 0.00 
assign ( resid   18 and name   HA )  ( resid   21 and name   HB ) 3.82 2.02 0.00 
assign ( resid   18 and name   HA )  ( resid   21 and name  HG# ) 4.34 2.54 0.00 
assign ( resid   18 and name   HA )  ( resid   21 and name HG1# ) 5.05 3.25 0.00 
assign ( resid   18 and name   HA )  ( resid   21 and name HG2# ) 5.05 3.25 0.00 
assign ( resid   18 and name   HA )  ( resid   22 and name   HN ) 4.32 2.52 0.00 
assign ( resid   18 and name   HN )  ( resid   18 and name  HB# ) 2.63 0.83 0.00 
assign ( resid   18 and name   HN )  ( resid   19 and name   HN ) 3.06 1.26 0.00 
assign ( resid   18 and name   HN )  ( resid   19 and name  HG# ) 4.40 2.60 0.00 
assign ( resid   18 and name   HN )  ( resid   20 and name   HN ) 4.75 2.95 0.00 
assign ( resid   18 and name   HN )  ( resid   20 and name  HG# ) 5.50 3.70 0.00 
assign ( resid   18 and name   HN )  ( resid   21 and name  HG# ) 4.88 3.08 0.00 
assign ( resid   18 and name  HB# )  ( resid   19 and name   HN ) 3.13 1.33 0.00 
assign ( resid   18 and name  HB# )  ( resid   21 and name   HB ) 5.50 3.70 0.00 
assign ( resid   18 and name  HB# )  ( resid   21 and name   HN ) 5.26 3.46 0.00 
assign ( resid   18 and name  HB# )  ( resid   21 and name  HG# ) 5.44 3.64 0.00 
assign ( resid   18 and name  HB# )  ( resid   75 and name  HB1 ) 5.14 3.34 0.00 
assign ( resid   18 and name  HB# )  ( resid   75 and name  HB2 ) 4.64 2.84 0.00 
assign ( resid   18 and name  HB# )  ( resid   78 and name   HG ) 5.50 3.70 0.00 
assign ( resid   18 and name  HB# )  ( resid   78 and name  HB1 ) 4.43 2.63 0.00 
assign ( resid   18 and name  HB# )  ( resid   78 and name HD2# ) 4.66 2.86 0.00 
assign ( resid   19 and name   HA )  ( resid   19 and name  HB# ) 2.43 0.63 0.00 
assign ( resid   19 and name   HA )  ( resid   19 and name  HD# ) 4.01 2.21 0.00 
assign ( resid   19 and name   HA )  ( resid   19 and name  HE# ) 5.50 3.70 0.00 
assign ( resid   19 and name   HA )  ( resid   19 and name  HG1 ) 4.11 2.31 0.00 
assign ( resid   19 and name   HA )  ( resid   19 and name  HG2 ) 4.11 2.31 0.00 
assign ( resid   19 and name   HA )  ( resid   22 and name   HN ) 3.90 2.10 0.00 
assign ( resid   19 and name   HA )  ( resid   22 and name  HB1 ) 4.29 2.49 0.00 
assign ( resid   19 and name   HA )  ( resid   22 and name  HD# ) 3.55 1.75 0.00 
assign ( resid   19 and name   HA )  ( resid   22 and name  HE# ) 5.49 3.69 0.00 
assign ( resid   19 and name   HA )  ( resid   23 and name   HN ) 3.36 1.56 0.00 
assign ( resid   19 and name   HA )  ( resid   65 and name  HE# ) 4.07 2.27 0.00 
assign ( resid   19 and name   HA )  ( resid   78 and name HD2# ) 3.30 1.50 0.00 
assign ( resid   19 and name   HN )  ( resid   19 and name   HA ) 2.94 1.14 0.00 
assign ( resid   19 and name   HN )  ( resid   19 and name  HB# ) 2.81 1.01 0.00 
assign ( resid   19 and name   HN )  ( resid   19 and name  HG1 ) 3.89 2.09 0.00 
assign ( resid   19 and name   HN )  ( resid   19 and name  HG2 ) 3.89 2.09 0.00 
assign ( resid   19 and name   HN )  ( resid   19 and name  HG# ) 3.01 1.21 0.00 
assign ( resid   19 and name   HN )  ( resid   20 and name   HN ) 3.07 1.27 0.00 
assign ( resid   19 and name   HN )  ( resid   20 and name  HG# ) 5.44 3.64 0.00 
assign ( resid   19 and name   HN )  ( resid   23 and name   HN ) 5.50 3.70 0.00 
assign ( resid   19 and name   HN )  ( resid   78 and name HD2# ) 4.53 2.73 0.00 
assign ( resid   19 and name  HB# )  ( resid   19 and name  HD# ) 2.76 0.96 0.00 
assign ( resid   19 and name  HB# )  ( resid   19 and name  HE# ) 3.43 1.63 0.00 
assign ( resid   19 and name  HB# )  ( resid   20 and name   HN ) 2.78 0.98 0.00 
assign ( resid   19 and name  HB# )  ( resid   78 and name HD2# ) 3.92 2.12 0.00 
assign ( resid   19 and name  HD# )  ( resid   65 and name  HE# ) 3.38 1.58 0.00 
assign ( resid   19 and name  HD# )  ( resid   75 and name   HA ) 5.50 3.70 0.00 
assign ( resid   19 and name  HD# )  ( resid   78 and name HD2# ) 3.79 1.99 0.00 
assign ( resid   19 and name  HE# )  ( resid   65 and name  HE# ) 3.99 2.19 0.00 
assign ( resid   19 and name  HE# )  ( resid   69 and name  HD# ) 4.40 2.60 0.00 
assign ( resid   19 and name  HE# )  ( resid   69 and name HD1# ) 5.17 3.37 0.00 
assign ( resid   19 and name  HE# )  ( resid   69 and name HD2# ) 5.17 3.37 0.00 
assign ( resid   19 and name  HE# )  ( resid   78 and name HD1# ) 5.50 3.70 0.00 
assign ( resid   19 and name  HE# )  ( resid   78 and name HD2# ) 5.04 3.24 0.00 
assign ( resid   19 and name  HG1 )  ( resid   19 and name  HE# ) 3.65 1.85 0.00 
assign ( resid   19 and name  HG1 )  ( resid   20 and name   HN ) 4.93 3.13 0.00 
assign ( resid   19 and name  HG1 )  ( resid   78 and name HD2# ) 4.61 2.81 0.00 
assign ( resid   19 and name  HG2 )  ( resid   19 and name  HE# ) 3.65 1.85 0.00 
assign ( resid   19 and name  HG2 )  ( resid   20 and name   HN ) 4.93 3.13 0.00 
assign ( resid   19 and name  HG2 )  ( resid   78 and name HD2# ) 4.61 2.81 0.00 
assign ( resid   19 and name  HG# )  ( resid   19 and name  HD# ) 2.31 0.51 0.00 
assign ( resid   19 and name  HG# )  ( resid   20 and name   HN ) 4.18 2.38 0.00 
assign ( resid   19 and name  HG# )  ( resid   65 and name  HE# ) 4.57 2.77 0.00 
assign ( resid   19 and name  HG# )  ( resid   69 and name  HD# ) 4.76 2.96 0.00 
assign ( resid   19 and name  HG# )  ( resid   75 and name  HG# ) 4.46 2.66 0.00 
assign ( resid   19 and name  HG# )  ( resid   78 and name HD2# ) 3.97 2.17 0.00 
assign ( resid   20 and name   HA )  ( resid   23 and name  HG1 ) 4.47 2.67 0.00 
assign ( resid   20 and name   HN )  ( resid   20 and name   HA ) 2.86 1.06 0.00 
assign ( resid   20 and name   HN )  ( resid   20 and name  HG# ) 3.10 1.30 0.00 
assign ( resid   20 and name   HN )  ( resid   21 and name   HA ) 5.50 3.70 0.00 
assign ( resid   20 and name   HN )  ( resid   21 and name   HN ) 2.82 1.02 0.00 
assign ( resid   20 and name   HN )  ( resid   21 and name  HG# ) 4.77 2.97 0.00 
assign ( resid   20 and name   HN )  ( resid   22 and name   HN ) 4.82 3.02 0.00 
assign ( resid   20 and name  HB1 )  ( resid   20 and name  HG# ) 2.95 1.15 0.00 
assign ( resid   20 and name  HB2 )  ( resid   20 and name  HG# ) 2.95 1.15 0.00 
assign ( resid   20 and name  HG# )  ( resid   21 and name   HN ) 3.74 1.94 0.00 
assign ( resid   20 and name  HG# )  ( resid   22 and name   HN ) 4.91 3.11 0.00 
assign ( resid   21 and name   HA )  ( resid   21 and name  HG# ) 2.86 1.06 0.00 
assign ( resid   21 and name   HA )  ( resid   21 and name HG1# ) 3.33 1.53 0.00 
assign ( resid   21 and name   HA )  ( resid   21 and name HG2# ) 3.33 1.53 0.00 
assign ( resid   21 and name   HA )  ( resid   24 and name   HN ) 3.77 1.97 0.00 
assign ( resid   21 and name   HA )  ( resid   24 and name  HB# ) 3.32 1.52 0.00 
assign ( resid   21 and name   HA )  ( resid   25 and name   HN ) 4.43 2.63 0.00 
assign ( resid   21 and name   HB )  ( resid   21 and name   HN ) 2.50 0.70 0.00  
assign ( resid   21 and name   HB )  ( resid   22 and name   HN ) 2.67 0.87 0.00  
assign ( resid   21 and name   HN )  ( resid   21 and name   HB ) 2.52 0.72 0.00 
assign ( resid   21 and name   HN )  ( resid   21 and name HG2# ) 2.67 0.87 0.00 
assign ( resid   21 and name   HN )  ( resid   22 and name   HN ) 2.64 0.84 0.00 
assign ( resid   21 and name   HN )  ( resid   22 and name  HB1 ) 4.46 2.66 0.00 
assign ( resid   21 and name   HN )  ( resid   23 and name   HN ) 4.69 2.89 0.00 
assign ( resid   21 and name   HN )  ( resid   23 and name  HG1 ) 5.50 3.70 0.00 
assign ( resid   21 and name  HG# )  ( resid   22 and name   HA ) 3.91 2.11 0.00 
assign ( resid   21 and name  HG# )  ( resid   22 and name   HN ) 3.50 1.70 0.00 
assign ( resid   21 and name  HG# )  ( resid   22 and name  HB1 ) 5.44 3.64 0.00 
assign ( resid   21 and name  HG# )  ( resid   24 and name  HB# ) 3.82 2.02 0.00 
assign ( resid   21 and name  HG# )  ( resid   25 and name  HG1 ) 4.11 2.31 0.00 
assign ( resid   21 and name  HG# )  ( resid   25 and name  HG2 ) 4.04 2.24 0.00 
assign ( resid   21 and name  HG# )  ( resid   80 and name   HN ) 5.44 3.64 0.00 
assign ( resid   21 and name  HG# )  ( resid   80 and name  HB1 ) 5.44 3.64 0.00 
assign ( resid   21 and name HG1# )  ( resid   22 and name   HN ) 3.70 1.90 0.00  
assign ( resid   21 and name HG1# )  ( resid   24 and name  HB# ) 4.91 3.11 0.00 
assign ( resid   21 and name HG2# )  ( resid   22 and name   HN ) 4.50 2.70 0.00  
assign ( resid   21 and name HG2# )  ( resid   24 and name  HB# ) 4.91 3.11 0.00 
assign ( resid   22 and name   HA )  ( resid   22 and name  HD# ) 3.09 1.29 0.00 
assign ( resid   22 and name   HA )  ( resid   22 and name  HE# ) 4.87 3.07 0.00 
assign ( resid   22 and name   HA )  ( resid   25 and name   HN ) 3.54 1.74 0.00 
assign ( resid   22 and name   HA )  ( resid   25 and name  HB# ) 4.23 2.43 0.00 
assign ( resid   22 and name   HA )  ( resid   78 and name  HD# ) 5.50 3.70 0.00 
assign ( resid   22 and name   HA )  ( resid   80 and name   HN ) 4.99 3.19 0.00 
assign ( resid   22 and name   HA )  ( resid   80 and name  HB1 ) 4.26 2.46 0.00 
assign ( resid   22 and name   HA )  ( resid   80 and name  HB2 ) 5.15 3.35 0.00 
assign ( resid   22 and name   HN )  ( resid   22 and name   HA ) 2.87 1.07 0.00 
assign ( resid   22 and name   HN )  ( resid   22 and name  HB1 ) 2.72 0.92 0.00 
assign ( resid   22 and name   HN )  ( resid   22 and name  HB2 ) 3.04 1.24 0.00 
assign ( resid   22 and name   HN )  ( resid   22 and name  HD# ) 4.27 2.47 0.00 
assign ( resid   22 and name   HN )  ( resid   23 and name   HN ) 3.12 1.32 0.00 
assign ( resid   22 and name   HN )  ( resid   23 and name  HG1 ) 4.95 3.15 0.00 
assign ( resid   22 and name   HN )  ( resid   23 and name  HG2 ) 5.50 3.70 0.00 
assign ( resid   22 and name   HN )  ( resid   78 and name HD2# ) 4.89 3.09 0.00 
assign ( resid   22 and name   HZ )  ( resid   23 and name  HB# ) 5.50 3.70 0.00 
assign ( resid   22 and name   HZ )  ( resid   26 and name  HE# ) 4.50 2.70 0.00
assign ( resid   22 and name   HZ )  ( resid   26 and name  HB1 ) 5.47 3.67 0.00 
assign ( resid   22 and name   HZ )  ( resid   64 and name   HB ) 4.22 2.42 0.00 
assign ( resid   22 and name   HZ )  ( resid   64 and name  HG# ) 4.41 2.61 0.00 
assign ( resid   22 and name   HZ )  ( resid   65 and name   HA ) 4.80 3.00 0.00 
assign ( resid   22 and name   HZ )  ( resid   65 and name  HB1 ) 4.42 2.62 0.00 
assign ( resid   22 and name   HZ )  ( resid   66 and name   HN ) 5.50 3.70 0.00 
assign ( resid   22 and name   HZ )  ( resid   68 and name   HN ) 5.50 3.70 0.00 
assign ( resid   22 and name   HZ )  ( resid   68 and name  HG1 ) 4.67 2.87 0.00 
assign ( resid   22 and name   HZ )  ( resid   68 and name  HG2 ) 4.89 3.09 0.00 
assign ( resid   22 and name   HZ )  ( resid   69 and name  HD# ) 5.44 3.64 0.00 
assign ( resid   22 and name   HZ )  ( resid   78 and name HD1# ) 4.51 2.71 0.00 
assign ( resid   22 and name   HZ )  ( resid   78 and name HD2# ) 5.24 3.44 0.00 
assign ( resid   22 and name   HZ )  ( resid   84 and name HG2# ) 4.59 2.79 0.00 
assign ( resid   22 and name   HZ )  ( resid   84 and name HG1# ) 3.33 1.53 0.00 
assign ( resid   22 and name  HB1 )  ( resid   23 and name   HN ) 3.30 1.50 0.00 
assign ( resid   22 and name  HB1 )  ( resid   78 and name   HG ) 5.25 3.45 0.00 
assign ( resid   22 and name  HB1 )  ( resid   78 and name HD1# ) 5.50 3.70 0.00 
assign ( resid   22 and name  HB1 )  ( resid   78 and name HD2# ) 4.30 2.50 0.00 
assign ( resid   22 and name  HB2 )  ( resid   78 and name   HG ) 5.44 3.64 0.00 
assign ( resid   22 and name  HB2 )  ( resid   78 and name HD1# ) 5.34 3.54 0.00 
assign ( resid   22 and name  HB2 )  ( resid   78 and name HD2# ) 4.12 2.32 0.00 
assign ( resid   22 and name  HD# )  ( resid   23 and name   HA ) 3.93 2.13 0.00 
assign ( resid   22 and name  HD# )  ( resid   23 and name   HN ) 3.51 1.71 0.00 
assign ( resid   22 and name  HD# )  ( resid   25 and name  HG1 ) 4.03 2.23 0.00 
assign ( resid   22 and name  HD# )  ( resid   25 and name  HG2 ) 5.50 3.70 0.00 
assign ( resid   22 and name  HD# )  ( resid   26 and name   HN ) 4.39 2.59 0.00 
assign ( resid   22 and name  HD# )  ( resid   26 and name  HB1 ) 5.50 3.70 0.00 
assign ( resid   22 and name  HD# )  ( resid   65 and name  HE# ) 4.54 2.74 0.00 
assign ( resid   22 and name  HD# )  ( resid   65 and name  HG# ) 4.51 2.71 0.00 
assign ( resid   22 and name  HD# )  ( resid   68 and name  HG1 ) 5.50 3.70 0.00 
assign ( resid   22 and name  HD# )  ( resid   78 and name   HG ) 5.50 3.70 0.00 
assign ( resid   22 and name  HD# )  ( resid   78 and name HD1# ) 5.43 3.63 0.00 
assign ( resid   22 and name  HD# )  ( resid   78 and name HD2# ) 3.24 1.44 0.00 
assign ( resid   22 and name  HD# )  ( resid   79 and name   HA ) 3.77 1.97 0.00 
assign ( resid   22 and name  HD# )  ( resid   79 and name   HN ) 4.20 2.40 0.00 
assign ( resid   22 and name  HD# )  ( resid   80 and name   HA ) 3.16 1.36 0.00 
assign ( resid   22 and name  HD# )  ( resid   80 and name   HN ) 3.42 1.62 0.00 
assign ( resid   22 and name  HD# )  ( resid   80 and name  HB1 ) 3.20 1.40 0.00 
assign ( resid   22 and name  HD# )  ( resid   80 and name  HB2 ) 3.46 1.66 0.00 
assign ( resid   22 and name  HD# )  ( resid   84 and name HG1# ) 3.91 2.11 0.00 
assign ( resid   22 and name  HE# )  ( resid   23 and name   HA ) 5.10 3.30 0.00 
assign ( resid   22 and name  HE# )  ( resid   26 and name  HB1 ) 5.50 3.70 0.00 
assign ( resid   22 and name  HE# )  ( resid   26 and name  HB2 ) 4.09 2.29 0.00 
assign ( resid   22 and name  HE# )  ( resid   26 and name  HG# ) 4.41 2.61 0.00 
assign ( resid   22 and name  HE# )  ( resid   26 and name  HE# ) 3.21 1.41 0.00
assign ( resid   22 and name  HE# )  ( resid   62 and name   HA ) 5.50 3.70 0.00 
assign ( resid   22 and name  HE# )  ( resid   64 and name  HG# ) 3.82 2.02 0.00 
assign ( resid   22 and name  HE# )  ( resid   65 and name   HA ) 3.57 1.77 0.00 
assign ( resid   22 and name  HE# )  ( resid   65 and name   HN ) 4.24 2.44 0.00 
assign ( resid   22 and name  HE# )  ( resid   65 and name  HB1 ) 4.46 2.66 0.00 
assign ( resid   22 and name  HE# )  ( resid   65 and name  HB2 ) 2.90 1.10 0.00 
assign ( resid   22 and name  HE# )  ( resid   65 and name  HE# ) 4.96 3.16 0.00 
assign ( resid   22 and name  HE# )  ( resid   65 and name  HG1 ) 4.03 2.23 0.00 
assign ( resid   22 and name  HE# )  ( resid   65 and name  HG2 ) 4.03 2.23 0.00 
assign ( resid   22 and name  HE# )  ( resid   65 and name  HG# ) 3.32 1.52 0.00 
assign ( resid   22 and name  HE# )  ( resid   68 and name  HG1 ) 5.26 3.46 0.00 
assign ( resid   22 and name  HE# )  ( resid   69 and name  HD# ) 4.81 3.01 0.00 
assign ( resid   22 and name  HE# )  ( resid   78 and name   HG ) 5.50 3.70 0.00 
assign ( resid   22 and name  HE# )  ( resid   78 and name HD1# ) 3.55 1.75 0.00 
assign ( resid   22 and name  HE# )  ( resid   79 and name   HA ) 5.50 3.70 0.00 
assign ( resid   22 and name  HE# )  ( resid   80 and name   HA ) 3.34 1.54 0.00 
assign ( resid   22 and name  HE# )  ( resid   80 and name  HB2 ) 4.65 2.85 0.00 
assign ( resid   22 and name  HE# )  ( resid   84 and name HG2# ) 3.61 1.81 0.00 
assign ( resid   22 and name  HE# )  ( resid   84 and name HG1# ) 3.04 1.24 0.00 
assign ( resid   23 and name   HA )  ( resid   23 and name  HD1 ) 5.50 3.70 0.00 
assign ( resid   23 and name   HA )  ( resid   23 and name  HD2 ) 5.50 3.70 0.00 
assign ( resid   23 and name   HA )  ( resid   23 and name  HD# ) 4.72 2.92 0.00 
assign ( resid   23 and name   HA )  ( resid   23 and name  HG1 ) 4.01 2.21 0.00 
assign ( resid   23 and name   HA )  ( resid   24 and name   HA ) 4.81 3.01 0.00 
assign ( resid   23 and name   HA )  ( resid   26 and name   HN ) 3.82 2.02 0.00 
assign ( resid   23 and name   HA )  ( resid   26 and name  HB1 ) 4.33 2.53 0.00 
assign ( resid   23 and name   HA )  ( resid   26 and name  HB2 ) 4.17 2.37 0.00 
assign ( resid   23 and name   HA )  ( resid   27 and name   HN ) 4.45 2.65 0.00 
assign ( resid   23 and name   HA )  ( resid   61 and name HG2# ) 4.24 2.44 0.00 
assign ( resid   23 and name   HN )  ( resid   23 and name   HA ) 2.93 1.13 0.00 
assign ( resid   23 and name   HN )  ( resid   23 and name  HB# ) 2.45 0.65 0.00 
assign ( resid   23 and name   HN )  ( resid   23 and name  HG1 ) 4.40 2.60 0.00 
assign ( resid   23 and name   HN )  ( resid   23 and name  HG2 ) 3.49 1.69 0.00 
assign ( resid   23 and name   HN )  ( resid   24 and name   HN ) 3.20 1.40 0.00 
assign ( resid   23 and name   HN )  ( resid   25 and name   HN ) 4.61 2.81 0.00 
assign ( resid   23 and name   HN )  ( resid   26 and name   HN ) 5.31 3.51 0.00 
assign ( resid   23 and name   HN )  ( resid   26 and name  HB2 ) 5.50 3.70 0.00 
assign ( resid   23 and name   HN )  ( resid   61 and name HG2# ) 5.21 3.41 0.00 
assign ( resid   23 and name   HN )  ( resid   78 and name HD2# ) 4.72 2.92 0.00 
assign ( resid   23 and name  HB# )  ( resid   23 and name  HD1 ) 3.63 1.83 0.00 
assign ( resid   23 and name  HB# )  ( resid   23 and name  HD2 ) 3.63 1.83 0.00 
assign ( resid   23 and name  HB# )  ( resid   61 and name HG2# ) 4.64 2.84 0.00 
assign ( resid   23 and name  HD# )  ( resid   24 and name   HA ) 3.71 1.91 0.00 
assign ( resid   23 and name  HD# )  ( resid   24 and name   HN ) 4.40 2.60 0.00 
assign ( resid   23 and name  HG1 )  ( resid   24 and name   HA ) 4.12 2.32 0.00 
assign ( resid   23 and name  HG1 )  ( resid   24 and name   HN ) 3.75 1.95 0.00 
assign ( resid   24 and name   HA )  ( resid   24 and name  HB# ) 2.80 1.00 0.00 
assign ( resid   24 and name   HA )  ( resid   24 and name  HD# ) 3.94 2.14 0.00 
assign ( resid   24 and name   HA )  ( resid   24 and name  HE# ) 5.50 3.70 0.00 
assign ( resid   24 and name   HA )  ( resid   24 and name  HG# ) 3.18 1.38 0.00 
assign ( resid   24 and name   HA )  ( resid   61 and name HG2# ) 4.73 2.93 0.00 
assign ( resid   24 and name   HN )  ( resid   24 and name  HB# ) 2.78 0.98 0.00 
assign ( resid   24 and name   HN )  ( resid   24 and name  HG# ) 4.76 2.96 0.00 
assign ( resid   24 and name   HN )  ( resid   25 and name   HN ) 2.72 0.92 0.00 
assign ( resid   24 and name   HN )  ( resid   25 and name  HG2 ) 3.93 2.13 0.00 
assign ( resid   24 and name   HN )  ( resid   26 and name   HN ) 3.94 2.14 0.00 
assign ( resid   24 and name   HN )  ( resid   27 and name   HN ) 5.12 3.32 0.00 
assign ( resid   24 and name   HN )  ( resid   61 and name HG2# ) 5.24 3.44 0.00 
assign ( resid   24 and name  HB# )  ( resid   24 and name  HD# ) 3.45 1.65 0.00 
assign ( resid   24 and name  HB# )  ( resid   24 and name  HE# ) 4.98 3.18 0.00 
assign ( resid   24 and name  HB# )  ( resid   24 and name  HG# ) 2.97 1.17 0.00 
assign ( resid   24 and name  HB# )  ( resid   25 and name   HN ) 2.98 1.18 0.00 
assign ( resid   24 and name  HD# )  ( resid   24 and name  HE# ) 2.71 0.91 0.00 
assign ( resid   24 and name  HG# )  ( resid   24 and name  HD# ) 2.65 0.85 0.00 
assign ( resid   24 and name  HG# )  ( resid   24 and name  HE# ) 3.45 1.65 0.00 
assign ( resid   24 and name  HG# )  ( resid   25 and name   HN ) 4.55 2.75 0.00 
assign ( resid   25 and name   HA )  ( resid   25 and name  HB# ) 2.76 0.96 0.00 
assign ( resid   25 and name   HA )  ( resid   25 and name  HG1 ) 3.87 2.07 0.00 
assign ( resid   25 and name   HA )  ( resid   25 and name  HG2 ) 3.77 1.97 0.00 
assign ( resid   25 and name   HA )  ( resid   26 and name   HN ) 3.57 1.77 0.00 
assign ( resid   25 and name   HA )  ( resid   28 and name  HB# ) 4.19 2.39 0.00 
assign ( resid   25 and name   HN )  ( resid   25 and name   HA ) 2.89 1.09 0.00 
assign ( resid   25 and name   HN )  ( resid   25 and name  HB# ) 3.32 1.52 0.00 
assign ( resid   25 and name   HN )  ( resid   25 and name  HG1 ) 3.07 1.27 0.00 
assign ( resid   25 and name   HN )  ( resid   25 and name  HG2 ) 3.11 1.31 0.00 
assign ( resid   25 and name   HN )  ( resid   26 and name   HA ) 5.28 3.48 0.00 
assign ( resid   25 and name   HN )  ( resid   26 and name   HN ) 2.88 1.08 0.00 
assign ( resid   25 and name   HN )  ( resid   26 and name  HB1 ) 4.90 3.10 0.00 
assign ( resid   25 and name   HN )  ( resid   26 and name  HB2 ) 4.99 3.19 0.00 
assign ( resid   25 and name   HN )  ( resid   27 and name   HN ) 4.65 2.85 0.00 
assign ( resid   25 and name   HN )  ( resid   28 and name   HN ) 5.49 3.69 0.00 
assign ( resid   25 and name   HN )  ( resid   28 and name  HG# ) 5.34 3.54 0.00 
assign ( resid   25 and name   HN )  ( resid   80 and name  HB1 ) 4.36 2.56 0.00 
assign ( resid   25 and name  HB# )  ( resid   25 and name  HG1 ) 2.85 1.05 0.00 
assign ( resid   25 and name  HB# )  ( resid   26 and name   HN ) 3.30 1.50 0.00 
assign ( resid   25 and name  HB# )  ( resid   28 and name   HN ) 4.87 3.07 0.00 
assign ( resid   25 and name  HB# )  ( resid   80 and name  HB1 ) 3.72 1.92 0.00 
assign ( resid   25 and name  HB# )  ( resid   80 and name  HB2 ) 3.57 1.77 0.00 
assign ( resid   25 and name  HG1 )  ( resid   26 and name   HN ) 3.47 1.67 0.00 
assign ( resid   25 and name  HG2 )  ( resid   26 and name   HN ) 4.46 2.66 0.00 
assign ( resid   25 and name  HG2 )  ( resid   80 and name  HB2 ) 5.50 3.70 0.00 
assign ( resid   26 and name   HA )  ( resid   28 and name   HN ) 5.50 3.70 0.00 
assign ( resid   26 and name   HA )  ( resid   29 and name   HN ) 3.33 1.53 0.00 
assign ( resid   26 and name   HA )  ( resid   29 and name  HB# ) 3.38 1.58 0.00 
assign ( resid   26 and name   HA )  ( resid   29 and name  HD# ) 5.49 3.69 0.00 
assign ( resid   26 and name   HA )  ( resid   30 and name   HN ) 4.53 2.73 0.00 
assign ( resid   26 and name   HA )  ( resid   84 and name HG1# ) 5.50 3.70 0.00 
assign ( resid   26 and name   HN )  ( resid   26 and name  HB1 ) 2.90 1.10 0.00 
assign ( resid   26 and name   HN )  ( resid   26 and name  HB2 ) 2.85 1.05 0.00 
assign ( resid   26 and name   HN )  ( resid   27 and name   HN ) 2.97 1.17 0.00 
assign ( resid   26 and name   HN )  ( resid   28 and name   HN ) 4.62 2.82 0.00 
assign ( resid   26 and name   HN )  ( resid   29 and name  HB# ) 5.34 3.54 0.00 
assign ( resid   26 and name   HN )  ( resid   30 and name HD1# ) 5.50 3.70 0.00 
assign ( resid   26 and name   HN )  ( resid   61 and name HG2# ) 4.11 2.31 0.00 
assign ( resid   26 and name   HN )  ( resid   80 and name  HB2 ) 4.93 3.13 0.00 
assign ( resid   26 and name  HB1 )  ( resid   27 and name   HN ) 3.11 1.31 0.00 
assign ( resid   26 and name  HB1 )  ( resid   28 and name   HN ) 4.87 3.07 0.00 
assign ( resid   26 and name  HB1 )  ( resid   61 and name HG2# ) 4.52 2.72 0.00 
assign ( resid   26 and name  HB2 )  ( resid   27 and name   HN ) 3.91 2.11 0.00 
assign ( resid   26 and name  HB2 )  ( resid   28 and name   HN ) 5.50 3.70 0.00 
assign ( resid   26 and name  HB2 )  ( resid   84 and name HG1# ) 3.79 1.99 0.00 
assign ( resid   26 and name  HG1 )  ( resid   30 and name HD1# ) 3.77 1.97 0.00 
assign ( resid   26 and name  HG2 )  ( resid   30 and name HD1# ) 3.77 1.97 0.00 
assign ( resid   26 and name  HG# )  ( resid   27 and name   HN ) 4.23 2.43 0.00 
assign ( resid   26 and name  HG# )  ( resid   30 and name   HN ) 4.16 2.36 0.00 
assign ( resid   26 and name  HG# )  ( resid   30 and name HG11 ) 5.24 3.44 0.00 
assign ( resid   26 and name  HG# )  ( resid   61 and name   HA ) 5.22 3.42 0.00 
assign ( resid   26 and name  HG# )  ( resid   61 and name HG2# ) 4.38 2.58 0.00 
assign ( resid   26 and name  HG# )  ( resid   64 and name  HG# ) 5.13 3.33 0.00 
assign ( resid   26 and name  HG# )  ( resid   84 and name HG1# ) 5.34 3.54 0.00 
assign ( resid   26 and name   HA )  ( resid   26 and name  HE# ) 4.00 2.20 0.00
assign ( resid   26 and name  HB2 )  ( resid   26 and name  HE# ) 3.77 1.97 0.00
assign ( resid   26 and name  HE# )  ( resid   29 and name  HB# ) 4.47 2.67 0.00
assign ( resid   26 and name  HE# )  ( resid   29 and name  HD# ) 3.17 1.37 0.00
assign ( resid   26 and name  HE# )  ( resid   29 and name  HE# ) 3.68 1.88 0.00
assign ( resid   26 and name  HE# )  ( resid   29 and name   HZ ) 4.24 2.44 0.00
assign ( resid   26 and name  HE# )  ( resid   30 and name   HA ) 5.27 3.47 0.00
assign ( resid   26 and name  HE# )  ( resid   30 and name HD1# ) 4.07 2.27 0.00
assign ( resid   26 and name  HE# )  ( resid   30 and name HG1# ) 3.55 1.75 0.00
assign ( resid   26 and name  HE# )  ( resid   30 and name   HN ) 5.06 3.26 0.00
assign ( resid   26 and name  HE# )  ( resid   64 and name HG1# ) 3.15 1.35 0.00 
assign ( resid   26 and name  HE# )  ( resid   80 and name   HA ) 4.60 2.80 0.00
assign ( resid   26 and name  HE# )  ( resid   84 and name HG2# ) 4.11 2.31 0.00 
assign ( resid   26 and name  HE# )  ( resid   84 and name HG1# ) 3.33 1.53 0.00 
assign ( resid   26 and name  HE# )  ( resid   84 and name   HN ) 5.36 3.56 0.00
assign ( resid   26 and name  HE# )  ( resid   85 and name   HA ) 4.51 2.71 0.00
assign ( resid   26 and name  HE# )  ( resid   85 and name  HG# ) 4.63 2.83 0.00
assign ( resid   26 and name  HE# )  ( resid   85 and name   HN ) 4.59 2.79 0.00
assign ( resid   26 and name  HE# )  ( resid   86 and name   HN ) 5.50 3.70 0.00
assign ( resid   26 and name  HE# )  ( resid   88 and name   HA ) 5.50 3.70 0.00
assign ( resid   26 and name  HE# )  ( resid   88 and name   HB ) 3.93 2.13 0.00
assign ( resid   26 and name  HE# )  ( resid   88 and name HG2# ) 3.43 1.63 0.00
assign ( resid   26 and name  HE# )  ( resid   88 and name   HN ) 3.90 2.10 0.00
assign ( resid   26 and name  HE# )  ( resid   89 and name   HA ) 5.50 3.70 0.00
assign ( resid   26 and name  HE# )  ( resid   89 and name   HN ) 4.23 2.43 0.00
assign ( resid   26 and name  HG2 )  ( resid   26 and name  HE# ) 3.73 1.93 0.00
assign ( resid   27 and name   HA )  ( resid   27 and name  HB# ) 2.90 1.10 0.00 
assign ( resid   27 and name   HA )  ( resid   30 and name   HB ) 3.72 1.92 0.00 
assign ( resid   27 and name   HA )  ( resid   30 and name   HN ) 3.62 1.82 0.00 
assign ( resid   27 and name   HA )  ( resid   30 and name HD1# ) 4.38 2.58 0.00 
assign ( resid   27 and name   HA )  ( resid   30 and name HG2# ) 4.89 3.09 0.00 
assign ( resid   27 and name   HA )  ( resid   31 and name   HN ) 4.05 2.25 0.00 
assign ( resid   27 and name   HA )  ( resid   31 and name  HG# ) 4.32 2.52 0.00 
assign ( resid   27 and name   HA )  ( resid   61 and name HG2# ) 4.69 2.89 0.00 
assign ( resid   27 and name   HN )  ( resid   27 and name   HA ) 2.78 0.98 0.00 
assign ( resid   27 and name   HN )  ( resid   27 and name  HB# ) 2.78 0.98 0.00 
assign ( resid   27 and name   HN )  ( resid   28 and name   HN ) 2.98 1.18 0.00 
assign ( resid   27 and name   HN )  ( resid   28 and name  HG# ) 4.89 3.09 0.00 
assign ( resid   27 and name   HN )  ( resid   29 and name   HN ) 4.47 2.67 0.00 
assign ( resid   27 and name   HN )  ( resid   29 and name  HB# ) 5.25 3.45 0.00 
assign ( resid   27 and name   HN )  ( resid   30 and name   HN ) 4.92 3.12 0.00 
assign ( resid   27 and name   HN )  ( resid   30 and name HD1# ) 4.45 2.65 0.00 
assign ( resid   27 and name   HN )  ( resid   31 and name   HN ) 5.50 3.70 0.00 
assign ( resid   27 and name   HN )  ( resid   61 and name HG2# ) 3.41 1.61 0.00 
assign ( resid   27 and name  HB# )  ( resid   28 and name   HN ) 3.12 1.32 0.00 
assign ( resid   27 and name  HB# )  ( resid   30 and name HG2# ) 5.50 3.70 0.00 
assign ( resid   27 and name  HB# )  ( resid   31 and name  HG# ) 3.87 2.07 0.00 
assign ( resid   27 and name  HB# )  ( resid   61 and name HG2# ) 4.10 2.30 0.00 
assign ( resid   28 and name   HA )  ( resid   28 and name  HB# ) 2.91 1.11 0.00 
assign ( resid   28 and name   HA )  ( resid   28 and name  HG1 ) 3.81 2.01 0.00 
assign ( resid   28 and name   HA )  ( resid   28 and name  HG2 ) 3.81 2.01 0.00 
assign ( resid   28 and name   HA )  ( resid   28 and name  HG# ) 3.26 1.46 0.00 
assign ( resid   28 and name   HA )  ( resid   29 and name   HA ) 5.08 3.28 0.00 
assign ( resid   28 and name   HA )  ( resid   31 and name   HB ) 3.93 2.13 0.00  
assign ( resid   28 and name   HA )  ( resid   31 and name   HN ) 4.07 2.27 0.00 
assign ( resid   28 and name   HA )  ( resid   31 and name  HG# ) 3.56 1.76 0.00 
assign ( resid   28 and name   HN )  ( resid   28 and name  HB# ) 2.63 0.83 0.00 
assign ( resid   28 and name   HN )  ( resid   28 and name  HG1 ) 3.59 1.79 0.00 
assign ( resid   28 and name   HN )  ( resid   28 and name  HG2 ) 3.59 1.79 0.00 
assign ( resid   28 and name   HN )  ( resid   28 and name  HG# ) 2.98 1.18 0.00 
assign ( resid   28 and name   HN )  ( resid   29 and name   HA ) 5.40 3.60 0.00 
assign ( resid   28 and name   HN )  ( resid   29 and name   HN ) 2.89 1.09 0.00 
assign ( resid   28 and name   HN )  ( resid   29 and name  HB# ) 4.59 2.79 0.00 
assign ( resid   28 and name   HN )  ( resid   30 and name   HN ) 4.27 2.47 0.00 
assign ( resid   28 and name   HN )  ( resid   30 and name HD1# ) 5.50 3.70 0.00 
assign ( resid   28 and name   HN )  ( resid   31 and name   HN ) 4.82 3.02 0.00 
assign ( resid   28 and name   HN )  ( resid   31 and name  HG# ) 4.51 2.71 0.00 
assign ( resid   28 and name  HB# )  ( resid   29 and name   HN ) 2.83 1.03 0.00 
assign ( resid   28 and name  HG# )  ( resid   29 and name   HN ) 4.56 2.76 0.00 
assign ( resid   29 and name   HA )  ( resid   29 and name  HD# ) 3.17 1.37 0.00 
assign ( resid   29 and name   HA )  ( resid   29 and name  HE# ) 4.86 3.06 0.00 
assign ( resid   29 and name   HA )  ( resid   31 and name   HN ) 5.46 3.66 0.00 
assign ( resid   29 and name   HA )  ( resid   32 and name  HB1 ) 3.82 2.02 0.00 
assign ( resid   29 and name   HA )  ( resid   32 and name  HB2 ) 3.89 2.09 0.00 
assign ( resid   29 and name   HA )  ( resid   32 and name  HG1 ) 5.24 3.44 0.00 
assign ( resid   29 and name   HA )  ( resid   32 and name  HG2 ) 5.24 3.44 0.00 
assign ( resid   29 and name   HA )  ( resid   32 and name  HG# ) 4.54 2.74 0.00 
assign ( resid   29 and name   HN )  ( resid   29 and name  HB# ) 2.46 0.66 0.00 
assign ( resid   29 and name   HN )  ( resid   29 and name  HD# ) 4.34 2.54 0.00 
assign ( resid   29 and name   HN )  ( resid   30 and name   HN ) 2.96 1.16 0.00 
assign ( resid   29 and name   HN )  ( resid   31 and name   HN ) 4.72 2.92 0.00 
assign ( resid   29 and name   HZ )  ( resid   85 and name   HA ) 4.03 2.23 0.00 
assign ( resid   29 and name   HZ )  ( resid   85 and name  HB1 ) 4.09 2.29 0.00 
assign ( resid   29 and name   HZ )  ( resid   85 and name  HB2 ) 5.17 3.37 0.00 
assign ( resid   29 and name   HZ )  ( resid   85 and name  HG1 ) 5.12 3.32 0.00 
assign ( resid   29 and name   HZ )  ( resid   85 and name  HG2 ) 5.12 3.32 0.00 
assign ( resid   29 and name   HZ )  ( resid   85 and name  HG# ) 4.25 2.45 0.00 
assign ( resid   29 and name   HZ )  ( resid   86 and name   HA ) 5.38 3.58 0.00 
assign ( resid   29 and name   HZ )  ( resid   88 and name   HB ) 4.55 2.75 0.00 
assign ( resid   29 and name   HZ )  ( resid   88 and name HG2# ) 5.40 3.60 0.00 
assign ( resid   29 and name   HZ )  ( resid   89 and name   HA ) 5.04 3.24 0.00 
assign ( resid   29 and name   HZ )  ( resid   89 and name   HN ) 3.87 2.07 0.00 
assign ( resid   29 and name   HZ )  ( resid   89 and name  HB1 ) 3.33 1.53 0.00 
assign ( resid   29 and name   HZ )  ( resid   89 and name  HB2 ) 4.69 2.89 0.00 
assign ( resid   29 and name   HZ )  ( resid   89 and name  HD# ) 3.88 2.08 0.00 
assign ( resid   29 and name   HZ )  ( resid   89 and name  HE# ) 4.42 2.62 0.00 
assign ( resid   29 and name   HZ )  ( resid   89 and name  HG1 ) 5.50 3.70 0.00 
assign ( resid   29 and name   HZ )  ( resid   89 and name  HG2 ) 4.17 2.37 0.00 
assign ( resid   29 and name  HB# )  ( resid   30 and name   HN ) 2.87 1.07 0.00 
assign ( resid   29 and name  HB# )  ( resid   30 and name HG11 ) 4.62 2.82 0.00 
assign ( resid   29 and name  HB# )  ( resid   85 and name  HD# ) 5.15 3.35 0.00 
assign ( resid   29 and name  HB# )  ( resid   85 and name  HE1 ) 5.50 3.70 0.00 
assign ( resid   29 and name  HB# )  ( resid   85 and name  HE2 ) 5.50 3.70 0.00 
assign ( resid   29 and name  HD# )  ( resid   30 and name   HN ) 3.79 1.99 0.00 
assign ( resid   29 and name  HD# )  ( resid   30 and name HD1# ) 4.43 2.63 0.00 
assign ( resid   29 and name  HD# )  ( resid   30 and name HG12 ) 3.97 2.17 0.00 
assign ( resid   29 and name  HD# )  ( resid   31 and name   HN ) 5.50 3.70 0.00 
assign ( resid   29 and name  HD# )  ( resid   85 and name  HD# ) 4.62 2.82 0.00 
assign ( resid   29 and name  HD# )  ( resid   85 and name  HE# ) 4.32 2.52 0.00 
assign ( resid   29 and name  HD# )  ( resid   85 and name  HG# ) 4.27 2.47 0.00 
assign ( resid   29 and name  HD# )  ( resid   88 and name   HB ) 3.68 1.88 0.00 
assign ( resid   29 and name  HD# )  ( resid   88 and name HG2# ) 3.37 1.57 0.00 
assign ( resid   29 and name  HD# )  ( resid   89 and name   HA ) 5.32 3.52 0.00 
assign ( resid   29 and name  HD# )  ( resid   89 and name  HG2 ) 5.50 3.70 0.00 
assign ( resid   29 and name  HE# )  ( resid   29 and name   HZ ) 2.40 0.60 0.00 
assign ( resid   29 and name  HE# )  ( resid   85 and name   HA ) 3.52 1.72 0.00 
assign ( resid   29 and name  HE# )  ( resid   85 and name   HN ) 5.49 3.69 0.00 
assign ( resid   29 and name  HE# )  ( resid   85 and name  HB1 ) 5.50 3.70 0.00 
assign ( resid   29 and name  HE# )  ( resid   85 and name  HB2 ) 5.50 3.70 0.00 
assign ( resid   29 and name  HE# )  ( resid   85 and name  HD# ) 3.38 1.58 0.00 
assign ( resid   29 and name  HE# )  ( resid   85 and name  HE1 ) 5.50 3.70 0.00 
assign ( resid   29 and name  HE# )  ( resid   85 and name  HE2 ) 5.50 3.70 0.00 
assign ( resid   29 and name  HE# )  ( resid   85 and name  HG# ) 3.26 1.46 0.00 
assign ( resid   29 and name  HE# )  ( resid   86 and name   HN ) 5.50 3.70 0.00 
assign ( resid   29 and name  HE# )  ( resid   88 and name   HA ) 5.50 3.70 0.00 
assign ( resid   29 and name  HE# )  ( resid   88 and name   HB ) 3.05 1.25 0.00 
assign ( resid   29 and name  HE# )  ( resid   88 and name   HN ) 4.40 2.60 0.00 
assign ( resid   29 and name  HE# )  ( resid   88 and name HG2# ) 3.17 1.37 0.00 
assign ( resid   29 and name  HE# )  ( resid   89 and name   HA ) 4.23 2.43 0.00 
assign ( resid   29 and name  HE# )  ( resid   89 and name  HB1 ) 3.26 1.46 0.00 
assign ( resid   29 and name  HE# )  ( resid   89 and name  HB2 ) 4.73 2.93 0.00 
assign ( resid   29 and name  HE# )  ( resid   89 and name  HD# ) 4.14 2.34 0.00 
assign ( resid   29 and name  HE# )  ( resid   89 and name  HG1 ) 4.23 2.43 0.00 
assign ( resid   29 and name  HE# )  ( resid   90 and name   HN ) 5.15 3.35 0.00 
assign ( resid   30 and name   HA )  ( resid   30 and name HD1# ) 4.06 2.26 0.00 
assign ( resid   30 and name   HA )  ( resid   30 and name HG11 ) 3.55 1.75 0.00 
assign ( resid   30 and name   HA )  ( resid   30 and name HG12 ) 3.83 2.03 0.00 
assign ( resid   30 and name   HA )  ( resid   30 and name HG2# ) 3.69 1.89 0.00 
assign ( resid   30 and name   HA )  ( resid   32 and name   HN ) 4.34 2.54 0.00 
assign ( resid   30 and name   HA )  ( resid   33 and name   HN ) 3.29 1.49 0.00 
assign ( resid   30 and name   HA )  ( resid   33 and name  HB1 ) 4.31 2.51 0.00 
assign ( resid   30 and name   HA )  ( resid   33 and name  HB2 ) 4.31 2.51 0.00 
assign ( resid   30 and name   HA )  ( resid   33 and name  HB# ) 3.60 1.80 0.00 
assign ( resid   30 and name   HA )  ( resid   34 and name   HN ) 4.50 2.70 0.00 
assign ( resid   30 and name   HA )  ( resid   60 and name HD1# ) 5.50 3.70 0.00 
assign ( resid   30 and name   HA )  ( resid   88 and name HG2# ) 3.94 2.14 0.00 
assign ( resid   30 and name   HA )  ( resid   92 and name HD1# ) 4.14 2.34 0.00 
assign ( resid   30 and name   HB )  ( resid   30 and name HD1# ) 3.56 1.76 0.00 
assign ( resid   30 and name   HB )  ( resid   31 and name   HN ) 2.97 1.17 0.00 
assign ( resid   30 and name   HB )  ( resid   57 and name  HB# ) 5.50 3.70 0.00 
assign ( resid   30 and name   HB )  ( resid   61 and name   HA ) 5.50 3.70 0.00 
assign ( resid   30 and name   HN )  ( resid   30 and name   HB ) 2.58 0.78 0.00 
assign ( resid   30 and name   HN )  ( resid   30 and name HG11 ) 3.11 1.31 0.00 
assign ( resid   30 and name   HN )  ( resid   30 and name HG2# ) 3.90 2.10 0.00 
assign ( resid   30 and name   HN )  ( resid   31 and name   HA ) 5.28 3.48 0.00 
assign ( resid   30 and name   HN )  ( resid   31 and name   HN ) 3.10 1.30 0.00 
assign ( resid   30 and name   HN )  ( resid   32 and name   HN ) 4.38 2.58 0.00 
assign ( resid   30 and name   HN )  ( resid   33 and name  HB# ) 5.29 3.49 0.00 
assign ( resid   30 and name HD1# )  ( resid   60 and name   HA ) 4.80 3.00 0.00 
assign ( resid   30 and name HD1# )  ( resid   60 and name   HN ) 4.57 2.77 0.00 
assign ( resid   30 and name HD1# )  ( resid   60 and name  HB1 ) 3.78 1.98 0.00 
assign ( resid   30 and name HD1# )  ( resid   60 and name  HB2 ) 3.68 1.88 0.00 
assign ( resid   30 and name HD1# )  ( resid   60 and name HD1# ) 4.53 2.73 0.00 
assign ( resid   30 and name HD1# )  ( resid   60 and name HD2# ) 4.92 3.12 0.00 
assign ( resid   30 and name HD1# )  ( resid   61 and name   HA ) 3.36 1.56 0.00 
assign ( resid   30 and name HD1# )  ( resid   61 and name   HB ) 4.58 2.78 0.00 
assign ( resid   30 and name HD1# )  ( resid   61 and name   HN ) 3.00 1.20 0.00 
assign ( resid   30 and name HD1# )  ( resid   61 and name HG2# ) 4.06 2.26 0.00 
assign ( resid   30 and name HD1# )  ( resid   62 and name   HA ) 5.50 3.70 0.00 
assign ( resid   30 and name HD1# )  ( resid   62 and name   HN ) 4.28 2.48 0.00 
assign ( resid   30 and name HD1# )  ( resid   63 and name   HN ) 4.85 3.05 0.00 
assign ( resid   30 and name HD1# )  ( resid   64 and name   HB ) 4.22 2.42 0.00 
assign ( resid   30 and name HD1# )  ( resid   64 and name   HN ) 4.26 2.46 0.00 
assign ( resid   30 and name HD1# )  ( resid   64 and name  HG# ) 3.76 1.96 0.00 
assign ( resid   30 and name HD1# )  ( resid   88 and name HG2# ) 3.87 2.07 0.00 
assign ( resid   30 and name HG11 )  ( resid   88 and name HG2# ) 4.74 2.94 0.00 
assign ( resid   30 and name HG12 )  ( resid   61 and name   HA ) 5.50 3.70 0.00 
assign ( resid   30 and name HG12 )  ( resid   88 and name HG2# ) 3.71 1.91 0.00 
assign ( resid   30 and name HG2# )  ( resid   30 and name HD1# ) 2.50 0.70 0.00 
assign ( resid   30 and name HG2# )  ( resid   30 and name HG11 ) 3.78 1.98 0.00 
assign ( resid   30 and name HG2# )  ( resid   30 and name HG12 ) 3.99 2.19 0.00 
assign ( resid   30 and name HG2# )  ( resid   31 and name   HA ) 4.98 3.18 0.00 
assign ( resid   30 and name HG2# )  ( resid   31 and name   HN ) 3.36 1.56 0.00 
assign ( resid   30 and name HG2# )  ( resid   32 and name   HN ) 4.96 3.16 0.00 
assign ( resid   30 and name HG2# )  ( resid   34 and name   HG ) 3.88 2.08 0.00 
assign ( resid   30 and name HG2# )  ( resid   34 and name  HD# ) 3.18 1.38 0.00 
assign ( resid   30 and name HG2# )  ( resid   34 and name HD1# ) 3.93 2.13 0.00 
assign ( resid   30 and name HG2# )  ( resid   34 and name HD2# ) 3.93 2.13 0.00 
assign ( resid   30 and name HG2# )  ( resid   35 and name   HN ) 5.50 3.70 0.00 
assign ( resid   30 and name HG2# )  ( resid   57 and name   HA ) 3.55 1.75 0.00 
assign ( resid   30 and name HG2# )  ( resid   57 and name  HB# ) 3.54 1.74 0.00 
assign ( resid   30 and name HG2# )  ( resid   60 and name   HA ) 5.50 3.70 0.00 
assign ( resid   30 and name HG2# )  ( resid   60 and name   HG ) 4.81 3.01 0.00 
assign ( resid   30 and name HG2# )  ( resid   60 and name  HB1 ) 4.04 2.24 0.00 
assign ( resid   30 and name HG2# )  ( resid   60 and name  HB2 ) 3.71 1.91 0.00 
assign ( resid   30 and name HG2# )  ( resid   60 and name HD1# ) 3.73 1.93 0.00 
assign ( resid   31 and name   HA )  ( resid   31 and name  HG# ) 2.87 1.07 0.00 
assign ( resid   31 and name   HA )  ( resid   31 and name HG1# ) 3.33 1.53 0.00 
assign ( resid   31 and name   HA )  ( resid   31 and name HG2# ) 3.33 1.53 0.00 
assign ( resid   31 and name   HA )  ( resid   34 and name   HG ) 5.50 3.70 0.00 
assign ( resid   31 and name   HA )  ( resid   34 and name   HN ) 3.65 1.85 0.00 
assign ( resid   31 and name   HA )  ( resid   34 and name  HB1 ) 4.93 3.13 0.00 
assign ( resid   31 and name   HA )  ( resid   34 and name  HB2 ) 4.10 2.30 0.00 
assign ( resid   31 and name   HA )  ( resid   34 and name  HD# ) 4.52 2.72 0.00 
assign ( resid   31 and name   HA )  ( resid   53 and name   HZ ) 4.46 2.66 0.00 
assign ( resid   31 and name   HA )  ( resid   53 and name  HD# ) 5.50 3.70 0.00 
assign ( resid   31 and name   HA )  ( resid   53 and name  HE# ) 4.21 2.41 0.00 
assign ( resid   31 and name   HA )  ( resid   57 and name  HB# ) 5.10 3.30 0.00 
assign ( resid   31 and name   HB )  ( resid   32 and name   HN ) 2.60 0.80 0.00 
assign ( resid   31 and name   HB )  ( resid   57 and name  HB# ) 5.50 3.70 0.00 
assign ( resid   31 and name   HN )  ( resid   31 and name   HB ) 2.56 0.76 0.00 
assign ( resid   31 and name   HN )  ( resid   31 and name HG2# ) 2.69 0.89 0.00 
assign ( resid   31 and name   HN )  ( resid   32 and name   HN ) 2.97 1.17 0.00 
assign ( resid   31 and name   HN )  ( resid   32 and name  HB# ) 5.30 3.50 0.00 
assign ( resid   31 and name   HN )  ( resid   33 and name   HN ) 5.07 3.27 0.00 
assign ( resid   31 and name   HN )  ( resid   34 and name   HN ) 5.04 3.24 0.00 
assign ( resid   31 and name   HN )  ( resid   34 and name  HB2 ) 5.36 3.56 0.00 
assign ( resid   31 and name   HN )  ( resid   34 and name  HD# ) 5.44 3.64 0.00 
assign ( resid   31 and name   HN )  ( resid   53 and name  HE# ) 5.50 3.70 0.00 
assign ( resid   31 and name  HG# )  ( resid   32 and name   HA ) 4.67 2.87 0.00 
assign ( resid   31 and name  HG# )  ( resid   32 and name   HN ) 3.49 1.69 0.00 
assign ( resid   31 and name  HG# )  ( resid   32 and name  HG# ) 5.26 3.46 0.00 
assign ( resid   31 and name  HG# )  ( resid   34 and name   HN ) 4.84 3.04 0.00 
assign ( resid   31 and name  HG# )  ( resid   35 and name   HN ) 4.74 2.94 0.00 
assign ( resid   31 and name  HG# )  ( resid   35 and name HD21 ) 3.70 1.90 0.00 
assign ( resid   31 and name  HG# )  ( resid   35 and name HD22 ) 4.18 2.38 0.00 
assign ( resid   31 and name  HG# )  ( resid   53 and name  HE# ) 3.20 1.40 0.00 
assign ( resid   31 and name  HG# )  ( resid   57 and name   HA ) 4.13 2.33 0.00 
assign ( resid   31 and name  HG# )  ( resid   57 and name  HB# ) 3.38 1.58 0.00 
assign ( resid   31 and name HG1# )  ( resid   32 and name   HN ) 4.80 3.00 0.00 
assign ( resid   31 and name HG1# )  ( resid   53 and name   HZ ) 3.93 2.13 0.00 
assign ( resid   31 and name HG1# )  ( resid   53 and name  HE# ) 3.74 1.94 0.00 
assign ( resid   31 and name HG2# )  ( resid   32 and name   HN ) 4.80 3.00 0.00 
assign ( resid   31 and name HG2# )  ( resid   53 and name   HZ ) 3.93 2.13 0.00 
assign ( resid   31 and name HG2# )  ( resid   53 and name  HE# ) 3.74 1.94 0.00 
assign ( resid   32 and name   HA )  ( resid   32 and name  HG1 ) 3.78 1.98 0.00 
assign ( resid   32 and name   HA )  ( resid   32 and name  HG2 ) 3.78 1.98 0.00 
assign ( resid   32 and name   HA )  ( resid   35 and name  HB1 ) 4.69 2.89 0.00 
assign ( resid   32 and name   HA )  ( resid   35 and name  HB2 ) 4.12 2.32 0.00 
assign ( resid   32 and name   HA )  ( resid   35 and name HD21 ) 4.24 2.44 0.00 
assign ( resid   32 and name   HA )  ( resid   35 and name HD22 ) 3.72 1.92 0.00 
assign ( resid   32 and name   HN )  ( resid   32 and name   HA ) 2.88 1.08 0.00 
assign ( resid   32 and name   HN )  ( resid   32 and name  HB# ) 2.77 0.97 0.00 
assign ( resid   32 and name   HN )  ( resid   32 and name  HG# ) 3.80 2.00 0.00  
assign ( resid   32 and name   HN )  ( resid   33 and name   HN ) 2.70 0.90 0.00 
assign ( resid   32 and name   HN )  ( resid   33 and name  HB# ) 4.47 2.67 0.00 
assign ( resid   32 and name   HN )  ( resid   34 and name   HN ) 4.10 2.30 0.00 
assign ( resid   32 and name   HN )  ( resid   35 and name  HB2 ) 5.32 3.52 0.00 
assign ( resid   32 and name  HB1 )  ( resid   33 and name   HA ) 5.50 3.70 0.00 
assign ( resid   32 and name  HB2 )  ( resid   33 and name   HA ) 5.50 3.70 0.00 
assign ( resid   32 and name  HB# )  ( resid   34 and name   HN ) 5.34 3.54 0.00 
assign ( resid   32 and name  HG# )  ( resid   33 and name   HN ) 5.07 3.27 0.00 
assign ( resid   33 and name   HA )  ( resid   36 and name  HG# ) 5.00 3.20 0.00 
assign ( resid   33 and name   HA )  ( resid   37 and name  HD# ) 5.50 3.70 0.00 
assign ( resid   33 and name   HA )  ( resid   37 and name  HE# ) 4.21 2.41 0.00 
assign ( resid   33 and name   HN )  ( resid   33 and name  HB1 ) 3.54 1.74 0.00 
assign ( resid   33 and name   HN )  ( resid   33 and name  HB2 ) 3.54 1.74 0.00 
assign ( resid   33 and name   HN )  ( resid   33 and name  HB# ) 2.84 1.04 0.00 
assign ( resid   33 and name   HN )  ( resid   34 and name   HG ) 5.04 3.24 0.00 
assign ( resid   33 and name   HN )  ( resid   34 and name   HN ) 2.71 0.91 0.00 
assign ( resid   33 and name  HB1 )  ( resid   34 and name   HN ) 3.57 1.77 0.00 
assign ( resid   33 and name  HB1 )  ( resid   92 and name HD1# ) 3.93 2.13 0.00 
assign ( resid   33 and name  HB1 )  ( resid   92 and name HG2# ) 4.48 2.68 0.00 
assign ( resid   33 and name  HB2 )  ( resid   34 and name   HN ) 3.57 1.77 0.00 
assign ( resid   33 and name  HB2 )  ( resid   92 and name HD1# ) 3.93 2.13 0.00 
assign ( resid   33 and name  HB2 )  ( resid   92 and name HG2# ) 4.48 2.68 0.00 
assign ( resid   33 and name  HB# )  ( resid   34 and name   HN ) 2.98 1.18 0.00 
assign ( resid   33 and name  HB# )  ( resid   34 and name  HD# ) 5.28 3.48 0.00 
assign ( resid   33 and name  HB# )  ( resid   37 and name  HE# ) 3.91 2.11 0.00 
assign ( resid   33 and name  HB# )  ( resid   92 and name   HB ) 5.34 3.54 0.00 
assign ( resid   33 and name  HB# )  ( resid   92 and name HD1# ) 3.43 1.63 0.00 
assign ( resid   33 and name  HB# )  ( resid   92 and name HG2# ) 3.72 1.92 0.00 
assign ( resid   34 and name   HA )  ( resid   34 and name  HD# ) 3.43 1.63 0.00 
assign ( resid   34 and name   HA )  ( resid   37 and name   HN ) 3.43 1.63 0.00 
assign ( resid   34 and name   HA )  ( resid   37 and name  HB1 ) 5.04 3.24 0.00 
assign ( resid   34 and name   HA )  ( resid   37 and name  HB2 ) 5.50 3.70 0.00 
assign ( resid   34 and name   HA )  ( resid   37 and name  HD# ) 2.54 0.74 0.00 
assign ( resid   34 and name   HA )  ( resid   37 and name  HE# ) 3.77 1.97 0.00 
assign ( resid   34 and name   HA )  ( resid   92 and name HG2# ) 5.50 3.70 0.00 
assign ( resid   34 and name   HG )  ( resid   37 and name  HE# ) 5.50 3.70 0.00 
assign ( resid   34 and name   HG )  ( resid   47 and name HD1# ) 5.11 3.31 0.00 
assign ( resid   34 and name   HG )  ( resid   57 and name  HB# ) 5.22 3.42 0.00 
assign ( resid   34 and name   HG )  ( resid   92 and name HD1# ) 4.69 2.89 0.00 
assign ( resid   34 and name   HN )  ( resid   34 and name   HG ) 3.08 1.28 0.00 
assign ( resid   34 and name   HN )  ( resid   34 and name  HB1 ) 3.76 1.96 0.00 
assign ( resid   34 and name   HN )  ( resid   34 and name  HB2 ) 2.66 0.86 0.00 
assign ( resid   34 and name   HN )  ( resid   34 and name  HD# ) 3.48 1.68 0.00 
assign ( resid   34 and name   HN )  ( resid   34 and name HD1# ) 4.20 2.40 0.00 
assign ( resid   34 and name   HN )  ( resid   34 and name HD2# ) 4.20 2.40 0.00 
assign ( resid   34 and name   HN )  ( resid   36 and name  HD1 ) 5.09 3.29 0.00 
assign ( resid   34 and name   HN )  ( resid   36 and name  HD2 ) 4.68 2.88 0.00 
assign ( resid   34 and name   HN )  ( resid   36 and name  HG# ) 5.12 3.32 0.00 
assign ( resid   34 and name   HN )  ( resid   53 and name  HE# ) 5.15 3.35 0.00 
assign ( resid   34 and name   HN )  ( resid   92 and name HD1# ) 4.59 2.79 0.00 
assign ( resid   34 and name  HB1 )  ( resid   34 and name HD1# ) 3.87 2.07 0.00 
assign ( resid   34 and name  HB1 )  ( resid   34 and name HD2# ) 3.87 2.07 0.00 
assign ( resid   34 and name  HB1 )  ( resid   47 and name HD1# ) 4.81 3.01 0.00 
assign ( resid   34 and name  HB1 )  ( resid   53 and name  HD# ) 3.82 2.02 0.00 
assign ( resid   34 and name  HB1 )  ( resid   53 and name  HE# ) 4.03 2.23 0.00 
assign ( resid   34 and name  HB1 )  ( resid   57 and name  HB# ) 5.50 3.70 0.00 
assign ( resid   34 and name  HB2 )  ( resid   47 and name HD1# ) 4.63 2.83 0.00 
assign ( resid   34 and name  HB2 )  ( resid   53 and name   HZ ) 4.17 2.37 0.00 
assign ( resid   34 and name  HB2 )  ( resid   53 and name  HE# ) 3.44 1.64 0.00 
assign ( resid   34 and name  HB2 )  ( resid   56 and name  HD# ) 5.44 3.64 0.00 
assign ( resid   34 and name  HD# )  ( resid   35 and name   HN ) 5.44 3.64 0.00 
assign ( resid   34 and name  HD# )  ( resid   37 and name   HN ) 4.67 2.87 0.00 
assign ( resid   34 and name  HD# )  ( resid   37 and name  HB1 ) 5.44 3.64 0.00 
assign ( resid   34 and name  HD# )  ( resid   37 and name  HB2 ) 5.44 3.64 0.00 
assign ( resid   34 and name  HD# )  ( resid   37 and name  HD# ) 3.19 1.39 0.00 
assign ( resid   34 and name  HD# )  ( resid   37 and name  HE# ) 3.93 2.13 0.00 
assign ( resid   34 and name  HD# )  ( resid   47 and name HD1# ) 3.26 1.46 0.00 
assign ( resid   34 and name  HD# )  ( resid   53 and name   HN ) 5.44 3.64 0.00 
assign ( resid   34 and name  HD# )  ( resid   53 and name  HD# ) 4.37 2.57 0.00 
assign ( resid   34 and name  HD# )  ( resid   53 and name  HE# ) 4.48 2.68 0.00 
assign ( resid   34 and name  HD# )  ( resid   56 and name   HN ) 5.08 3.28 0.00 
assign ( resid   34 and name  HD# )  ( resid   56 and name  HB1 ) 3.76 1.96 0.00 
assign ( resid   34 and name  HD# )  ( resid   56 and name  HD# ) 3.13 1.33 0.00 
assign ( resid   34 and name  HD# )  ( resid   57 and name   HA ) 3.53 1.73 0.00 
assign ( resid   34 and name  HD# )  ( resid   57 and name   HN ) 3.36 1.56 0.00 
assign ( resid   34 and name  HD# )  ( resid   57 and name  HB# ) 3.37 1.57 0.00 
assign ( resid   34 and name  HD# )  ( resid   58 and name   HN ) 4.87 3.07 0.00 
assign ( resid   34 and name  HD# )  ( resid   59 and name   HN ) 5.44 3.64 0.00 
assign ( resid   34 and name  HD# )  ( resid   60 and name HD1# ) 3.87 2.07 0.00 
assign ( resid   34 and name  HD# )  ( resid   92 and name HD1# ) 4.29 2.49 0.00 
assign ( resid   34 and name  HD# )  ( resid   92 and name HG2# ) 3.24 1.44 0.00 
assign ( resid   34 and name  HD# )  ( resid   96 and name   HN ) 5.44 3.64 0.00 
assign ( resid   34 and name  HD# )  ( resid   96 and name  HE# ) 3.75 1.95 0.00 
assign ( resid   34 and name  HD# )  ( resid   96 and name  HG# ) 5.28 3.48 0.00 
assign ( resid   34 and name HD1# )  ( resid   47 and name HD1# ) 3.84 2.04 0.00 
assign ( resid   34 and name HD1# )  ( resid   53 and name  HE# ) 5.50 3.70 0.00 
assign ( resid   34 and name HD1# )  ( resid   92 and name HG2# ) 4.15 2.35 0.00 
assign ( resid   34 and name HD1# )  ( resid   96 and name  HE# ) 4.90 3.10 0.00 
assign ( resid   34 and name HD2# )  ( resid   47 and name HD1# ) 3.84 2.04 0.00 
assign ( resid   34 and name HD2# )  ( resid   53 and name  HE# ) 5.50 3.70 0.00 
assign ( resid   34 and name HD2# )  ( resid   92 and name HG2# ) 4.15 2.35 0.00 
assign ( resid   34 and name HD2# )  ( resid   96 and name  HE# ) 4.90 3.10 0.00 
assign ( resid   35 and name   HA )  ( resid   35 and name HD21 ) 3.67 1.87 0.00 
assign ( resid   35 and name   HA )  ( resid   35 and name HD22 ) 2.96 1.16 0.00 
assign ( resid   35 and name   HA )  ( resid   38 and name  HD# ) 3.96 2.16 0.00 
assign ( resid   35 and name   HA )  ( resid   38 and name  HG# ) 3.77 1.97 0.00 
assign ( resid   35 and name   HA )  ( resid   53 and name   HZ ) 5.02 3.22 0.00 
assign ( resid   35 and name   HA )  ( resid   53 and name  HD# ) 4.49 2.69 0.00 
assign ( resid   35 and name   HA )  ( resid   53 and name  HE# ) 4.20 2.40 0.00 
assign ( resid   35 and name   HN )  ( resid   35 and name  HB1 ) 3.99 2.19 0.00 
assign ( resid   35 and name   HN )  ( resid   35 and name  HB2 ) 3.19 1.39 0.00 
assign ( resid   35 and name   HN )  ( resid   35 and name HD21 ) 5.50 3.70 0.00 
assign ( resid   35 and name   HN )  ( resid   35 and name HD22 ) 3.47 1.67 0.00 
assign ( resid   35 and name   HN )  ( resid   36 and name  HD2 ) 4.70 2.90 0.00 
assign ( resid   35 and name   HN )  ( resid   53 and name  HD# ) 5.50 3.70 0.00 
assign ( resid   35 and name   HN )  ( resid   53 and name  HE# ) 4.51 2.71 0.00 
assign ( resid   35 and name  HB1 )  ( resid   36 and name  HD1 ) 3.74 1.94 0.00 
assign ( resid   35 and name  HB1 )  ( resid   36 and name  HD2 ) 4.28 2.48 0.00 
assign ( resid   35 and name  HB1 )  ( resid   36 and name  HG# ) 5.50 3.70 0.00 
assign ( resid   35 and name  HB1 )  ( resid   37 and name   HN ) 5.10 3.30 0.00 
assign ( resid   35 and name  HB1 )  ( resid   53 and name  HE# ) 5.50 3.70 0.00 
assign ( resid   35 and name  HB2 )  ( resid   35 and name HD21 ) 3.78 1.98 0.00 
assign ( resid   35 and name  HB2 )  ( resid   35 and name HD22 ) 3.41 1.61 0.00 
assign ( resid   35 and name  HB2 )  ( resid   36 and name  HD1 ) 3.58 1.78 0.00 
assign ( resid   35 and name  HB2 )  ( resid   36 and name  HD2 ) 4.01 2.21 0.00 
assign ( resid   35 and name  HB2 )  ( resid   36 and name  HG# ) 5.50 3.70 0.00 
assign ( resid   35 and name  HB2 )  ( resid   53 and name  HE# ) 4.85 3.05 0.00 
assign ( resid   36 and name   HA )  ( resid   38 and name   HN ) 4.08 2.28 0.00 
assign ( resid   36 and name   HA )  ( resid   39 and name   HN ) 4.25 2.45 0.00 
assign ( resid   36 and name   HA )  ( resid   39 and name  HD# ) 4.26 2.46 0.00 
assign ( resid   36 and name   HA )  ( resid   39 and name  HE# ) 5.17 3.37 0.00 
assign ( resid   36 and name   HA )  ( resid   39 and name  HG1 ) 4.40 2.60 0.00 
assign ( resid   36 and name   HA )  ( resid   39 and name  HG2 ) 4.40 2.60 0.00 
assign ( resid   36 and name   HA )  ( resid   39 and name  HG# ) 3.66 1.86 0.00 
assign ( resid   36 and name  HB1 )  ( resid   37 and name  HD# ) 5.50 3.70 0.00 
assign ( resid   36 and name  HB1 )  ( resid   37 and name  HE# ) 5.50 3.70 0.00 
assign ( resid   36 and name  HB2 )  ( resid   37 and name   HN ) 4.03 2.23 0.00 
assign ( resid   36 and name  HB2 )  ( resid   37 and name  HD# ) 5.50 3.70 0.00 
assign ( resid   36 and name  HB2 )  ( resid   37 and name  HE# ) 5.50 3.70 0.00 
assign ( resid   36 and name  HB2 )  ( resid   38 and name   HN ) 5.50 3.70 0.00 
assign ( resid   36 and name  HB2 )  ( resid   39 and name   HN ) 5.46 3.66 0.00 
assign ( resid   36 and name  HD2 )  ( resid   37 and name   HN ) 3.16 1.36 0.00 
assign ( resid   36 and name  HD2 )  ( resid   37 and name  HD# ) 5.50 3.70 0.00 
assign ( resid   36 and name  HD2 )  ( resid   53 and name  HE# ) 4.96 3.16 0.00 
assign ( resid   36 and name  HG# )  ( resid   37 and name   HN ) 3.52 1.72 0.00 
assign ( resid   36 and name  HG# )  ( resid   37 and name  HD# ) 3.65 1.85 0.00 
assign ( resid   36 and name  HG# )  ( resid   37 and name  HE# ) 3.14 1.34 0.00 
assign ( resid   37 and name   HA )  ( resid   37 and name  HD# ) 3.33 1.53 0.00 
assign ( resid   37 and name   HA )  ( resid   37 and name  HE# ) 4.94 3.14 0.00 
assign ( resid   37 and name   HA )  ( resid   39 and name   HN ) 3.78 1.98 0.00 
assign ( resid   37 and name   HA )  ( resid   42 and name   HN ) 5.27 3.47 0.00 
assign ( resid   37 and name   HA )  ( resid   42 and name  HB1 ) 4.97 3.17 0.00 
assign ( resid   37 and name   HA )  ( resid   42 and name  HB2 ) 4.38 2.58 0.00 
assign ( resid   37 and name   HA )  ( resid   46 and name   HA ) 4.96 3.16 0.00 
assign ( resid   37 and name   HA )  ( resid   47 and name   HN ) 4.54 2.74 0.00 
assign ( resid   37 and name   HA )  ( resid   47 and name HD1# ) 5.50 3.70 0.00 
assign ( resid   37 and name   HN )  ( resid   37 and name  HB1 ) 3.77 1.97 0.00 
assign ( resid   37 and name   HN )  ( resid   37 and name  HB2 ) 2.87 1.07 0.00 
assign ( resid   37 and name   HN )  ( resid   37 and name  HD# ) 2.71 0.91 0.00 
assign ( resid   37 and name   HN )  ( resid   37 and name  HE# ) 4.67 2.87 0.00 
assign ( resid   37 and name   HN )  ( resid   38 and name   HA ) 5.32 3.52 0.00 
assign ( resid   37 and name   HN )  ( resid   38 and name  HD# ) 5.34 3.54 0.00 
assign ( resid   37 and name   HN )  ( resid   38 and name  HG# ) 4.05 2.25 0.00 
assign ( resid   37 and name   HN )  ( resid   39 and name   HN ) 4.10 2.30 0.00 
assign ( resid   37 and name   HN )  ( resid   39 and name  HE# ) 5.35 3.55 0.00 
assign ( resid   37 and name   HN )  ( resid   42 and name  HB2 ) 5.50 3.70 0.00 
assign ( resid   37 and name   HN )  ( resid   47 and name HD1# ) 4.24 2.44 0.00 
assign ( resid   37 and name  HB1 )  ( resid   38 and name   HN ) 4.01 2.21 0.00 
assign ( resid   37 and name  HB1 )  ( resid   46 and name   HA ) 4.84 3.04 0.00 
assign ( resid   37 and name  HB1 )  ( resid   47 and name   HN ) 3.66 1.86 0.00 
assign ( resid   37 and name  HB1 )  ( resid   47 and name HD1# ) 4.16 2.36 0.00 
assign ( resid   37 and name  HB1 )  ( resid   47 and name HG11 ) 5.16 3.36 0.00 
assign ( resid   37 and name  HB1 )  ( resid   47 and name HG12 ) 5.50 3.70 0.00 
assign ( resid   37 and name  HB1 )  ( resid   96 and name  HE# ) 4.58 2.78 0.00 
assign ( resid   37 and name  HB2 )  ( resid   38 and name   HN ) 3.78 1.98 0.00 
assign ( resid   37 and name  HB2 )  ( resid   39 and name   HN ) 5.29 3.49 0.00 
assign ( resid   37 and name  HB2 )  ( resid   46 and name   HA ) 5.50 3.70 0.00 
assign ( resid   37 and name  HB2 )  ( resid   47 and name   HN ) 4.38 2.58 0.00 
assign ( resid   37 and name  HB2 )  ( resid   47 and name HD1# ) 3.86 2.06 0.00 
assign ( resid   37 and name  HB2 )  ( resid   47 and name HG11 ) 5.50 3.70 0.00 
assign ( resid   37 and name  HB2 )  ( resid   47 and name HG12 ) 5.50 3.70 0.00 
assign ( resid   37 and name  HB2 )  ( resid   96 and name  HE# ) 5.30 3.50 0.00 
assign ( resid   37 and name  HD# )  ( resid   38 and name   HN ) 4.46 2.66 0.00 
assign ( resid   37 and name  HD# )  ( resid   42 and name  HB2 ) 5.21 3.41 0.00 
assign ( resid   37 and name  HD# )  ( resid   44 and name  HG# ) 5.10 3.30 0.00 
assign ( resid   37 and name  HD# )  ( resid   45 and name   HN ) 5.50 3.70 0.00 
assign ( resid   37 and name  HD# )  ( resid   45 and name  HA1 ) 3.90 2.10 0.00 
assign ( resid   37 and name  HD# )  ( resid   46 and name   HA ) 4.56 2.76 0.00 
assign ( resid   37 and name  HD# )  ( resid   47 and name   HN ) 4.73 2.93 0.00 
assign ( resid   37 and name  HD# )  ( resid   47 and name HD1# ) 4.06 2.26 0.00 
assign ( resid   37 and name  HD# )  ( resid   47 and name HG11 ) 4.37 2.57 0.00 
assign ( resid   37 and name  HD# )  ( resid   47 and name HG12 ) 5.23 3.43 0.00 
assign ( resid   37 and name  HD# )  ( resid   56 and name  HD# ) 5.44 3.64 0.00 
assign ( resid   37 and name  HD# )  ( resid   92 and name HG2# ) 4.41 2.61 0.00 
assign ( resid   37 and name  HD# )  ( resid   96 and name  HB1 ) 3.52 1.72 0.00 
assign ( resid   37 and name  HD# )  ( resid   96 and name  HE# ) 3.27 1.47 0.00 
assign ( resid   37 and name  HD# )  ( resid   96 and name  HG# ) 4.06 2.26 0.00 
assign ( resid   37 and name  HE# )  ( resid   44 and name   HB ) 5.50 3.70 0.00 
assign ( resid   37 and name  HE# )  ( resid   44 and name   HN ) 5.47 3.67 0.00 
assign ( resid   37 and name  HE# )  ( resid   44 and name  HG# ) 4.30 2.50 0.00 
assign ( resid   37 and name  HE# )  ( resid   45 and name   HN ) 5.50 3.70 0.00 
assign ( resid   37 and name  HE# )  ( resid   45 and name  HA1 ) 4.33 2.53 0.00 
assign ( resid   37 and name  HE# )  ( resid   45 and name  HA2 ) 5.50 3.70 0.00 
assign ( resid   37 and name  HE# )  ( resid   92 and name HD1# ) 5.27 3.47 0.00 
assign ( resid   37 and name  HE# )  ( resid   92 and name HG2# ) 3.29 1.49 0.00 
assign ( resid   37 and name  HE# )  ( resid   93 and name   HA ) 4.57 2.77 0.00 
assign ( resid   37 and name  HE# )  ( resid   96 and name  HB1 ) 3.12 1.32 0.00 
assign ( resid   37 and name  HE# )  ( resid   96 and name  HB2 ) 3.38 1.58 0.00 
assign ( resid   37 and name  HE# )  ( resid   96 and name  HE# ) 3.64 1.84 0.00 
assign ( resid   37 and name  HE# )  ( resid   96 and name  HG1 ) 5.50 3.70 0.00 
assign ( resid   37 and name  HE# )  ( resid   96 and name  HG2 ) 5.50 3.70 0.00 
assign ( resid   37 and name  HE# )  ( resid   97 and name   HN ) 5.50 3.70 0.00 
assign ( resid   38 and name   HA )  ( resid   38 and name  HD1 ) 5.03 3.23 0.00 
assign ( resid   38 and name   HA )  ( resid   38 and name  HD2 ) 5.03 3.23 0.00 
assign ( resid   38 and name   HA )  ( resid   38 and name  HD# ) 4.40 2.60 0.00 
assign ( resid   38 and name   HA )  ( resid   38 and name  HG1 ) 3.93 2.13 0.00 
assign ( resid   38 and name   HA )  ( resid   38 and name  HG2 ) 3.93 2.13 0.00 
assign ( resid   38 and name   HA )  ( resid   47 and name   HB ) 3.83 2.03 0.00 
assign ( resid   38 and name   HA )  ( resid   47 and name HD1# ) 5.35 3.55 0.00 
assign ( resid   38 and name   HA )  ( resid   47 and name HG11 ) 5.50 3.70 0.00 
assign ( resid   38 and name   HA )  ( resid   47 and name HG12 ) 5.50 3.70 0.00 
assign ( resid   38 and name   HA )  ( resid   47 and name HG2# ) 5.50 3.70 0.00 
assign ( resid   38 and name   HN )  ( resid   38 and name  HB# ) 3.02 1.22 0.00 
assign ( resid   38 and name   HN )  ( resid   38 and name  HG# ) 2.40 0.60 0.00 
assign ( resid   38 and name   HN )  ( resid   39 and name   HN ) 2.61 0.81 0.00 
assign ( resid   38 and name   HN )  ( resid   47 and name   HN ) 5.50 3.70 0.00 
assign ( resid   38 and name   HN )  ( resid   47 and name HD1# ) 4.18 2.38 0.00 
assign ( resid   38 and name   HN )  ( resid   47 and name HG2# ) 5.50 3.70 0.00 
assign ( resid   38 and name  HB1 )  ( resid   47 and name   HB ) 5.50 3.70 0.00 
assign ( resid   38 and name  HB2 )  ( resid   47 and name   HB ) 5.50 3.70 0.00 
assign ( resid   38 and name  HB# )  ( resid   39 and name  HE# ) 5.34 3.54 0.00 
assign ( resid   38 and name  HB# )  ( resid   53 and name  HD# ) 4.79 2.99 0.00 
assign ( resid   38 and name  HD1 )  ( resid   47 and name   HB ) 5.50 3.70 0.00 
assign ( resid   38 and name  HD1 )  ( resid   47 and name HG2# ) 5.50 3.70 0.00 
assign ( resid   38 and name  HD1 )  ( resid   53 and name  HB1 ) 5.50 3.70 0.00 
assign ( resid   38 and name  HD1 )  ( resid   53 and name  HB2 ) 4.79 2.99 0.00 
assign ( resid   38 and name  HD1 )  ( resid   53 and name  HD# ) 4.37 2.57 0.00 
assign ( resid   38 and name  HD1 )  ( resid   53 and name  HE# ) 5.50 3.70 0.00 
assign ( resid   38 and name  HD2 )  ( resid   47 and name   HB ) 5.50 3.70 0.00 
assign ( resid   38 and name  HD2 )  ( resid   47 and name HG2# ) 5.50 3.70 0.00 
assign ( resid   38 and name  HD2 )  ( resid   53 and name  HB1 ) 5.50 3.70 0.00 
assign ( resid   38 and name  HD2 )  ( resid   53 and name  HB2 ) 4.79 2.99 0.00 
assign ( resid   38 and name  HD2 )  ( resid   53 and name  HD# ) 4.37 2.57 0.00 
assign ( resid   38 and name  HD2 )  ( resid   53 and name  HE# ) 5.50 3.70 0.00 
assign ( resid   38 and name  HD# )  ( resid   39 and name   HN ) 5.34 3.54 0.00 
assign ( resid   38 and name  HD# )  ( resid   39 and name  HE# ) 5.34 3.54 0.00 
assign ( resid   38 and name  HD# )  ( resid   47 and name HG2# ) 4.72 2.92 0.00 
assign ( resid   38 and name  HD# )  ( resid   53 and name   HA ) 5.34 3.54 0.00 
assign ( resid   38 and name  HD# )  ( resid   53 and name  HD# ) 3.84 2.04 0.00 
assign ( resid   38 and name  HD# )  ( resid   53 and name  HE# ) 4.63 2.83 0.00 
assign ( resid   38 and name  HG1 )  ( resid   39 and name   HA ) 4.07 2.27 0.00
assign ( resid   38 and name  HG1 )  ( resid   39 and name   HN ) 3.24 1.44 0.00
assign ( resid   38 and name  HG1 )  ( resid   40 and name  HD1 ) 5.50 3.70 0.00
assign ( resid   38 and name  HG1 )  ( resid   53 and name  HD# ) 4.85 3.05 0.00
assign ( resid   38 and name  HG2 )  ( resid   39 and name   HN ) 3.48 1.68 0.00
assign ( resid   38 and name  HG2 )  ( resid   47 and name HD1# ) 4.81 3.01 0.00
assign ( resid   38 and name  HG2 )  ( resid   47 and name HG2# ) 5.50 3.70 0.00
assign ( resid   38 and name  HG2 )  ( resid   53 and name  HD# ) 4.92 3.12 0.00
assign ( resid   38 and name  HG2 )  ( resid   53 and name  HE# ) 5.15 3.35 0.00
assign ( resid   39 and name   HA )  ( resid   39 and name  HD# ) 4.07 2.27 0.00 
assign ( resid   39 and name   HA )  ( resid   39 and name  HE# ) 5.50 3.70 0.00 
assign ( resid   39 and name   HA )  ( resid   39 and name  HG1 ) 4.21 2.41 0.00 
assign ( resid   39 and name   HA )  ( resid   39 and name  HG2 ) 4.21 2.41 0.00 
assign ( resid   39 and name   HA )  ( resid   39 and name  HG# ) 3.52 1.72 0.00 
assign ( resid   39 and name   HA )  ( resid   40 and name   HA ) 4.61 2.81 0.00 
assign ( resid   39 and name   HA )  ( resid   40 and name  HD1 ) 3.18 1.38 0.00 
assign ( resid   39 and name   HA )  ( resid   40 and name  HD2 ) 3.27 1.47 0.00 
assign ( resid   39 and name   HN )  ( resid   39 and name  HB2 ) 2.88 1.08 0.00 
assign ( resid   39 and name   HN )  ( resid   39 and name  HE# ) 3.96 2.16 0.00 
assign ( resid   39 and name   HN )  ( resid   39 and name  HG# ) 2.52 0.72 0.00 
assign ( resid   39 and name   HN )  ( resid   41 and name   HN ) 5.50 3.70 0.00 
assign ( resid   39 and name   HN )  ( resid   42 and name   HN ) 4.76 2.96 0.00 
assign ( resid   39 and name   HN )  ( resid   42 and name  HB2 ) 4.23 2.43 0.00 
assign ( resid   39 and name   HN )  ( resid   47 and name   HN ) 5.02 3.22 0.00 
assign ( resid   39 and name   HN )  ( resid   47 and name HD1# ) 5.50 3.70 0.00 
assign ( resid   39 and name   HN )  ( resid   47 and name HG11 ) 5.50 3.70 0.00 
assign ( resid   39 and name  HB1 )  ( resid   39 and name  HD# ) 2.73 0.93 0.00 
assign ( resid   39 and name  HB1 )  ( resid   39 and name  HE# ) 4.84 3.04 0.00 
assign ( resid   39 and name  HB1 )  ( resid   40 and name  HD1 ) 4.63 2.83 0.00 
assign ( resid   39 and name  HB1 )  ( resid   40 and name  HD2 ) 4.19 2.39 0.00 
assign ( resid   39 and name  HB1 )  ( resid   41 and name   HN ) 3.07 1.27 0.00 
assign ( resid   39 and name  HB1 )  ( resid   42 and name  HB2 ) 5.09 3.29 0.00 
assign ( resid   39 and name  HB2 )  ( resid   39 and name  HD# ) 3.42 1.62 0.00 
assign ( resid   39 and name  HB2 )  ( resid   41 and name   HN ) 3.35 1.55 0.00 
assign ( resid   39 and name  HB2 )  ( resid   42 and name   HN ) 3.32 1.52 0.00 
assign ( resid   39 and name  HB2 )  ( resid   42 and name  HB1 ) 5.29 3.49 0.00 
assign ( resid   39 and name  HB2 )  ( resid   42 and name  HB2 ) 5.09 3.29 0.00 
assign ( resid   39 and name  HD# )  ( resid   40 and name  HD1 ) 5.13 3.33 0.00 
assign ( resid   39 and name  HD# )  ( resid   42 and name  HB2 ) 5.50 3.70 0.00 
assign ( resid   39 and name  HG1 )  ( resid   39 and name  HD# ) 2.96 1.16 0.00 
assign ( resid   39 and name  HG2 )  ( resid   39 and name  HD# ) 2.96 1.16 0.00 
assign ( resid   39 and name  HG# )  ( resid   40 and name  HD1 ) 5.34 3.54 0.00 
assign ( resid   39 and name  HG# )  ( resid   40 and name  HD2 ) 5.01 3.21 0.00 
assign ( resid   39 and name  HG# )  ( resid   41 and name   HN ) 5.04 3.24 0.00 
assign ( resid   40 and name   HA )  ( resid   41 and name   HA ) 4.67 2.87 0.00 
assign ( resid   40 and name   HA )  ( resid   42 and name   HN ) 3.99 2.19 0.00 
assign ( resid   40 and name   HA )  ( resid   46 and name   HE ) 4.24 2.44 0.00 
assign ( resid   40 and name   HA )  ( resid   46 and name  HD1 ) 4.51 2.71 0.00 
assign ( resid   40 and name   HA )  ( resid   46 and name  HD2 ) 4.51 2.71 0.00 
assign ( resid   40 and name   HA )  ( resid   46 and name  HD# ) 3.69 1.89 0.00 
assign ( resid   40 and name   HA )  ( resid   46 and name  HG# ) 5.34 3.54 0.00 
assign ( resid   40 and name  HB# )  ( resid   41 and name   HN ) 3.81 2.01 0.00 
assign ( resid   40 and name  HB# )  ( resid   42 and name   HN ) 5.34 3.54 0.00 
assign ( resid   40 and name  HB# )  ( resid   46 and name   HE ) 5.34 3.54 0.00 
assign ( resid   40 and name  HD1 )  ( resid   41 and name   HN ) 4.10 2.30 0.00 
assign ( resid   40 and name  HD1 )  ( resid   42 and name   HN ) 5.50 3.70 0.00 
assign ( resid   40 and name  HD2 )  ( resid   41 and name   HN ) 3.15 1.35 0.00 
assign ( resid   40 and name  HD2 )  ( resid   42 and name   HN ) 4.87 3.07 0.00 
assign ( resid   40 and name  HG# )  ( resid   41 and name   HN ) 3.33 1.53 0.00 
assign ( resid   41 and name   HA )  ( resid   42 and name   HN ) 3.17 1.37 0.00 
assign ( resid   41 and name   HN )  ( resid   41 and name  HB1 ) 3.30 1.50 0.00 
assign ( resid   41 and name   HN )  ( resid   41 and name  HB2 ) 3.30 1.50 0.00 
assign ( resid   41 and name   HN )  ( resid   41 and name  HB# ) 2.83 1.03 0.00 
assign ( resid   41 and name   HN )  ( resid   42 and name   HN ) 2.74 0.94 0.00 
assign ( resid   41 and name   HN )  ( resid   42 and name  HB1 ) 4.84 3.04 0.00 
assign ( resid   41 and name   HN )  ( resid   42 and name  HB2 ) 4.83 3.03 0.00 
assign ( resid   41 and name   HN )  ( resid   46 and name  HD# ) 5.18 3.38 0.00 
assign ( resid   41 and name  HB1 )  ( resid   42 and name   HN ) 4.88 3.08 0.00 
assign ( resid   41 and name  HB2 )  ( resid   42 and name   HN ) 4.88 3.08 0.00 
assign ( resid   41 and name  HB# )  ( resid   42 and name   HN ) 4.23 2.43 0.00 
assign ( resid   42 and name   HA )  ( resid   43 and name   HN ) 3.07 1.27 0.00 
assign ( resid   42 and name   HN )  ( resid   42 and name  HB1 ) 2.60 0.80 0.00 
assign ( resid   42 and name   HN )  ( resid   42 and name  HB2 ) 2.80 1.00 0.00 
assign ( resid   42 and name   HN )  ( resid   43 and name   HN ) 4.85 3.05 0.00 
assign ( resid   42 and name   HN )  ( resid   46 and name   HA ) 5.13 3.33 0.00 
assign ( resid   42 and name   HN )  ( resid   46 and name   HE ) 5.48 3.68 0.00 
assign ( resid   42 and name   HN )  ( resid   46 and name  HB2 ) 4.85 3.05 0.00 
assign ( resid   42 and name   HN )  ( resid   46 and name  HD# ) 3.93 2.13 0.00 
assign ( resid   42 and name   HN )  ( resid   46 and name  HG# ) 4.95 3.15 0.00 
assign ( resid   42 and name  HB1 )  ( resid   43 and name   HN ) 5.50 3.70 0.00 
assign ( resid   42 and name  HB1 )  ( resid   44 and name   HN ) 4.86 3.06 0.00 
assign ( resid   42 and name  HB1 )  ( resid   46 and name   HA ) 4.81 3.01 0.00 
assign ( resid   42 and name  HB1 )  ( resid   46 and name   HE ) 5.25 3.45 0.00 
assign ( resid   42 and name  HB1 )  ( resid   46 and name   HN ) 4.42 2.62 0.00 
assign ( resid   42 and name  HB1 )  ( resid   46 and name  HB1 ) 5.50 3.70 0.00 
assign ( resid   42 and name  HB1 )  ( resid   46 and name  HB2 ) 4.68 2.88 0.00 
assign ( resid   42 and name  HB1 )  ( resid   46 and name  HD1 ) 4.73 2.93 0.00 
assign ( resid   42 and name  HB1 )  ( resid   46 and name  HD2 ) 4.73 2.93 0.00 
assign ( resid   42 and name  HB1 )  ( resid   46 and name  HD# ) 4.16 2.36 0.00 
assign ( resid   42 and name  HB1 )  ( resid   46 and name  HG# ) 4.00 2.20 0.00 
assign ( resid   42 and name  HB1 )  ( resid   47 and name   HN ) 4.71 2.91 0.00 
assign ( resid   42 and name  HB2 )  ( resid   43 and name   HN ) 4.96 3.16 0.00 
assign ( resid   42 and name  HB2 )  ( resid   44 and name   HN ) 4.87 3.07 0.00 
assign ( resid   42 and name  HB2 )  ( resid   46 and name   HA ) 5.50 3.70 0.00 
assign ( resid   42 and name  HB2 )  ( resid   46 and name   HN ) 5.50 3.70 0.00 
assign ( resid   42 and name  HB2 )  ( resid   46 and name  HB1 ) 5.50 3.70 0.00 
assign ( resid   42 and name  HB2 )  ( resid   46 and name  HB2 ) 4.91 3.11 0.00 
assign ( resid   42 and name  HB2 )  ( resid   46 and name  HD1 ) 5.50 3.70 0.00 
assign ( resid   42 and name  HB2 )  ( resid   46 and name  HD2 ) 5.50 3.70 0.00 
assign ( resid   42 and name  HB2 )  ( resid   46 and name  HD# ) 4.73 2.93 0.00 
assign ( resid   42 and name  HB2 )  ( resid   46 and name  HG1 ) 5.50 3.70 0.00 
assign ( resid   42 and name  HB2 )  ( resid   46 and name  HG2 ) 5.50 3.70 0.00 
assign ( resid   42 and name  HB2 )  ( resid   47 and name   HN ) 5.31 3.51 0.00 
assign ( resid   43 and name   HA )  ( resid   43 and name  HD# ) 3.98 2.18 0.00 
assign ( resid   43 and name   HA )  ( resid   43 and name  HE# ) 5.03 3.23 0.00 
assign ( resid   43 and name   HA )  ( resid   43 and name  HG# ) 3.42 1.62 0.00 
assign ( resid   43 and name   HN )  ( resid   43 and name  HB1 ) 3.97 2.17 0.00 
assign ( resid   43 and name   HN )  ( resid   43 and name  HB2 ) 3.97 2.17 0.00 
assign ( resid   43 and name   HN )  ( resid   43 and name  HB# ) 3.26 1.46 0.00 
assign ( resid   43 and name   HN )  ( resid   43 and name  HD# ) 4.30 2.50 0.00 
assign ( resid   43 and name   HN )  ( resid   43 and name  HG# ) 4.20 2.40 0.00 
assign ( resid   43 and name   HN )  ( resid   44 and name   HN ) 3.06 1.26 0.00 
assign ( resid   43 and name   HN )  ( resid   44 and name  HG# ) 5.44 3.64 0.00 
assign ( resid   43 and name  HB1 )  ( resid   43 and name  HD# ) 3.84 2.04 0.00 
assign ( resid   43 and name  HB1 )  ( resid   43 and name  HE# ) 5.50 3.70 0.00 
assign ( resid   43 and name  HB2 )  ( resid   43 and name  HD# ) 3.84 2.04 0.00 
assign ( resid   43 and name  HB2 )  ( resid   43 and name  HE# ) 5.50 3.70 0.00 
assign ( resid   43 and name  HB# )  ( resid   43 and name  HD# ) 3.34 1.54 0.00 
assign ( resid   43 and name  HB# )  ( resid   44 and name   HN ) 2.84 1.04 0.00 
assign ( resid   43 and name  HB# )  ( resid   44 and name  HG# ) 3.72 1.92 0.00 
assign ( resid   43 and name  HD# )  ( resid   44 and name  HG# ) 5.44 3.64 0.00 
assign ( resid   43 and name  HG# )  ( resid   43 and name  HD# ) 2.42 0.62 0.00 
assign ( resid   43 and name  HG# )  ( resid   43 and name  HE# ) 3.62 1.82 0.00 
assign ( resid   43 and name  HG# )  ( resid   44 and name  HG# ) 5.28 3.48 0.00 
assign ( resid   44 and name   HA )  ( resid   44 and name HG1# ) 3.44 1.64 0.00 
assign ( resid   44 and name   HA )  ( resid   44 and name HG2# ) 3.44 1.64 0.00 
assign ( resid   44 and name   HA )  ( resid   45 and name   HN ) 2.44 0.64 0.00 
assign ( resid   44 and name   HA )  ( resid   46 and name   HN ) 4.03 2.23 0.00 
assign ( resid   44 and name   HA )  ( resid  101 and name   HA ) 3.16 1.36 0.00 
assign ( resid   44 and name   HA )  ( resid  101 and name  HB# ) 4.37 2.57 0.00 
assign ( resid   44 and name   HB )  ( resid   45 and name   HN ) 4.19 2.39 0.00 
assign ( resid   44 and name   HB )  ( resid  101 and name   HA ) 5.50 3.70 0.00 
assign ( resid   44 and name   HN )  ( resid   44 and name   HA ) 2.91 1.11 0.00 
assign ( resid   44 and name   HN )  ( resid   44 and name  HG# ) 3.29 1.49 0.00 
assign ( resid   44 and name   HN )  ( resid   45 and name   HN ) 4.47 2.67 0.00 
assign ( resid   44 and name  HG# )  ( resid   45 and name   HN ) 3.01 1.21 0.00 
assign ( resid   44 and name  HG# )  ( resid   45 and name  HA1 ) 4.61 2.81 0.00 
assign ( resid   44 and name  HG# )  ( resid   45 and name  HA2 ) 5.44 3.64 0.00 
assign ( resid   44 and name  HG# )  ( resid   96 and name   HN ) 5.19 3.39 0.00 
assign ( resid   44 and name  HG# )  ( resid   97 and name   HA ) 3.18 1.38 0.00 
assign ( resid   44 and name  HG# )  ( resid   97 and name   HN ) 3.86 2.06 0.00 
assign ( resid   44 and name  HG# )  ( resid   97 and name  HB# ) 4.14 2.34 0.00 
assign ( resid   44 and name  HG# )  ( resid   97 and name  HG# ) 3.88 2.08 0.00 
assign ( resid   44 and name  HG# )  ( resid   97 and name HE2# ) 4.31 2.51 0.00 
assign ( resid   44 and name  HG# )  ( resid   98 and name   HN ) 4.73 2.93 0.00 
assign ( resid   44 and name  HG# )  ( resid   99 and name   HN ) 4.61 2.81 0.00 
assign ( resid   44 and name  HG# )  ( resid   99 and name  HB2 ) 5.24 3.44 0.00 
assign ( resid   44 and name  HG# )  ( resid   99 and name  HD# ) 5.41 3.61 0.00 
assign ( resid   44 and name  HG# )  ( resid  100 and name   HN ) 3.82 2.02 0.00 
assign ( resid   44 and name  HG# )  ( resid  100 and name  HA# ) 4.85 3.05 0.00 
assign ( resid   44 and name  HG# )  ( resid  101 and name   HA ) 4.39 2.59 0.00 
assign ( resid   44 and name HG1# )  ( resid  101 and name   HA ) 5.47 3.67 0.00 
assign ( resid   44 and name HG2# )  ( resid  101 and name   HA ) 5.47 3.67 0.00 
assign ( resid   45 and name   HN )  ( resid   45 and name  HA1 ) 2.94 1.14 0.00 
assign ( resid   45 and name   HN )  ( resid   45 and name  HA2 ) 2.70 0.90 0.00 
assign ( resid   45 and name   HN )  ( resid   46 and name   HN ) 2.88 1.08 0.00 
assign ( resid   45 and name   HN )  ( resid   96 and name  HB1 ) 5.31 3.51 0.00 
assign ( resid   45 and name   HN )  ( resid   96 and name  HE# ) 4.83 3.03 0.00 
assign ( resid   45 and name   HN )  ( resid   97 and name   HA ) 5.11 3.31 0.00 
assign ( resid   45 and name   HN )  ( resid   99 and name  HB1 ) 5.50 3.70 0.00 
assign ( resid   45 and name   HN )  ( resid   99 and name  HB2 ) 4.46 2.66 0.00 
assign ( resid   45 and name   HN )  ( resid   99 and name  HD# ) 5.50 3.70 0.00 
assign ( resid   45 and name   HN )  ( resid  100 and name   HN ) 4.86 3.06 0.00 
assign ( resid   45 and name   HN )  ( resid  101 and name   HA ) 3.21 1.41 0.00 
assign ( resid   45 and name   HN )  ( resid  101 and name  HB# ) 4.46 2.66 0.00 
assign ( resid   45 and name   HN )  ( resid  102 and name   HA ) 4.21 2.41 0.00 
assign ( resid   45 and name   HN )  ( resid  102 and name   HN ) 5.12 3.32 0.00 
assign ( resid   45 and name  HA1 )  ( resid   47 and name   HN ) 5.50 3.70 0.00 
assign ( resid   45 and name  HA1 )  ( resid   96 and name   HN ) 5.50 3.70 0.00 
assign ( resid   45 and name  HA1 )  ( resid   96 and name  HB1 ) 5.46 3.66 0.00 
assign ( resid   45 and name  HA1 )  ( resid   96 and name  HB2 ) 5.50 3.70 0.00 
assign ( resid   45 and name  HA1 )  ( resid   96 and name  HE# ) 3.83 2.03 0.00 
assign ( resid   45 and name  HA1 )  ( resid   99 and name  HB1 ) 5.50 3.70 0.00 
assign ( resid   45 and name  HA1 )  ( resid   99 and name  HB2 ) 5.50 3.70 0.00 
assign ( resid   45 and name  HA1 )  ( resid   99 and name  HD# ) 4.51 2.71 0.00 
assign ( resid   45 and name  HA1 )  ( resid  103 and name   HA ) 5.50 3.70 0.00 
assign ( resid   45 and name  HA1 )  ( resid  103 and name   HN ) 5.50 3.70 0.00 
assign ( resid   45 and name  HA2 )  ( resid   46 and name   HN ) 3.27 1.47 0.00 
assign ( resid   45 and name  HA2 )  ( resid   96 and name  HB1 ) 5.50 3.70 0.00 
assign ( resid   45 and name  HA2 )  ( resid   96 and name  HB2 ) 5.48 3.68 0.00 
assign ( resid   45 and name  HA2 )  ( resid   96 and name  HE# ) 3.99 2.19 0.00 
assign ( resid   45 and name  HA2 )  ( resid   99 and name   HN ) 5.37 3.57 0.00 
assign ( resid   45 and name  HA2 )  ( resid   99 and name  HB1 ) 5.25 3.45 0.00 
assign ( resid   45 and name  HA2 )  ( resid   99 and name  HB2 ) 4.91 3.11 0.00 
assign ( resid   45 and name  HA2 )  ( resid   99 and name  HD# ) 4.50 2.70 0.00 
assign ( resid   45 and name  HA2 )  ( resid  100 and name   HN ) 5.50 3.70 0.00 
assign ( resid   45 and name  HA2 )  ( resid  102 and name   HN ) 4.78 2.98 0.00 
assign ( resid   45 and name  HA2 )  ( resid  103 and name   HA ) 5.50 3.70 0.00 
assign ( resid   45 and name  HA2 )  ( resid  103 and name   HN ) 4.19 2.39 0.00 
assign ( resid   46 and name   HA )  ( resid   46 and name  HD1 ) 5.33 3.53 0.00 
assign ( resid   46 and name   HA )  ( resid   46 and name  HD2 ) 5.33 3.53 0.00 
assign ( resid   46 and name   HA )  ( resid   46 and name  HD# ) 4.63 2.83 0.00 
assign ( resid   46 and name   HA )  ( resid   46 and name  HG1 ) 4.09 2.29 0.00 
assign ( resid   46 and name   HA )  ( resid   46 and name  HG2 ) 4.09 2.29 0.00 
assign ( resid   46 and name   HA )  ( resid   46 and name  HG# ) 3.51 1.71 0.00 
assign ( resid   46 and name   HA )  ( resid   47 and name   HN ) 2.50 0.70 0.00 
assign ( resid   46 and name   HA )  ( resid   47 and name HD1# ) 5.50 3.70 0.00 
assign ( resid   46 and name   HA )  ( resid   47 and name HG11 ) 5.50 3.70 0.00 
assign ( resid   46 and name   HA )  ( resid  102 and name HG1# ) 5.50 3.70 0.00 
assign ( resid   46 and name   HE )  ( resid  102 and name HG1# ) 4.46 2.66 0.00 
assign ( resid   46 and name   HN )  ( resid   46 and name  HB1 ) 3.02 1.22 0.00 
assign ( resid   46 and name   HN )  ( resid   46 and name  HB2 ) 2.66 0.86 0.00 
assign ( resid   46 and name   HN )  ( resid   46 and name  HD# ) 4.68 2.88 0.00 
assign ( resid   46 and name   HN )  ( resid   46 and name  HG# ) 4.37 2.57 0.00 
assign ( resid   46 and name   HN )  ( resid   47 and name   HN ) 4.62 2.82 0.00 
assign ( resid   46 and name   HN )  ( resid  101 and name   HA ) 4.51 2.71 0.00 
assign ( resid   46 and name   HN )  ( resid  102 and name   HA ) 2.65 0.85 0.00 
assign ( resid   46 and name   HN )  ( resid  102 and name HG1# ) 4.21 2.41 0.00 
assign ( resid   46 and name   HN )  ( resid  103 and name   HN ) 4.38 2.58 0.00 
assign ( resid   46 and name   HN )  ( resid  103 and name  HB1 ) 5.30 3.50 0.00 
assign ( resid   46 and name   HN )  ( resid  103 and name  HB2 ) 4.61 2.81 0.00 
assign ( resid   46 and name  HB1 )  ( resid   46 and name   HE ) 3.51 1.71 0.00 
assign ( resid   46 and name  HB1 )  ( resid   47 and name   HN ) 4.44 2.64 0.00 
assign ( resid   46 and name  HB1 )  ( resid   48 and name   HN ) 5.50 3.70 0.00 
assign ( resid   46 and name  HB2 )  ( resid   46 and name   HE ) 3.71 1.91 0.00 
assign ( resid   46 and name  HB2 )  ( resid  102 and name   HA ) 4.21 2.41 0.00 
assign ( resid   46 and name  HB2 )  ( resid  102 and name HG1# ) 5.05 3.25 0.00 
assign ( resid   46 and name  HD# )  ( resid   47 and name   HN ) 5.34 3.54 0.00 
assign ( resid   46 and name  HG1 )  ( resid   46 and name   HE ) 4.10 2.30 0.00 
assign ( resid   46 and name  HG2 )  ( resid   46 and name   HE ) 4.10 2.30 0.00 
assign ( resid   46 and name  HG# )  ( resid   46 and name   HE ) 3.41 1.61 0.00 
assign ( resid   46 and name  HG# )  ( resid   47 and name   HN ) 3.21 1.41 0.00 
assign ( resid   46 and name  HG# )  ( resid   48 and name   HA ) 5.34 3.54 0.00 
assign ( resid   46 and name  HG# )  ( resid  102 and name   HA ) 4.61 2.81 0.00 
assign ( resid   47 and name   HA )  ( resid   47 and name HD1# ) 4.51 2.71 0.00 
assign ( resid   47 and name   HA )  ( resid   47 and name HG11 ) 4.16 2.36 0.00 
assign ( resid   47 and name   HA )  ( resid   47 and name HG12 ) 4.00 2.20 0.00 
assign ( resid   47 and name   HA )  ( resid   47 and name HG2# ) 3.60 1.80 0.00 
assign ( resid   47 and name   HA )  ( resid   48 and name   HN ) 2.67 0.87 0.00 
assign ( resid   47 and name   HA )  ( resid   48 and name HG2# ) 4.56 2.76 0.00 
assign ( resid   47 and name   HA )  ( resid   49 and name   HN ) 4.39 2.59 0.00 
assign ( resid   47 and name   HA )  ( resid   96 and name  HE# ) 5.28 3.48 0.00 
assign ( resid   47 and name   HA )  ( resid  103 and name   HN ) 4.07 2.27 0.00 
assign ( resid   47 and name   HA )  ( resid  103 and name  HB1 ) 3.99 2.19 0.00 
assign ( resid   47 and name   HA )  ( resid  103 and name  HB2 ) 4.41 2.61 0.00 
assign ( resid   47 and name   HA )  ( resid  103 and name  HD# ) 5.09 3.29 0.00 
assign ( resid   47 and name   HA )  ( resid  103 and name  HE# ) 5.36 3.56 0.00 
assign ( resid   47 and name   HB )  ( resid   47 and name HD1# ) 3.39 1.59 0.00 
assign ( resid   47 and name   HB )  ( resid   48 and name   HN ) 4.38 2.58 0.00 
assign ( resid   47 and name   HB )  ( resid   53 and name   HN ) 4.88 3.08 0.00 
assign ( resid   47 and name   HB )  ( resid   53 and name  HE# ) 5.50 3.70 0.00 
assign ( resid   47 and name   HN )  ( resid   47 and name HD1# ) 3.76 1.96 0.00 
assign ( resid   47 and name   HN )  ( resid   47 and name HG11 ) 3.50 1.70 0.00 
assign ( resid   47 and name   HN )  ( resid   47 and name HG12 ) 3.50 1.70 0.00 
assign ( resid   47 and name   HN )  ( resid   47 and name HG2# ) 4.01 2.21 0.00 
assign ( resid   47 and name   HN )  ( resid   48 and name   HA ) 5.50 3.70 0.00 
assign ( resid   47 and name   HN )  ( resid   48 and name   HN ) 5.02 3.22 0.00 
assign ( resid   47 and name   HN )  ( resid  103 and name   HN ) 5.50 3.70 0.00 
assign ( resid   47 and name   HN )  ( resid  103 and name  HB1 ) 5.17 3.37 0.00 
assign ( resid   47 and name   HN )  ( resid  103 and name  HB2 ) 5.07 3.27 0.00 
assign ( resid   47 and name HD1# )  ( resid   49 and name   HN ) 5.50 3.70 0.00 
assign ( resid   47 and name HD1# )  ( resid   53 and name   HA ) 4.29 2.49 0.00 
assign ( resid   47 and name HD1# )  ( resid   53 and name   HN ) 4.74 2.94 0.00 
assign ( resid   47 and name HD1# )  ( resid   53 and name  HB1 ) 5.50 3.70 0.00 
assign ( resid   47 and name HD1# )  ( resid   53 and name  HB2 ) 5.14 3.34 0.00 
assign ( resid   47 and name HD1# )  ( resid   53 and name  HD# ) 3.36 1.56 0.00 
assign ( resid   47 and name HD1# )  ( resid   53 and name  HE# ) 3.64 1.84 0.00 
assign ( resid   47 and name HD1# )  ( resid   56 and name   HN ) 5.09 3.29 0.00 
assign ( resid   47 and name HD1# )  ( resid   56 and name  HB1 ) 3.87 2.07 0.00 
assign ( resid   47 and name HD1# )  ( resid   56 and name  HD# ) 3.56 1.76 0.00 
assign ( resid   47 and name HD1# )  ( resid   57 and name   HN ) 4.77 2.97 0.00 
assign ( resid   47 and name HD1# )  ( resid   96 and name  HE# ) 3.72 1.92 0.00 
assign ( resid   47 and name HG11 )  ( resid   56 and name  HD# ) 5.44 3.64 0.00 
assign ( resid   47 and name HG11 )  ( resid   96 and name  HE# ) 4.30 2.50 0.00 
assign ( resid   47 and name HG11 )  ( resid  103 and name  HB1 ) 5.50 3.70 0.00 
assign ( resid   47 and name HG11 )  ( resid  103 and name  HB2 ) 5.50 3.70 0.00 
assign ( resid   47 and name HG11 )  ( resid  103 and name  HD# ) 5.50 3.70 0.00 
assign ( resid   47 and name HG11 )  ( resid  103 and name  HE# ) 5.50 3.70 0.00 
assign ( resid   47 and name HG12 )  ( resid   48 and name   HN ) 4.88 3.08 0.00 
assign ( resid   47 and name HG12 )  ( resid   53 and name   HA ) 5.50 3.70 0.00 
assign ( resid   47 and name HG12 )  ( resid   96 and name  HE# ) 3.86 2.06 0.00 
assign ( resid   47 and name HG12 )  ( resid  103 and name   HN ) 5.50 3.70 0.00 
assign ( resid   47 and name HG12 )  ( resid  103 and name  HB1 ) 5.50 3.70 0.00 
assign ( resid   47 and name HG12 )  ( resid  103 and name  HB2 ) 5.50 3.70 0.00 
assign ( resid   47 and name HG12 )  ( resid  103 and name  HD# ) 5.50 3.70 0.00 
assign ( resid   47 and name HG12 )  ( resid  103 and name  HE# ) 4.34 2.54 0.00 
assign ( resid   47 and name HG2# )  ( resid   47 and name HD1# ) 3.29 1.49 0.00 
assign ( resid   47 and name HG2# )  ( resid   47 and name HG11 ) 4.20 2.40 0.00 
assign ( resid   47 and name HG2# )  ( resid   47 and name HG12 ) 3.68 1.88 0.00 
assign ( resid   47 and name HG2# )  ( resid   48 and name   HN ) 3.28 1.48 0.00 
assign ( resid   47 and name HG2# )  ( resid   49 and name   HN ) 2.78 0.98 0.00 
assign ( resid   47 and name HG2# )  ( resid   52 and name   HN ) 3.88 2.08 0.00 
assign ( resid   47 and name HG2# )  ( resid   52 and name  HB1 ) 3.83 2.03 0.00 
assign ( resid   47 and name HG2# )  ( resid   52 and name  HB2 ) 3.83 2.03 0.00 
assign ( resid   47 and name HG2# )  ( resid   52 and name  HB# ) 3.35 1.55 0.00 
assign ( resid   47 and name HG2# )  ( resid   53 and name   HA ) 3.40 1.60 0.00 
assign ( resid   47 and name HG2# )  ( resid   53 and name   HN ) 2.98 1.18 0.00 
assign ( resid   47 and name HG2# )  ( resid   53 and name  HB1 ) 3.95 2.15 0.00 
assign ( resid   47 and name HG2# )  ( resid   53 and name  HB2 ) 3.57 1.77 0.00 
assign ( resid   47 and name HG2# )  ( resid   53 and name  HD# ) 3.27 1.47 0.00 
assign ( resid   47 and name HG2# )  ( resid   54 and name   HN ) 4.58 2.78 0.00 
assign ( resid   47 and name HG2# )  ( resid  103 and name  HD# ) 4.74 2.94 0.00 
assign ( resid   47 and name HG2# )  ( resid  103 and name  HE# ) 3.53 1.73 0.00 
assign ( resid   48 and name   HA )  ( resid   48 and name HG2# ) 3.16 1.36 0.00 
assign ( resid   48 and name   HB )  ( resid   49 and name   HN ) 3.83 2.03 0.00 
assign ( resid   48 and name   HN )  ( resid   48 and name   HB ) 3.96 2.16 0.00 
assign ( resid   48 and name   HN )  ( resid   48 and name HG2# ) 2.82 1.02 0.00 
assign ( resid   48 and name   HN )  ( resid   49 and name   HN ) 3.33 1.53 0.00 
assign ( resid   48 and name   HN )  ( resid   52 and name  HB1 ) 4.90 3.10 0.00 
assign ( resid   48 and name   HN )  ( resid   52 and name  HB2 ) 4.90 3.10 0.00 
assign ( resid   48 and name   HN )  ( resid   52 and name  HB# ) 4.20 2.40 0.00 
assign ( resid   48 and name   HN )  ( resid  102 and name   HA ) 5.50 3.70 0.00 
assign ( resid   48 and name   HN )  ( resid  102 and name HG1# ) 4.38 2.58 0.00 
assign ( resid   48 and name   HN )  ( resid  103 and name   HN ) 5.35 3.55 0.00 
assign ( resid   48 and name   HN )  ( resid  103 and name  HB1 ) 4.35 2.55 0.00 
assign ( resid   48 and name   HN )  ( resid  103 and name  HB2 ) 5.20 3.40 0.00 
assign ( resid   48 and name   HN )  ( resid  103 and name  HD# ) 5.08 3.28 0.00 
assign ( resid   48 and name HG2# )  ( resid   49 and name   HN ) 3.49 1.69 0.00 
assign ( resid   48 and name HG2# )  ( resid  102 and name   HB ) 4.96 3.16 0.00 
assign ( resid   48 and name HG2# )  ( resid  102 and name HG1# ) 3.15 1.35 0.00 
assign ( resid   48 and name HG2# )  ( resid  103 and name   HN ) 3.74 1.94 0.00 
assign ( resid   49 and name   HA )  ( resid   49 and name HG2# ) 3.20 1.40 0.00 
assign ( resid   49 and name   HA )  ( resid   52 and name   HN ) 5.30 3.50 0.00 
assign ( resid   49 and name   HB )  ( resid   51 and name   HN ) 2.93 1.13 0.00 
assign ( resid   49 and name   HB )  ( resid   51 and name  HB# ) 5.34 3.54 0.00 
assign ( resid   49 and name   HB )  ( resid   53 and name   HN ) 5.26 3.46 0.00 
assign ( resid   49 and name   HN )  ( resid   49 and name   HB ) 3.59 1.79 0.00 
assign ( resid   49 and name   HN )  ( resid   50 and name   HA ) 5.19 3.39 0.00 
assign ( resid   49 and name   HN )  ( resid   50 and name HG2# ) 5.50 3.70 0.00 
assign ( resid   49 and name   HN )  ( resid   51 and name   HN ) 5.28 3.48 0.00 
assign ( resid   49 and name   HN )  ( resid   52 and name   HN ) 3.72 1.92 0.00 
assign ( resid   49 and name   HN )  ( resid   52 and name  HB# ) 3.90 2.10 0.00 
assign ( resid   49 and name   HN )  ( resid   53 and name   HA ) 5.50 3.70 0.00 
assign ( resid   49 and name   HN )  ( resid   53 and name   HN ) 3.90 2.10 0.00 
assign ( resid   49 and name   HN )  ( resid   53 and name  HB2 ) 4.90 3.10 0.00 
assign ( resid   49 and name HG2# )  ( resid   50 and name HG2# ) 3.00 1.20 0.00 
assign ( resid   50 and name   HA )  ( resid   50 and name HG2# ) 3.49 1.69 0.00 
assign ( resid   50 and name   HA )  ( resid   53 and name   HN ) 3.21 1.41 0.00 
assign ( resid   50 and name   HA )  ( resid   53 and name  HB1 ) 3.57 1.77 0.00 
assign ( resid   50 and name   HA )  ( resid   53 and name  HB2 ) 3.88 2.08 0.00 
assign ( resid   50 and name   HA )  ( resid   53 and name  HD# ) 5.50 3.70 0.00 
assign ( resid   50 and name   HA )  ( resid   54 and name   HN ) 3.96 2.16 0.00 
assign ( resid   50 and name   HB )  ( resid   51 and name   HN ) 3.72 1.92 0.00 
assign ( resid   50 and name   HB )  ( resid   52 and name   HN ) 5.50 3.70 0.00 
assign ( resid   50 and name   HB )  ( resid   53 and name   HN ) 5.50 3.70 0.00 
assign ( resid   50 and name   HB )  ( resid   53 and name  HB1 ) 5.50 3.70 0.00 
assign ( resid   50 and name HG2# )  ( resid   51 and name   HA ) 4.05 2.25 0.00 
assign ( resid   50 and name HG2# )  ( resid   51 and name   HN ) 3.37 1.57 0.00 
assign ( resid   50 and name HG2# )  ( resid   52 and name   HN ) 4.25 2.45 0.00 
assign ( resid   50 and name HG2# )  ( resid   53 and name   HN ) 4.97 3.17 0.00 
assign ( resid   50 and name HG2# )  ( resid   53 and name  HD# ) 5.50 3.70 0.00 
assign ( resid   50 and name HG2# )  ( resid   54 and name   HN ) 5.07 3.27 0.00 
assign ( resid   51 and name   HA )  ( resid   51 and name  HG# ) 3.60 1.80 0.00 
assign ( resid   51 and name   HA )  ( resid   54 and name  HB2 ) 4.73 2.93 0.00 
assign ( resid   51 and name   HA )  ( resid   54 and name  HD# ) 4.20 2.40 0.00 
assign ( resid   51 and name   HA )  ( resid   54 and name  HG# ) 5.34 3.54 0.00 
assign ( resid   51 and name   HN )  ( resid   51 and name   HA ) 2.89 1.09 0.00 
assign ( resid   51 and name   HN )  ( resid   51 and name  HB# ) 2.62 0.82 0.00 
assign ( resid   51 and name   HN )  ( resid   51 and name  HG1 ) 3.73 1.93 0.00 
assign ( resid   51 and name   HN )  ( resid   51 and name  HG2 ) 3.73 1.93 0.00 
assign ( resid   51 and name   HN )  ( resid   51 and name  HG# ) 3.24 1.44 0.00 
assign ( resid   51 and name   HN )  ( resid   52 and name   HN ) 3.05 1.25 0.00 
assign ( resid   51 and name   HN )  ( resid   52 and name  HB# ) 4.91 3.11 0.00 
assign ( resid   51 and name   HN )  ( resid   53 and name   HN ) 4.73 2.93 0.00 
assign ( resid   51 and name   HN )  ( resid   54 and name   HN ) 5.39 3.59 0.00 
assign ( resid   51 and name   HN )  ( resid   54 and name  HD# ) 5.50 3.70 0.00 
assign ( resid   51 and name  HG# )  ( resid   52 and name   HN ) 4.80 3.00 0.00 
assign ( resid   52 and name   HA )  ( resid   54 and name   HN ) 4.80 3.00 0.00 
assign ( resid   52 and name   HA )  ( resid   55 and name   HN ) 3.36 1.56 0.00 
assign ( resid   52 and name   HA )  ( resid   55 and name  HB1 ) 3.77 1.97 0.00 
assign ( resid   52 and name   HA )  ( resid   55 and name  HB2 ) 4.07 2.27 0.00 
assign ( resid   52 and name   HA )  ( resid   56 and name   HN ) 4.62 2.82 0.00 
assign ( resid   52 and name   HA )  ( resid  103 and name  HD# ) 5.50 3.70 0.00 
assign ( resid   52 and name   HA )  ( resid  103 and name  HE# ) 3.84 2.04 0.00 
assign ( resid   52 and name   HN )  ( resid   52 and name  HB# ) 3.39 1.59 0.00 
assign ( resid   52 and name   HN )  ( resid   53 and name   HN ) 2.77 0.97 0.00 
assign ( resid   52 and name   HN )  ( resid   53 and name  HB1 ) 4.31 2.51 0.00 
assign ( resid   52 and name   HN )  ( resid   54 and name   HN ) 4.25 2.45 0.00 
assign ( resid   52 and name   HN )  ( resid   55 and name  HB2 ) 5.27 3.47 0.00 
assign ( resid   52 and name   HN )  ( resid  103 and name  HE# ) 5.36 3.56 0.00 
assign ( resid   52 and name  HB1 )  ( resid   53 and name   HN ) 3.32 1.52 0.00 
assign ( resid   52 and name  HB1 )  ( resid  103 and name  HD# ) 4.65 2.85 0.00 
assign ( resid   52 and name  HB2 )  ( resid   53 and name   HN ) 3.32 1.52 0.00 
assign ( resid   52 and name  HB2 )  ( resid  103 and name  HD# ) 4.65 2.85 0.00 
assign ( resid   52 and name  HB# )  ( resid   53 and name   HN ) 2.82 1.02 0.00 
assign ( resid   52 and name  HB# )  ( resid   54 and name   HN ) 5.34 3.54 0.00 
assign ( resid   52 and name  HB# )  ( resid  103 and name  HD# ) 4.03 2.23 0.00 
assign ( resid   52 and name  HB# )  ( resid  103 and name  HE# ) 2.85 1.05 0.00 
assign ( resid   53 and name   HA )  ( resid   53 and name  HD# ) 3.50 1.70 0.00 
assign ( resid   53 and name   HA )  ( resid   53 and name  HE# ) 4.93 3.13 0.00 
assign ( resid   53 and name   HA )  ( resid   56 and name  HB1 ) 4.71 2.91 0.00 
assign ( resid   53 and name   HA )  ( resid   56 and name  HB2 ) 4.83 3.03 0.00 
assign ( resid   53 and name   HA )  ( resid   56 and name  HD# ) 5.44 3.64 0.00 
assign ( resid   53 and name   HA )  ( resid   57 and name   HN ) 4.50 2.70 0.00 
assign ( resid   53 and name   HA )  ( resid  103 and name  HE# ) 4.20 2.40 0.00 
assign ( resid   53 and name   HN )  ( resid   53 and name   HA ) 2.94 1.14 0.00 
assign ( resid   53 and name   HN )  ( resid   53 and name  HB1 ) 2.64 0.84 0.00 
assign ( resid   53 and name   HN )  ( resid   53 and name  HB2 ) 2.69 0.89 0.00 
assign ( resid   53 and name   HN )  ( resid   54 and name   HN ) 3.14 1.34 0.00 
assign ( resid   53 and name   HN )  ( resid   54 and name  HD# ) 5.50 3.70 0.00 
assign ( resid   53 and name   HN )  ( resid   55 and name   HN ) 4.87 3.07 0.00 
assign ( resid   53 and name   HN )  ( resid   56 and name   HN ) 5.39 3.59 0.00 
assign ( resid   53 and name   HZ )  ( resid   57 and name  HB# ) 5.50 3.70 0.00 
assign ( resid   53 and name  HB1 )  ( resid   54 and name   HN ) 2.82 1.02 0.00 
assign ( resid   53 and name  HB1 )  ( resid   55 and name   HN ) 5.14 3.34 0.00 
assign ( resid   53 and name  HB2 )  ( resid   54 and name   HN ) 3.98 2.18 0.00 
assign ( resid   53 and name  HD# )  ( resid   53 and name   HZ ) 3.93 2.13 0.00 
assign ( resid   53 and name  HD# )  ( resid   54 and name   HA ) 4.65 2.85 0.00 
assign ( resid   53 and name  HD# )  ( resid   54 and name   HN ) 3.74 1.94 0.00 
assign ( resid   53 and name  HD# )  ( resid   54 and name  HD# ) 5.50 3.70 0.00 
assign ( resid   53 and name  HD# )  ( resid   54 and name  HG1 ) 4.30 2.50 0.00 
assign ( resid   53 and name  HD# )  ( resid   54 and name  HG2 ) 4.30 2.50 0.00 
assign ( resid   53 and name  HD# )  ( resid   54 and name  HG# ) 3.62 1.82 0.00 
assign ( resid   53 and name  HD# )  ( resid   57 and name   HN ) 5.50 3.70 0.00 
assign ( resid   53 and name  HD# )  ( resid   57 and name  HB# ) 5.50 3.70 0.00 
assign ( resid   53 and name  HE# )  ( resid   54 and name  HD# ) 5.48 3.68 0.00 
assign ( resid   53 and name  HE# )  ( resid   57 and name   HN ) 5.50 3.70 0.00 
assign ( resid   53 and name  HE# )  ( resid   57 and name  HB# ) 5.50 3.70 0.00 
assign ( resid   54 and name   HA )  ( resid   54 and name  HD# ) 4.26 2.46 0.00 
assign ( resid   54 and name   HA )  ( resid   54 and name  HE# ) 5.50 3.70 0.00 
assign ( resid   54 and name   HA )  ( resid   54 and name  HG1 ) 3.63 1.83 0.00 
assign ( resid   54 and name   HA )  ( resid   54 and name  HG2 ) 3.63 1.83 0.00 
assign ( resid   54 and name   HA )  ( resid   57 and name   HN ) 3.68 1.88 0.00 
assign ( resid   54 and name   HA )  ( resid   57 and name  HB# ) 3.46 1.66 0.00 
assign ( resid   54 and name   HA )  ( resid   58 and name   HN ) 4.33 2.53 0.00 
assign ( resid   54 and name   HN )  ( resid   54 and name  HB2 ) 2.50 0.70 0.00 
assign ( resid   54 and name   HN )  ( resid   54 and name  HG# ) 2.63 0.83 0.00 
assign ( resid   54 and name   HN )  ( resid   55 and name   HA ) 5.50 3.70 0.00 
assign ( resid   54 and name   HN )  ( resid   55 and name   HN ) 2.88 1.08 0.00 
assign ( resid   54 and name   HN )  ( resid   56 and name   HN ) 4.45 2.65 0.00 
assign ( resid   54 and name   HN )  ( resid   57 and name  HB# ) 5.02 3.22 0.00 
assign ( resid   54 and name  HB1 )  ( resid   54 and name  HD# ) 3.09 1.29 0.00 
assign ( resid   54 and name  HB1 )  ( resid   54 and name  HE# ) 5.13 3.33 0.00 
assign ( resid   54 and name  HB1 )  ( resid   57 and name  HB# ) 5.50 3.70 0.00 
assign ( resid   54 and name  HB2 )  ( resid   54 and name  HD# ) 2.57 0.77 0.00 
assign ( resid   54 and name  HB2 )  ( resid   54 and name  HE# ) 4.51 2.71 0.00 
assign ( resid   54 and name  HB2 )  ( resid   54 and name  HG# ) 2.59 0.79 0.00 
assign ( resid   54 and name  HB2 )  ( resid   55 and name   HN ) 2.82 1.02 0.00 
assign ( resid   54 and name  HD# )  ( resid   54 and name  HE# ) 2.86 1.06 0.00 
assign ( resid   54 and name  HG1 )  ( resid   54 and name  HE# ) 4.24 2.44 0.00 
assign ( resid   54 and name  HG2 )  ( resid   54 and name  HE# ) 4.24 2.44 0.00 
assign ( resid   54 and name  HG# )  ( resid   54 and name  HE# ) 3.43 1.63 0.00 
assign ( resid   54 and name  HG# )  ( resid   57 and name  HB# ) 5.34 3.54 0.00 
assign ( resid   55 and name   HA )  ( resid   55 and name  HD2 ) 5.50 3.70 0.00
assign ( resid   55 and name   HA )  ( resid   57 and name   HN ) 5.37 3.57 0.00 
assign ( resid   55 and name   HA )  ( resid   58 and name   HN ) 4.22 2.42 0.00 
assign ( resid   55 and name   HA )  ( resid   58 and name  HB# ) 4.04 2.24 0.00 
assign ( resid   55 and name   HA )  ( resid   58 and name  HD# ) 4.92 3.12 0.00 
assign ( resid   55 and name   HA )  ( resid   59 and name   HN ) 5.23 3.43 0.00 
assign ( resid   55 and name   HN )  ( resid   55 and name   HA ) 2.87 1.07 0.00 
assign ( resid   55 and name   HN )  ( resid   55 and name  HB1 ) 2.66 0.86 0.00  
assign ( resid   55 and name   HN )  ( resid   55 and name  HB2 ) 2.55 0.75 0.00 
assign ( resid   55 and name   HN )  ( resid   56 and name   HN ) 3.06 1.26 0.00 
assign ( resid   55 and name   HN )  ( resid   57 and name   HN ) 4.90 3.10 0.00 
assign ( resid   55 and name   HN )  ( resid   57 and name  HB# ) 5.20 3.40 0.00 
assign ( resid   55 and name  HB1 )  ( resid   56 and name   HN ) 2.98 1.18 0.00 
assign ( resid   55 and name  HB1 )  ( resid   57 and name   HN ) 5.38 3.58 0.00 
assign ( resid   55 and name  HB2 )  ( resid   56 and name   HN ) 3.67 1.87 0.00 
assign ( resid   55 and name  HD2 )  ( resid  105 and name   HA ) 5.50 3.70 0.00
assign ( resid   55 and name  HD2 )  ( resid  105 and name  HB1 ) 5.44 3.64 0.00
assign ( resid   55 and name  HD2 )  ( resid  105 and name  HB2 ) 5.44 3.64 0.00
assign ( resid   55 and name  HD2 )  ( resid  105 and name  HB# ) 4.67 2.87 0.00
assign ( resid   55 and name  HD2 )  ( resid   56 and name   HA ) 5.15 3.35 0.00
assign ( resid   55 and name  HD2 )  ( resid   56 and name  HB2 ) 5.50 3.70 0.00
assign ( resid   55 and name  HD2 )  ( resid   56 and name   HN ) 4.24 2.44 0.00
assign ( resid   56 and name   HA )  ( resid   55 and name  HD2 ) 3.50 1.70 0.00  
assign ( resid   56 and name   HA )  ( resid   56 and name  HD# ) 3.30 1.50 0.00 
assign ( resid   56 and name   HA )  ( resid   56 and name HD1# ) 4.47 2.67 0.00 
assign ( resid   56 and name   HA )  ( resid   56 and name HD2# ) 4.47 2.67 0.00 
assign ( resid   56 and name   HA )  ( resid   59 and name   HN ) 3.36 1.56 0.00 
assign ( resid   56 and name   HA )  ( resid   60 and name   HN ) 4.27 2.47 0.00 
assign ( resid   56 and name   HA )  ( resid   60 and name HD1# ) 5.50 3.70 0.00 
assign ( resid   56 and name   HA )  ( resid   95 and name  HE# ) 5.50 3.70 0.00 
assign ( resid   56 and name   HA )  ( resid  103 and name  HE# ) 5.50 3.70 0.00 
assign ( resid   56 and name   HG )  ( resid   60 and name   HG ) 5.49 3.69 0.00 
assign ( resid   56 and name   HG )  ( resid   99 and name   HZ ) 5.50 3.70 0.00 
assign ( resid   56 and name   HG )  ( resid   99 and name  HE# ) 4.69 2.89 0.00 
assign ( resid   56 and name   HN )  ( resid   56 and name  HB2 ) 2.56 0.76 0.00 
assign ( resid   56 and name   HN )  ( resid   56 and name  HD# ) 3.83 2.03 0.00 
assign ( resid   56 and name   HN )  ( resid   56 and name HD1# ) 4.49 2.69 0.00 
assign ( resid   56 and name   HN )  ( resid   56 and name HD2# ) 4.49 2.69 0.00 
assign ( resid   56 and name   HN )  ( resid   57 and name   HA ) 5.23 3.43 0.00 
assign ( resid   56 and name   HN )  ( resid   57 and name   HN ) 2.83 1.03 0.00 
assign ( resid   56 and name   HN )  ( resid   58 and name   HN ) 4.16 2.36 0.00 
assign ( resid   56 and name   HN )  ( resid   59 and name   HN ) 4.72 2.92 0.00 
assign ( resid   56 and name   HN )  ( resid  103 and name  HE# ) 4.14 2.34 0.00 
assign ( resid   56 and name  HB1 )  ( resid   56 and name HD1# ) 3.97 2.17 0.00 
assign ( resid   56 and name  HB1 )  ( resid   56 and name HD2# ) 3.97 2.17 0.00 
assign ( resid   56 and name  HB1 )  ( resid   57 and name   HN ) 2.81 1.01 0.00 
assign ( resid   56 and name  HB1 )  ( resid   58 and name   HN ) 4.80 3.00 0.00 
assign ( resid   56 and name  HB1 )  ( resid   60 and name HD1# ) 4.99 3.19 0.00 
assign ( resid   56 and name  HB1 )  ( resid   99 and name  HE# ) 5.50 3.70 0.00 
assign ( resid   56 and name  HB1 )  ( resid  103 and name  HE# ) 3.83 2.03 0.00 
assign ( resid   56 and name  HB2 )  ( resid   56 and name HD1# ) 3.88 2.08 0.00 
assign ( resid   56 and name  HB2 )  ( resid   56 and name HD2# ) 3.88 2.08 0.00 
assign ( resid   56 and name  HB2 )  ( resid   57 and name   HN ) 3.57 1.77 0.00 
assign ( resid   56 and name  HB2 )  ( resid   99 and name  HE# ) 5.50 3.70 0.00 
assign ( resid   56 and name  HB2 )  ( resid  103 and name  HE# ) 3.28 1.48 0.00 
assign ( resid   56 and name  HD# )  ( resid   57 and name   HA ) 5.44 3.64 0.00 
assign ( resid   56 and name  HD# )  ( resid   57 and name   HN ) 4.47 2.67 0.00 
assign ( resid   56 and name  HD# )  ( resid   59 and name   HN ) 4.16 2.36 0.00 
assign ( resid   56 and name  HD# )  ( resid   60 and name   HG ) 3.49 1.69 0.00 
assign ( resid   56 and name  HD# )  ( resid   60 and name   HN ) 4.03 2.23 0.00 
assign ( resid   56 and name  HD# )  ( resid   60 and name HD1# ) 3.37 1.57 0.00 
assign ( resid   56 and name  HD# )  ( resid   60 and name HD2# ) 3.73 1.93 0.00 
assign ( resid   56 and name  HD# )  ( resid   91 and name  HE# ) 5.44 3.64 0.00 
assign ( resid   56 and name  HD# )  ( resid   92 and name HG2# ) 5.44 3.64 0.00 
assign ( resid   56 and name  HD# )  ( resid   95 and name  HD# ) 3.79 1.99 0.00 
assign ( resid   56 and name  HD# )  ( resid   95 and name  HE# ) 2.73 0.93 0.00 
assign ( resid   56 and name  HD# )  ( resid   96 and name  HB1 ) 5.44 3.64 0.00 
assign ( resid   56 and name  HD# )  ( resid   96 and name  HE# ) 3.26 1.46 0.00 
assign ( resid   56 and name  HD# )  ( resid   98 and name  HD# ) 5.44 3.64 0.00 
assign ( resid   56 and name  HD# )  ( resid   99 and name  HD# ) 5.44 3.64 0.00 
assign ( resid   56 and name  HD# )  ( resid   99 and name  HE# ) 5.08 3.28 0.00 
assign ( resid   56 and name  HD# )  ( resid  103 and name  HE# ) 3.06 1.26 0.00 
assign ( resid   56 and name  HD# )  ( resid  105 and name   HA ) 5.37 3.57 0.00 
assign ( resid   56 and name  HD# )  ( resid  105 and name  HB# ) 4.10 2.30 0.00 
assign ( resid   56 and name  HD# )  ( resid  108 and name  HB2 ) 5.44 3.64 0.00 
assign ( resid   56 and name HD1# )  ( resid   60 and name   HG ) 4.21 2.41 0.00 
assign ( resid   56 and name HD1# )  ( resid   60 and name   HN ) 5.50 3.70 0.00 
assign ( resid   56 and name HD1# )  ( resid   60 and name HD1# ) 4.07 2.27 0.00 
assign ( resid   56 and name HD1# )  ( resid   95 and name  HD# ) 4.35 2.55 0.00 
assign ( resid   56 and name HD1# )  ( resid   95 and name  HE# ) 3.61 1.81 0.00 
assign ( resid   56 and name HD1# )  ( resid   96 and name  HE# ) 4.21 2.41 0.00 
assign ( resid   56 and name HD1# )  ( resid   99 and name   HZ ) 5.50 3.70 0.00 
assign ( resid   56 and name HD1# )  ( resid  103 and name  HD# ) 5.50 3.70 0.00 
assign ( resid   56 and name HD1# )  ( resid  103 and name  HE# ) 4.07 2.27 0.00 
assign ( resid   56 and name HD2# )  ( resid   59 and name   HN ) 5.50 3.70 0.00 
assign ( resid   56 and name HD2# )  ( resid   60 and name   HG ) 4.21 2.41 0.00 
assign ( resid   56 and name HD2# )  ( resid   60 and name   HN ) 5.50 3.70 0.00 
assign ( resid   56 and name HD2# )  ( resid   60 and name HD1# ) 4.07 2.27 0.00 
assign ( resid   56 and name HD2# )  ( resid   95 and name  HD# ) 4.35 2.55 0.00 
assign ( resid   56 and name HD2# )  ( resid   95 and name  HE# ) 3.61 1.81 0.00 
assign ( resid   56 and name HD2# )  ( resid   96 and name  HE# ) 4.21 2.41 0.00 
assign ( resid   56 and name HD2# )  ( resid   99 and name   HZ ) 5.50 3.70 0.00 
assign ( resid   56 and name HD2# )  ( resid  103 and name  HD# ) 5.50 3.70 0.00 
assign ( resid   56 and name HD2# )  ( resid  103 and name  HE# ) 4.07 2.27 0.00 
assign ( resid   57 and name   HA )  ( resid   58 and name   HN ) 3.55 1.75 0.00 
assign ( resid   57 and name   HA )  ( resid   59 and name   HN ) 4.80 3.00 0.00 
assign ( resid   57 and name   HA )  ( resid   60 and name   HN ) 3.93 2.13 0.00 
assign ( resid   57 and name   HA )  ( resid   60 and name  HB2 ) 4.39 2.59 0.00 
assign ( resid   57 and name   HA )  ( resid   60 and name HD1# ) 4.57 2.77 0.00 
assign ( resid   57 and name   HA )  ( resid   61 and name   HN ) 4.42 2.62 0.00 
assign ( resid   57 and name   HN )  ( resid   57 and name   HA ) 2.93 1.13 0.00 
assign ( resid   57 and name   HN )  ( resid   57 and name  HB# ) 2.42 0.62 0.00 
assign ( resid   57 and name   HN )  ( resid   58 and name   HN ) 2.84 1.04 0.00 
assign ( resid   57 and name   HN )  ( resid   58 and name  HG# ) 4.71 2.91 0.00 
assign ( resid   57 and name   HN )  ( resid   59 and name   HN ) 4.32 2.52 0.00 
assign ( resid   57 and name   HN )  ( resid   60 and name   HN ) 5.25 3.45 0.00 
assign ( resid   57 and name   HN )  ( resid  103 and name  HE# ) 5.50 3.70 0.00 
assign ( resid   57 and name  HB# )  ( resid   58 and name   HA ) 4.78 2.98 0.00 
assign ( resid   57 and name  HB# )  ( resid   58 and name   HN ) 3.10 1.30 0.00 
assign ( resid   57 and name  HB# )  ( resid   58 and name  HB# ) 4.46 2.66 0.00 
assign ( resid   57 and name  HB# )  ( resid   58 and name  HG# ) 5.34 3.54 0.00 
assign ( resid   57 and name  HB# )  ( resid   59 and name   HN ) 4.91 3.11 0.00 
assign ( resid   58 and name   HA )  ( resid   58 and name  HB# ) 2.68 0.88 0.00 
assign ( resid   58 and name   HA )  ( resid   58 and name  HD# ) 4.48 2.68 0.00 
assign ( resid   58 and name   HA )  ( resid   58 and name  HG# ) 3.62 1.82 0.00 
assign ( resid   58 and name   HA )  ( resid   61 and name   HB ) 3.46 1.66 0.00 
assign ( resid   58 and name   HA )  ( resid   61 and name HG2# ) 5.04 3.24 0.00 
assign ( resid   58 and name   HN )  ( resid   58 and name  HB# ) 2.85 1.05 0.00 
assign ( resid   58 and name   HN )  ( resid   58 and name  HD# ) 3.94 2.14 0.00 
assign ( resid   58 and name   HN )  ( resid   58 and name  HG# ) 2.95 1.15 0.00 
assign ( resid   58 and name   HN )  ( resid   59 and name   HN ) 2.86 1.06 0.00 
assign ( resid   58 and name   HN )  ( resid   60 and name   HN ) 4.37 2.57 0.00 
assign ( resid   58 and name  HB# )  ( resid   58 and name  HD# ) 3.20 1.40 0.00 
assign ( resid   58 and name  HB# )  ( resid   59 and name   HA ) 5.27 3.47 0.00 
assign ( resid   58 and name  HD# )  ( resid   59 and name   HA ) 5.50 3.70 0.00 
assign ( resid   58 and name  HD# )  ( resid   59 and name   HN ) 4.35 2.55 0.00 
assign ( resid   58 and name  HG# )  ( resid   59 and name   HN ) 4.45 2.65 0.00 
assign ( resid   59 and name   HA )  ( resid   62 and name  HB# ) 3.80 2.00 0.00 
assign ( resid   59 and name   HN )  ( resid   60 and name   HG ) 4.78 2.98 0.00 
assign ( resid   59 and name   HN )  ( resid   60 and name   HN ) 3.01 1.21 0.00 
assign ( resid   59 and name   HN )  ( resid   60 and name HD2# ) 5.50 3.70 0.00 
assign ( resid   59 and name   HN )  ( resid   61 and name   HB ) 5.50 3.70 0.00 
assign ( resid   60 and name   HA )  ( resid   60 and name   HG ) 3.81 2.01 0.00 
assign ( resid   60 and name   HA )  ( resid   60 and name HD1# ) 4.61 2.81 0.00 
assign ( resid   60 and name   HA )  ( resid   60 and name HD2# ) 3.18 1.38 0.00 
assign ( resid   60 and name   HA )  ( resid   62 and name   HN ) 5.50 3.70 0.00 
assign ( resid   60 and name   HA )  ( resid   91 and name  HE# ) 4.05 2.25 0.00 
assign ( resid   60 and name   HA )  ( resid   92 and name HD1# ) 4.73 2.93 0.00 
assign ( resid   60 and name   HG )  ( resid   61 and name   HN ) 4.06 2.26 0.00 
assign ( resid   60 and name   HG )  ( resid   62 and name   HN ) 5.50 3.70 0.00 
assign ( resid   60 and name   HG )  ( resid   91 and name  HE# ) 4.45 2.65 0.00 
assign ( resid   60 and name   HN )  ( resid   60 and name   HA ) 2.91 1.11 0.00 
assign ( resid   60 and name   HN )  ( resid   60 and name   HG ) 2.71 0.91 0.00 
assign ( resid   60 and name   HN )  ( resid   60 and name  HB1 ) 3.77 1.97 0.00 
assign ( resid   60 and name   HN )  ( resid   60 and name  HB2 ) 2.77 0.97 0.00 
assign ( resid   60 and name   HN )  ( resid   60 and name HD1# ) 3.37 1.57 0.00 
assign ( resid   60 and name   HN )  ( resid   60 and name HD2# ) 3.51 1.71 0.00 
assign ( resid   60 and name   HN )  ( resid   61 and name   HB ) 4.91 3.11 0.00 
assign ( resid   60 and name   HN )  ( resid   61 and name   HN ) 2.81 1.01 0.00 
assign ( resid   60 and name   HN )  ( resid   62 and name   HN ) 4.16 2.36 0.00 
assign ( resid   60 and name   HN )  ( resid   62 and name  HB# ) 5.50 3.70 0.00 
assign ( resid   60 and name   HN )  ( resid   63 and name   HN ) 4.72 2.92 0.00 
assign ( resid   60 and name  HB1 )  ( resid   60 and name HD1# ) 3.23 1.43 0.00 
assign ( resid   60 and name  HB1 )  ( resid   60 and name HD2# ) 3.50 1.70 0.00 
assign ( resid   60 and name  HB1 )  ( resid   92 and name   HN ) 5.50 3.70 0.00 
assign ( resid   60 and name  HB2 )  ( resid   60 and name HD1# ) 3.56 1.76 0.00 
assign ( resid   60 and name  HB2 )  ( resid   60 and name HD2# ) 3.97 2.17 0.00 
assign ( resid   60 and name  HB2 )  ( resid   61 and name   HN ) 2.89 1.09 0.00 
assign ( resid   60 and name  HB2 )  ( resid   62 and name   HN ) 4.75 2.95 0.00 
assign ( resid   60 and name  HB2 )  ( resid   92 and name HD1# ) 5.24 3.44 0.00 
assign ( resid   60 and name HD1# )  ( resid   61 and name   HN ) 4.33 2.53 0.00 
assign ( resid   60 and name HD1# )  ( resid   88 and name HG2# ) 5.50 3.70 0.00 
assign ( resid   60 and name HD1# )  ( resid   91 and name  HD# ) 5.10 3.30 0.00 
assign ( resid   60 and name HD1# )  ( resid   91 and name  HE# ) 4.70 2.90 0.00 
assign ( resid   60 and name HD1# )  ( resid   92 and name   HA ) 5.50 3.70 0.00 
assign ( resid   60 and name HD1# )  ( resid   92 and name   HN ) 5.50 3.70 0.00 
assign ( resid   60 and name HD1# )  ( resid   92 and name HD1# ) 3.23 1.43 0.00 
assign ( resid   60 and name HD1# )  ( resid   92 and name HG11 ) 4.60 2.80 0.00 
assign ( resid   60 and name HD1# )  ( resid   92 and name HG2# ) 3.48 1.68 0.00 
assign ( resid   60 and name HD1# )  ( resid   95 and name  HD# ) 4.02 2.22 0.00 
assign ( resid   60 and name HD1# )  ( resid   95 and name  HE# ) 4.38 2.58 0.00 
assign ( resid   60 and name HD1# )  ( resid   96 and name   HN ) 5.44 3.64 0.00 
assign ( resid   60 and name HD2# )  ( resid   61 and name   HN ) 4.87 3.07 0.00 
assign ( resid   60 and name HD2# )  ( resid   62 and name   HN ) 5.50 3.70 0.00 
assign ( resid   60 and name HD2# )  ( resid   63 and name   HN ) 5.08 3.28 0.00 
assign ( resid   60 and name HD2# )  ( resid   64 and name   HN ) 5.50 3.70 0.00 
assign ( resid   60 and name HD2# )  ( resid   88 and name HG2# ) 5.50 3.70 0.00 
assign ( resid   60 and name HD2# )  ( resid   91 and name  HD# ) 4.09 2.29 0.00 
assign ( resid   60 and name HD2# )  ( resid   91 and name  HE# ) 2.94 1.14 0.00 
assign ( resid   60 and name HD2# )  ( resid   92 and name   HA ) 5.25 3.45 0.00 
assign ( resid   60 and name HD2# )  ( resid   92 and name HD1# ) 3.57 1.77 0.00 
assign ( resid   60 and name HD2# )  ( resid   92 and name HG11 ) 4.86 3.06 0.00 
assign ( resid   60 and name HD2# )  ( resid   92 and name HG12 ) 5.27 3.47 0.00 
assign ( resid   60 and name HD2# )  ( resid   92 and name HG2# ) 4.75 2.95 0.00 
assign ( resid   60 and name HD2# )  ( resid   95 and name   HN ) 5.22 3.42 0.00 
assign ( resid   60 and name HD2# )  ( resid   95 and name  HB1 ) 5.50 3.70 0.00 
assign ( resid   60 and name HD2# )  ( resid   95 and name  HB2 ) 5.50 3.70 0.00 
assign ( resid   60 and name HD2# )  ( resid   95 and name  HD# ) 3.59 1.79 0.00 
assign ( resid   60 and name HD2# )  ( resid   95 and name  HE# ) 3.51 1.71 0.00 
assign ( resid   60 and name HD2# )  ( resid   96 and name   HN ) 5.50 3.70 0.00 
assign ( resid   61 and name   HA )  ( resid   61 and name HG2# ) 3.44 1.64 0.00 
assign ( resid   61 and name   HA )  ( resid   63 and name   HN ) 4.92 3.12 0.00 
assign ( resid   61 and name   HA )  ( resid   64 and name   HB ) 4.47 2.67 0.00 
assign ( resid   61 and name   HN )  ( resid   61 and name   HB ) 2.64 0.84 0.00 
assign ( resid   61 and name HG2# )  ( resid   62 and name   HN ) 3.88 2.08 0.00 
assign ( resid   61 and name HG2# )  ( resid   64 and name   HB ) 5.27 3.47 0.00 
assign ( resid   62 and name   HA )  ( resid   62 and name  HD2 ) 5.50 3.70 0.00
assign ( resid   62 and name   HA )  ( resid   63 and name   HN ) 3.54 1.74 0.00 
assign ( resid   62 and name   HA )  ( resid   64 and name   HN ) 4.68 2.88 0.00 
assign ( resid   62 and name   HA )  ( resid   65 and name  HB1 ) 4.03 2.23 0.00 
assign ( resid   62 and name   HA )  ( resid   65 and name  HB2 ) 4.24 2.44 0.00 
assign ( resid   62 and name   HA )  ( resid   65 and name  HE# ) 4.31 2.51 0.00 
assign ( resid   62 and name   HN )  ( resid   62 and name  HB# ) 2.50 0.70 0.00 
assign ( resid   62 and name   HN )  ( resid   63 and name   HN ) 2.96 1.16 0.00 
assign ( resid   62 and name   HN )  ( resid   64 and name   HN ) 4.56 2.76 0.00 
assign ( resid   62 and name   HN )  ( resid   65 and name   HN ) 5.02 3.22 0.00 
assign ( resid   62 and name  HB# )  ( resid   63 and name   HN ) 3.03 1.23 0.00 
assign ( resid   62 and name  HB# )  ( resid   64 and name   HN ) 4.95 3.15 0.00 
assign ( resid   62 and name  HB# )  ( resid   65 and name   HN ) 5.21 3.41 0.00 
assign ( resid   62 and name  HB# )  ( resid   66 and name HD22 ) 5.50 3.70 0.00 
assign ( resid   62 and name  HD2 )  ( resid   63 and name  HA1 ) 5.50 3.70 0.00 
assign ( resid   62 and name  HD2 )  ( resid   63 and name  HA2 ) 5.50 3.70 0.00 
assign ( resid   63 and name   HN )  ( resid   63 and name  HA1 ) 2.40 0.60 0.00 
assign ( resid   63 and name   HN )  ( resid   64 and name   HB ) 5.13 3.33 0.00 
assign ( resid   63 and name   HN )  ( resid   64 and name   HN ) 3.00 1.20 0.00 
assign ( resid   63 and name   HN )  ( resid   64 and name  HG# ) 4.46 2.66 0.00 
assign ( resid   63 and name   HN )  ( resid   65 and name   HN ) 4.38 2.58 0.00 
assign ( resid   63 and name  HA1 )  ( resid   64 and name   HN ) 3.00 1.20 0.00 
assign ( resid   63 and name  HA1 )  ( resid   66 and name  HB1 ) 5.50 3.70 0.00 
assign ( resid   63 and name  HA1 )  ( resid   66 and name  HB2 ) 5.40 3.60 0.00 
assign ( resid   63 and name  HA1 )  ( resid   91 and name  HE# ) 4.66 2.86 0.00 
assign ( resid   63 and name  HA2 )  ( resid   66 and name   HN ) 3.90 2.10 0.00 
assign ( resid   63 and name  HA2 )  ( resid   66 and name  HB1 ) 4.66 2.86 0.00 
assign ( resid   63 and name  HA2 )  ( resid   66 and name  HB2 ) 4.64 2.84 0.00 
assign ( resid   63 and name  HA2 )  ( resid   66 and name HD22 ) 5.50 3.70 0.00 
assign ( resid   64 and name   HA )  ( resid   64 and name  HG# ) 3.00 1.20 0.00 
assign ( resid   64 and name   HA )  ( resid   64 and name HG1# ) 3.56 1.76 0.00 
assign ( resid   64 and name   HA )  ( resid   64 and name HG2# ) 3.56 1.76 0.00 
assign ( resid   64 and name   HA )  ( resid   66 and name   HN ) 4.87 3.07 0.00 
assign ( resid   64 and name   HA )  ( resid   67 and name   HN ) 3.96 2.16 0.00 
assign ( resid   64 and name   HA )  ( resid   67 and name  HB# ) 3.53 1.73 0.00 
assign ( resid   64 and name   HA )  ( resid   91 and name  HE# ) 5.50 3.70 0.00 
assign ( resid   64 and name   HB )  ( resid   91 and name  HE# ) 5.50 3.70 0.00 
assign ( resid   64 and name   HN )  ( resid   64 and name   HA ) 2.91 1.11 0.00 
assign ( resid   64 and name   HN )  ( resid   64 and name   HB ) 2.55 0.75 0.00 
assign ( resid   64 and name   HN )  ( resid   64 and name  HG# ) 2.55 0.75 0.00 
assign ( resid   64 and name   HN )  ( resid   65 and name   HN ) 2.84 1.04 0.00 
assign ( resid   64 and name   HN )  ( resid   66 and name   HN ) 4.57 2.77 0.00 
assign ( resid   64 and name   HN )  ( resid   66 and name  HB2 ) 5.50 3.70 0.00 
assign ( resid   64 and name   HN )  ( resid   67 and name   HN ) 5.50 3.70 0.00 
assign ( resid   64 and name   HN )  ( resid   91 and name  HD# ) 5.02 3.22 0.00 
assign ( resid   64 and name  HG# )  ( resid   65 and name   HA ) 4.46 2.66 0.00 
assign ( resid   64 and name  HG# )  ( resid   65 and name   HN ) 3.55 1.75 0.00 
assign ( resid   64 and name  HG# )  ( resid   66 and name   HN ) 5.09 3.29 0.00 
assign ( resid   64 and name  HG# )  ( resid   67 and name   HN ) 5.10 3.30 0.00 
assign ( resid   64 and name  HG# )  ( resid   68 and name   HN ) 4.74 2.94 0.00 
assign ( resid   64 and name  HG# )  ( resid   68 and name  HG1 ) 5.44 3.64 0.00 
assign ( resid   64 and name  HG# )  ( resid   68 and name  HG2 ) 3.97 2.17 0.00 
assign ( resid   64 and name  HG# )  ( resid   84 and name   HN ) 5.44 3.64 0.00  
assign ( resid   64 and name  HG# )  ( resid   84 and name HG1# ) 3.58 1.78 0.00 
assign ( resid   64 and name  HG# )  ( resid   88 and name   HA ) 5.01 3.21 0.00 
assign ( resid   64 and name  HG# )  ( resid   88 and name   HB ) 4.82 3.02 0.00 
assign ( resid   64 and name  HG# )  ( resid   88 and name   HN ) 4.46 2.66 0.00 
assign ( resid   64 and name  HG# )  ( resid   88 and name HG2# ) 3.14 1.34 0.00 
assign ( resid   64 and name  HG# )  ( resid   89 and name   HN ) 5.09 3.29 0.00 
assign ( resid   64 and name  HG# )  ( resid   91 and name  HD# ) 3.02 1.22 0.00 
assign ( resid   64 and name  HG# )  ( resid   91 and name  HE# ) 3.15 1.35 0.00 
assign ( resid   64 and name  HG# )  ( resid   92 and name HD1# ) 4.06 2.26 0.00 
assign ( resid   65 and name   HA )  ( resid   65 and name  HE# ) 5.12 3.32 0.00 
assign ( resid   65 and name   HA )  ( resid   65 and name  HG1 ) 3.98 2.18 0.00 
assign ( resid   65 and name   HA )  ( resid   65 and name  HG2 ) 3.98 2.18 0.00 
assign ( resid   65 and name   HA )  ( resid   65 and name  HG# ) 3.41 1.61 0.00 
assign ( resid   65 and name   HA )  ( resid   68 and name   HN ) 3.76 1.96 0.00 
assign ( resid   65 and name   HA )  ( resid   78 and name HD1# ) 5.36 3.56 0.00 
assign ( resid   65 and name   HN )  ( resid   65 and name  HB1 ) 2.52 0.72 0.00 
assign ( resid   65 and name   HN )  ( resid   65 and name  HB2 ) 2.85 1.05 0.00 
assign ( resid   65 and name   HN )  ( resid   67 and name   HN ) 4.36 2.56 0.00 
assign ( resid   65 and name  HB1 )  ( resid   65 and name  HE# ) 3.66 1.86 0.00 
assign ( resid   65 and name  HB1 )  ( resid   66 and name   HN ) 2.93 1.13 0.00 
assign ( resid   65 and name  HB1 )  ( resid   78 and name HD1# ) 5.44 3.64 0.00 
assign ( resid   65 and name  HB2 )  ( resid   66 and name   HN ) 4.56 2.76 0.00 
assign ( resid   65 and name  HE# )  ( resid   66 and name   HA ) 5.50 3.70 0.00 
assign ( resid   65 and name  HE# )  ( resid   69 and name  HB2 ) 5.45 3.65 0.00 
assign ( resid   65 and name  HE# )  ( resid   69 and name  HD# ) 3.58 1.78 0.00 
assign ( resid   65 and name  HE# )  ( resid   78 and name HD2# ) 4.08 2.28 0.00 
assign ( resid   65 and name  HG1 )  ( resid   69 and name   HG ) 5.02 3.22 0.00 
assign ( resid   65 and name  HG1 )  ( resid   78 and name HD1# ) 5.12 3.32 0.00 
assign ( resid   65 and name  HG2 )  ( resid   69 and name   HG ) 5.02 3.22 0.00 
assign ( resid   65 and name  HG2 )  ( resid   78 and name HD1# ) 5.12 3.32 0.00 
assign ( resid   65 and name  HG# )  ( resid   68 and name   HN ) 5.17 3.37 0.00 
assign ( resid   65 and name  HG# )  ( resid   69 and name  HD# ) 3.69 1.89 0.00 
assign ( resid   65 and name  HG# )  ( resid   78 and name   HG ) 4.87 3.07 0.00 
assign ( resid   65 and name  HG# )  ( resid   78 and name HD1# ) 4.29 2.49 0.00 
assign ( resid   65 and name  HG# )  ( resid   78 and name HD2# ) 4.07 2.27 0.00 
assign ( resid   66 and name   HA )  ( resid   66 and name HD22 ) 5.50 3.70 0.00 
assign ( resid   66 and name   HA )  ( resid   69 and name   HG ) 5.50 3.70 0.00 
assign ( resid   66 and name   HA )  ( resid   69 and name   HN ) 3.63 1.83 0.00 
assign ( resid   66 and name   HA )  ( resid   69 and name  HB1 ) 4.51 2.71 0.00 
assign ( resid   66 and name   HA )  ( resid   69 and name  HB2 ) 4.47 2.67 0.00 
assign ( resid   66 and name   HA )  ( resid   69 and name  HD# ) 3.76 1.96 0.00 
assign ( resid   66 and name   HA )  ( resid   70 and name   HN ) 4.84 3.04 0.00 
assign ( resid   66 and name   HN )  ( resid   66 and name  HB1 ) 3.37 1.57 0.00 
assign ( resid   66 and name   HN )  ( resid   66 and name  HB2 ) 2.58 0.78 0.00 
assign ( resid   66 and name   HN )  ( resid   66 and name HD21 ) 5.00 3.20 0.00 
assign ( resid   66 and name   HN )  ( resid   66 and name HD22 ) 4.13 2.33 0.00 
assign ( resid   66 and name   HN )  ( resid   67 and name   HN ) 2.89 1.09 0.00 
assign ( resid   66 and name   HN )  ( resid   67 and name  HB# ) 5.24 3.44 0.00 
assign ( resid   66 and name   HN )  ( resid   69 and name   HG ) 5.50 3.70 0.00 
assign ( resid   66 and name   HN )  ( resid   69 and name  HB2 ) 5.50 3.70 0.00 
assign ( resid   66 and name  HB1 )  ( resid   67 and name   HA ) 4.95 3.15 0.00 
assign ( resid   66 and name  HB1 )  ( resid   67 and name   HN ) 3.71 1.91 0.00 
assign ( resid   66 and name  HB2 )  ( resid   66 and name HD21 ) 3.60 1.80 0.00 
assign ( resid   66 and name  HB2 )  ( resid   66 and name HD22 ) 3.36 1.56 0.00 
assign ( resid   66 and name  HB2 )  ( resid   67 and name   HA ) 5.50 3.70 0.00 
assign ( resid   66 and name  HB2 )  ( resid   67 and name   HN ) 3.78 1.98 0.00 
assign ( resid   67 and name   HA )  ( resid   67 and name  HB# ) 2.99 1.19 0.00 
assign ( resid   67 and name   HA )  ( resid   68 and name   HN ) 3.55 1.75 0.00 
assign ( resid   67 and name   HA )  ( resid   70 and name   HN ) 4.24 2.44 0.00 
assign ( resid   67 and name   HA )  ( resid   70 and name  HB# ) 4.20 2.40 0.00 
assign ( resid   67 and name   HA )  ( resid   70 and name  HD# ) 3.05 1.25 0.00 
assign ( resid   67 and name   HA )  ( resid   70 and name  HE# ) 4.35 2.55 0.00 
assign ( resid   67 and name   HA )  ( resid   70 and name  HG# ) 4.99 3.19 0.00 
assign ( resid   67 and name   HN )  ( resid   67 and name   HA ) 2.91 1.11 0.00 
assign ( resid   67 and name   HN )  ( resid   67 and name  HB# ) 2.83 1.03 0.00 
assign ( resid   67 and name   HN )  ( resid   68 and name   HN ) 2.78 0.98 0.00 
assign ( resid   67 and name   HN )  ( resid   68 and name  HG1 ) 5.50 3.70 0.00 
assign ( resid   67 and name   HN )  ( resid   68 and name  HG2 ) 4.47 2.67 0.00 
assign ( resid   67 and name   HN )  ( resid   69 and name   HN ) 4.76 2.96 0.00 
assign ( resid   67 and name   HN )  ( resid   69 and name  HD# ) 5.44 3.64 0.00 
assign ( resid   67 and name   HN )  ( resid   70 and name   HN ) 4.92 3.12 0.00 
assign ( resid   67 and name   HN )  ( resid   70 and name  HB# ) 5.34 3.54 0.00 
assign ( resid   67 and name   HN )  ( resid   70 and name  HG# ) 5.34 3.54 0.00 
assign ( resid   67 and name  HB# )  ( resid   68 and name   HN ) 3.09 1.29 0.00 
assign ( resid   68 and name   HA )  ( resid   68 and name  HG1 ) 4.25 2.45 0.00 
assign ( resid   68 and name   HA )  ( resid   71 and name   HN ) 3.72 1.92 0.00 
assign ( resid   68 and name   HA )  ( resid   71 and name  HB1 ) 5.50 3.70 0.00 
assign ( resid   68 and name   HA )  ( resid   71 and name  HB2 ) 4.97 3.17 0.00 
assign ( resid   68 and name   HA )  ( resid   72 and name  HB2 ) 5.34 3.54 0.00 
assign ( resid   68 and name   HA )  ( resid   78 and name HD1# ) 5.50 3.70 0.00 
assign ( resid   68 and name   HN )  ( resid   68 and name  HB1 ) 2.60 0.80 0.00  
assign ( resid   68 and name   HN )  ( resid   68 and name  HB1 ) 2.60 0.80 0.00  
assign ( resid   68 and name   HN )  ( resid   68 and name  HG1 ) 3.14 1.34 0.00 
assign ( resid   68 and name   HN )  ( resid   68 and name  HG2 ) 2.94 1.14 0.00 
assign ( resid   68 and name   HN )  ( resid   69 and name   HN ) 2.55 0.75 0.00 
assign ( resid   68 and name   HN )  ( resid   69 and name  HD# ) 4.93 3.13 0.00 
assign ( resid   68 and name   HN )  ( resid   70 and name   HN ) 3.93 2.13 0.00 
assign ( resid   68 and name   HN )  ( resid   70 and name  HG# ) 5.34 3.54 0.00 
assign ( resid   68 and name   HN )  ( resid   78 and name HD1# ) 4.73 2.93 0.00 
assign ( resid   68 and name  HB1 )  ( resid   78 and name HD1# ) 4.78 2.98 0.00  
assign ( resid   68 and name  HB2 )  ( resid   68 and name  HG1 ) 2.88 1.08 0.00 
assign ( resid   68 and name  HB# )  ( resid   69 and name   HN ) 3.77 1.97 0.00 
assign ( resid   68 and name  HB2 )  ( resid   70 and name   HN ) 5.32 3.52 0.00 
assign ( resid   68 and name  HB2 )  ( resid   78 and name HD1# ) 3.77 1.97 0.00 
assign ( resid   68 and name  HG1 )  ( resid   70 and name   HN ) 5.50 3.70 0.00 
assign ( resid   68 and name  HG1 )  ( resid   78 and name   HG ) 5.50 3.70 0.00 
assign ( resid   68 and name  HG1 )  ( resid   78 and name HD1# ) 4.51 2.71 0.00 
assign ( resid   68 and name  HG1 )  ( resid   84 and name HG1# ) 4.91 3.11 0.00 
assign ( resid   68 and name  HG2 )  ( resid   78 and name HD1# ) 5.40 3.60 0.00 
assign ( resid   68 and name  HG2 )  ( resid   84 and name HG2# ) 5.50 3.70 0.00 
assign ( resid   68 and name  HG2 )  ( resid   84 and name HG1# ) 4.39 2.59 0.00 
assign ( resid   69 and name   HA )  ( resid   69 and name   HG ) 3.82 2.02 0.00 
assign ( resid   69 and name   HA )  ( resid   69 and name  HD# ) 3.16 1.36 0.00 
assign ( resid   69 and name   HA )  ( resid   69 and name HD1# ) 4.43 2.63 0.00 
assign ( resid   69 and name   HA )  ( resid   69 and name HD2# ) 4.43 2.63 0.00 
assign ( resid   69 and name   HA )  ( resid   72 and name   HN ) 3.71 1.91 0.00 
assign ( resid   69 and name   HA )  ( resid   72 and name  HB1 ) 4.30 2.50 0.00 
assign ( resid   69 and name   HA )  ( resid   72 and name  HB2 ) 4.20 2.40 0.00 
assign ( resid   69 and name   HA )  ( resid   78 and name HD1# ) 4.33 2.53 0.00 
assign ( resid   69 and name   HG )  ( resid   78 and name HD1# ) 4.18 2.38 0.00 
assign ( resid   69 and name   HG )  ( resid   78 and name HD2# ) 4.76 2.96 0.00 
assign ( resid   69 and name   HN )  ( resid   69 and name   HG ) 3.86 2.06 0.00 
assign ( resid   69 and name   HN )  ( resid   69 and name  HB2 ) 3.26 1.46 0.00 
assign ( resid   69 and name   HN )  ( resid   69 and name  HD# ) 3.44 1.64 0.00 
assign ( resid   69 and name   HN )  ( resid   69 and name HD1# ) 4.20 2.40 0.00 
assign ( resid   69 and name   HN )  ( resid   69 and name HD2# ) 4.20 2.40 0.00 
assign ( resid   69 and name   HN )  ( resid   70 and name   HN ) 2.90 1.10 0.00 
assign ( resid   69 and name   HN )  ( resid   70 and name  HG# ) 4.97 3.17 0.00 
assign ( resid   69 and name   HN )  ( resid   71 and name   HN ) 5.04 3.24 0.00 
assign ( resid   69 and name   HN )  ( resid   72 and name   HN ) 5.07 3.27 0.00 
assign ( resid   69 and name   HN )  ( resid   72 and name  HB2 ) 4.56 2.76 0.00 
assign ( resid   69 and name   HN )  ( resid   78 and name HD1# ) 3.94 2.14 0.00 
assign ( resid   69 and name  HB1 )  ( resid   69 and name HD1# ) 3.89 2.09 0.00 
assign ( resid   69 and name  HB1 )  ( resid   69 and name HD2# ) 3.89 2.09 0.00 
assign ( resid   69 and name  HB2 )  ( resid   78 and name HD1# ) 5.50 3.70 0.00 
assign ( resid   69 and name  HB2 )  ( resid   78 and name HD2# ) 5.50 3.70 0.00 
assign ( resid   69 and name  HB2 )  ( resid   69 and name HD1# ) 3.71 1.91 0.00 
assign ( resid   69 and name  HB2 )  ( resid   69 and name HD2# ) 3.71 1.91 0.00 
assign ( resid   69 and name  HB2 )  ( resid   70 and name   HN ) 3.60 1.80 0.00 
assign ( resid   69 and name  HB2 )  ( resid   71 and name   HN ) 5.50 3.70 0.00 
assign ( resid   69 and name  HD# )  ( resid   70 and name   HN ) 4.72 2.92 0.00 
assign ( resid   69 and name  HD# )  ( resid   72 and name   HN ) 5.50 3.70 0.00 
assign ( resid   69 and name  HD# )  ( resid   72 and name  HB1 ) 4.89 3.09 0.00 
assign ( resid   69 and name  HD# )  ( resid   72 and name  HB2 ) 4.94 3.14 0.00 
assign ( resid   69 and name  HD# )  ( resid   75 and name   HA ) 3.96 2.16 0.00 
assign ( resid   69 and name  HD# )  ( resid   75 and name  HB1 ) 4.16 2.36 0.00 
assign ( resid   69 and name  HD# )  ( resid   75 and name  HB2 ) 4.46 2.66 0.00 
assign ( resid   69 and name  HD# )  ( resid   75 and name  HG# ) 4.93 3.13 0.00 
assign ( resid   69 and name  HD# )  ( resid   76 and name   HN ) 5.42 3.62 0.00 
assign ( resid   69 and name  HD# )  ( resid   77 and name   HN ) 5.44 3.64 0.00 
assign ( resid   69 and name  HD# )  ( resid   78 and name   HN ) 5.44 3.64 0.00 
assign ( resid   69 and name  HD# )  ( resid   78 and name HD1# ) 3.56 1.76 0.00 
assign ( resid   69 and name  HD# )  ( resid   78 and name HD2# ) 3.95 2.15 0.00 
assign ( resid   69 and name HD1# )  ( resid   70 and name   HN ) 5.50 3.70 0.00 
assign ( resid   69 and name HD1# )  ( resid   78 and name  HB1 ) 5.50 3.70 0.00 
assign ( resid   69 and name HD1# )  ( resid   78 and name HD1# ) 4.41 2.61 0.00 
assign ( resid   69 and name HD2# )  ( resid   70 and name   HN ) 5.50 3.70 0.00 
assign ( resid   69 and name HD2# )  ( resid   78 and name  HB1 ) 5.50 3.70 0.00 
assign ( resid   69 and name HD2# )  ( resid   78 and name HD1# ) 4.41 2.61 0.00 
assign ( resid   70 and name   HA )  ( resid   70 and name  HD# ) 4.45 2.65 0.00 
assign ( resid   70 and name   HA )  ( resid   70 and name  HE# ) 4.96 3.16 0.00 
assign ( resid   70 and name   HA )  ( resid   70 and name  HG1 ) 4.04 2.24 0.00 
assign ( resid   70 and name   HA )  ( resid   70 and name  HG2 ) 4.04 2.24 0.00 
assign ( resid   70 and name   HA )  ( resid   71 and name  HD# ) 5.50 3.70 0.00 
assign ( resid   70 and name   HA )  ( resid   71 and name  HE# ) 5.50 3.70 0.00 
assign ( resid   70 and name   HA )  ( resid   72 and name   HN ) 4.41 2.61 0.00 
assign ( resid   70 and name   HN )  ( resid   70 and name  HB# ) 2.75 0.95 0.00 
assign ( resid   70 and name   HN )  ( resid   70 and name  HE# ) 5.50 3.70 0.00 
assign ( resid   70 and name   HN )  ( resid   70 and name  HG1 ) 3.94 2.14 0.00 
assign ( resid   70 and name   HN )  ( resid   70 and name  HG2 ) 3.94 2.14 0.00 
assign ( resid   70 and name   HN )  ( resid   70 and name  HG# ) 3.13 1.33 0.00 
assign ( resid   70 and name   HN )  ( resid   72 and name   HN ) 4.27 2.47 0.00 
assign ( resid   70 and name   HN )  ( resid   72 and name  HB2 ) 5.50 3.70 0.00 
assign ( resid   70 and name  HB1 )  ( resid   70 and name  HD# ) 3.16 1.36 0.00 
assign ( resid   70 and name  HB2 )  ( resid   70 and name  HD# ) 3.16 1.36 0.00 
assign ( resid   70 and name  HB# )  ( resid   70 and name  HD# ) 2.45 0.65 0.00 
assign ( resid   70 and name  HB# )  ( resid   70 and name  HE# ) 3.96 2.16 0.00 
assign ( resid   70 and name  HB# )  ( resid   71 and name   HN ) 3.98 2.18 0.00 
assign ( resid   70 and name  HB# )  ( resid   71 and name  HD# ) 4.50 2.70 0.00 
assign ( resid   70 and name  HB# )  ( resid   71 and name  HE# ) 5.03 3.23 0.00 
assign ( resid   70 and name  HD# )  ( resid   71 and name  HD# ) 3.68 1.88 0.00 
assign ( resid   70 and name  HD# )  ( resid   71 and name  HE# ) 3.29 1.49 0.00 
assign ( resid   70 and name  HE# )  ( resid   71 and name  HE# ) 4.86 3.06 0.00 
assign ( resid   70 and name  HG1 )  ( resid   70 and name  HE# ) 4.22 2.42 0.00 
assign ( resid   70 and name  HG1 )  ( resid   71 and name   HN ) 4.67 2.87 0.00 
assign ( resid   70 and name  HG2 )  ( resid   70 and name  HE# ) 4.22 2.42 0.00 
assign ( resid   70 and name  HG2 )  ( resid   71 and name   HN ) 4.67 2.87 0.00 
assign ( resid   70 and name  HG# )  ( resid   70 and name  HE# ) 3.65 1.85 0.00 
assign ( resid   70 and name  HG# )  ( resid   71 and name  HD# ) 4.70 2.90 0.00 
assign ( resid   70 and name  HG# )  ( resid   71 and name  HE# ) 4.84 3.04 0.00 
assign ( resid   70 and name  HG# )  ( resid   72 and name   HN ) 5.34 3.54 0.00 
assign ( resid   71 and name   HA )  ( resid   71 and name  HD# ) 3.08 1.28 0.00 
assign ( resid   71 and name   HA )  ( resid   71 and name  HE# ) 5.00 3.20 0.00 
assign ( resid   71 and name   HN )  ( resid   71 and name  HB1 ) 3.74 1.94 0.00 
assign ( resid   71 and name   HN )  ( resid   71 and name  HB2 ) 2.73 0.93 0.00 
assign ( resid   71 and name   HN )  ( resid   72 and name   HN ) 2.63 0.83 0.00 
assign ( resid   71 and name   HN )  ( resid   73 and name  HG# ) 5.34 3.54 0.00 
assign ( resid   71 and name  HB1 )  ( resid   72 and name   HN ) 4.43 2.63 0.00 
assign ( resid   71 and name  HD# )  ( resid   73 and name  HG# ) 5.34 3.54 0.00 
assign ( resid   72 and name   HA )  ( resid   74 and name   HN ) 4.23 2.43 0.00 
assign ( resid   72 and name   HN )  ( resid   72 and name  HB2 ) 2.59 0.79 0.00 
assign ( resid   72 and name   HN )  ( resid   73 and name   HN ) 4.43 2.63 0.00 
assign ( resid   72 and name   HN )  ( resid   73 and name  HD# ) 4.76 2.96 0.00 
assign ( resid   72 and name   HN )  ( resid   73 and name  HG# ) 4.55 2.75 0.00 
assign ( resid   72 and name   HN )  ( resid   74 and name   HN ) 5.50 3.70 0.00 
assign ( resid   72 and name  HB1 )  ( resid   73 and name   HN ) 4.44 2.64 0.00 
assign ( resid   72 and name  HB1 )  ( resid   74 and name   HN ) 3.37 1.57 0.00 
assign ( resid   72 and name  HB1 )  ( resid   75 and name   HA ) 5.35 3.55 0.00 
assign ( resid   72 and name  HB1 )  ( resid   78 and name HD1# ) 5.50 3.70 0.00 
assign ( resid   72 and name  HB2 )  ( resid   75 and name   HA ) 5.06 3.26 0.00 
assign ( resid   72 and name  HB2 )  ( resid   78 and name HD1# ) 5.21 3.41 0.00 
assign ( resid   73 and name   HA )  ( resid   73 and name  HB# ) 2.98 1.18 0.00 
assign ( resid   73 and name   HA )  ( resid   73 and name  HD# ) 4.16 2.36 0.00 
assign ( resid   73 and name   HA )  ( resid   73 and name  HE# ) 4.96 3.16 0.00 
assign ( resid   73 and name   HA )  ( resid   73 and name  HG# ) 3.68 1.88 0.00 
assign ( resid   73 and name   HN )  ( resid   73 and name  HB# ) 3.61 1.81 0.00 
assign ( resid   73 and name   HN )  ( resid   73 and name  HG# ) 4.30 2.50 0.00 
assign ( resid   73 and name   HN )  ( resid   74 and name   HN ) 3.37 1.57 0.00 
assign ( resid   73 and name  HB# )  ( resid   73 and name  HD# ) 3.11 1.31 0.00 
assign ( resid   73 and name  HB# )  ( resid   73 and name  HE# ) 5.13 3.33 0.00 
assign ( resid   73 and name  HB# )  ( resid   74 and name   HA ) 5.50 3.70 0.00 
assign ( resid   73 and name  HB# )  ( resid   74 and name  HB1 ) 5.50 3.70 0.00 
assign ( resid   73 and name  HB# )  ( resid   74 and name  HB2 ) 5.50 3.70 0.00 
assign ( resid   73 and name  HB# )  ( resid   74 and name  HB# ) 4.74 2.94 0.00 
assign ( resid   73 and name  HB# )  ( resid   74 and name HD21 ) 4.54 2.74 0.00 
assign ( resid   73 and name  HB# )  ( resid   74 and name HD22 ) 4.54 2.74 0.00 
assign ( resid   73 and name  HB# )  ( resid   74 and name HD2# ) 3.79 1.99 0.00 
assign ( resid   73 and name  HD# )  ( resid   73 and name  HE# ) 2.85 1.05 0.00 
assign ( resid   73 and name  HG# )  ( resid   73 and name  HE# ) 3.41 1.61 0.00 
assign ( resid   74 and name   HA )  ( resid   74 and name HD2# ) 4.42 2.62 0.00 
assign ( resid   74 and name   HA )  ( resid   75 and name  HD1 ) 3.25 1.45 0.00 
assign ( resid   74 and name   HA )  ( resid   75 and name  HD2 ) 3.25 1.45 0.00 
assign ( resid   74 and name   HA )  ( resid   75 and name  HG# ) 4.54 2.74 0.00 
assign ( resid   74 and name   HA )  ( resid   76 and name   HN ) 4.10 2.30 0.00 
assign ( resid   74 and name   HN )  ( resid   75 and name  HD# ) 4.61 2.81 0.00 
assign ( resid   74 and name  HB1 )  ( resid   75 and name  HD1 ) 5.40 3.60 0.00 
assign ( resid   74 and name  HB1 )  ( resid   75 and name  HD2 ) 5.40 3.60 0.00 
assign ( resid   74 and name  HB2 )  ( resid   75 and name  HD1 ) 5.40 3.60 0.00 
assign ( resid   74 and name  HB2 )  ( resid   75 and name  HD2 ) 5.40 3.60 0.00 
assign ( resid   74 and name  HB# )  ( resid   74 and name HD2# ) 2.89 1.09 0.00 
assign ( resid   74 and name  HB# )  ( resid   75 and name  HD# ) 3.88 2.08 0.00 
assign ( resid   75 and name   HA )  ( resid   77 and name   HN ) 3.43 1.63 0.00 
assign ( resid   75 and name   HA )  ( resid   78 and name   HN ) 3.32 1.52 0.00 
assign ( resid   75 and name   HA )  ( resid   78 and name   HG ) 4.62 2.82 0.00 
assign ( resid   75 and name   HA )  ( resid   78 and name  HB1 ) 5.50 3.70 0.00 
assign ( resid   75 and name   HA )  ( resid   78 and name  HB2 ) 4.80 3.00 0.00 
assign ( resid   75 and name   HA )  ( resid   78 and name HD1# ) 4.14 2.34 0.00 
assign ( resid   75 and name   HA )  ( resid   78 and name HD2# ) 5.09 3.29 0.00 
assign ( resid   75 and name  HB1 )  ( resid   77 and name   HN ) 4.57 2.77 0.00 
assign ( resid   75 and name  HB1 )  ( resid   78 and name   HG ) 4.53 2.73 0.00  
assign ( resid   75 and name  HB1 )  ( resid   78 and name   HN ) 4.75 2.95 0.00 
assign ( resid   75 and name  HB1 )  ( resid   78 and name HD1# ) 4.74 2.94 0.00  
assign ( resid   75 and name  HB2 )  ( resid   76 and name   HN ) 3.55 1.55 0.00   
assign ( resid   75 and name  HB2 )  ( resid   78 and name   HN ) 3.77 1.97 0.00 
assign ( resid   75 and name  HD# )  ( resid   76 and name   HN ) 3.83 2.03 0.00 
assign ( resid   76 and name   HA )  ( resid   77 and name   HN ) 3.14 1.34 0.00 
assign ( resid   76 and name  HB# )  ( resid   76 and name   HN ) 2.48 0.68 0.00 
assign ( resid   76 and name   HN )  ( resid   76 and name   HA ) 2.75 0.95 0.00 
assign ( resid   76 and name   HN )  ( resid   77 and name   HA ) 5.49 3.69 0.00
assign ( resid   76 and name   HN )  ( resid   77 and name   HN ) 2.50 0.70 0.00 
assign ( resid   76 and name   HN )  ( resid   78 and name   HN ) 3.74 1.94 0.00 
assign ( resid   76 and name  HB# )  ( resid   77 and name   HN ) 3.28 1.48 0.00 
assign ( resid   77 and name   HA )  ( resid   78 and name   HN ) 3.53 1.73 0.00 
assign ( resid   77 and name   HN )  ( resid   78 and name   HN ) 2.60 0.80 0.00 
assign ( resid   77 and name   HN )  ( resid   78 and name  HB1 ) 5.13 3.33 0.00 
assign ( resid   77 and name   HN )  ( resid   78 and name  HB2 ) 3.83 2.03 0.00 
assign ( resid   77 and name  HB# )  ( resid   78 and name   HN ) 3.44 1.64 0.00 
assign ( resid   78 and name   HA )  ( resid   78 and name   HG ) 4.22 2.42 0.00 
assign ( resid   78 and name   HA )  ( resid   78 and name HD1# ) 3.20 1.40 0.00 
assign ( resid   78 and name   HG )  ( resid   79 and name   HN ) 4.70 2.90 0.00 
assign ( resid   78 and name   HN )  ( resid   78 and name   HA ) 2.89 1.09 0.00 
assign ( resid   78 and name   HN )  ( resid   78 and name   HG ) 4.00 2.20 0.00  
assign ( resid   78 and name   HN )  ( resid   78 and name  HB2 ) 2.58 0.78 0.00 
assign ( resid   78 and name   HN )  ( resid   78 and name HD1# ) 4.20 2.40 0.00 
assign ( resid   78 and name   HN )  ( resid   78 and name HD2# ) 4.61 2.81 0.00
assign ( resid   78 and name   HN )  ( resid   79 and name   HN ) 3.87 2.07 0.00  
assign ( resid   78 and name  HB1 )  ( resid   78 and name HD1# ) 3.83 2.03 0.00 
assign ( resid   78 and name  HB1 )  ( resid   78 and name HD2# ) 4.13 2.33 0.00 
assign ( resid   78 and name  HB1 )  ( resid   79 and name   HN ) 4.20 2.40 0.00  
assign ( resid   78 and name  HB2 )  ( resid   78 and name HD1# ) 3.67 1.87 0.00 
assign ( resid   78 and name  HB2 )  ( resid   78 and name HD2# ) 3.56 1.76 0.00 
assign ( resid   79 and name   HA )  ( resid   79 and name  HG2 ) 4.10 2.30 0.00 
assign ( resid   79 and name   HA )  ( resid   80 and name   HN ) 2.61 0.81 0.00 
assign ( resid   79 and name   HN )  ( resid   79 and name  HG1 ) 4.84 3.04 0.00 
assign ( resid   79 and name   HN )  ( resid   80 and name   HN ) 4.50 2.70 0.00 
assign ( resid   79 and name   HN )  ( resid   80 and name   HN ) 4.58 2.78 0.00 
assign ( resid   79 and name   HN )  ( resid   81 and name   HN ) 4.00 2.20 0.00 
assign ( resid   79 and name  HB# )  ( resid   79 and name   HN ) 3.50 1.70 0.00 
assign ( resid   79 and name  HB1 )  ( resid   80 and name   HN ) 3.79 1.99 0.00 
assign ( resid   79 and name  HB1 )  ( resid   81 and name   HN ) 3.42 1.62 0.00 
assign ( resid   79 and name  HG1 )  ( resid   81 and name   HN ) 4.92 3.12 0.00 
assign ( resid   79 and name  HG1 )  ( resid   81 and name HD21 ) 5.22 3.42 0.00 
assign ( resid   79 and name  HG1 )  ( resid   81 and name HD22 ) 4.97 3.17 0.00 
assign ( resid   79 and name  HG2 )  ( resid   79 and name   HN ) 4.50 2.70 0.00  
assign ( resid   79 and name  HG2 )  ( resid   80 and name   HN ) 4.14 2.34 0.00 
assign ( resid   79 and name  HG2 )  ( resid   81 and name HD21 ) 5.08 3.28 0.00 
assign ( resid   79 and name  HG2 )  ( resid   81 and name HD22 ) 5.16 3.36 0.00 
assign ( resid   80 and name   HA )  ( resid   81 and name   HN ) 2.50 0.70 0.00 
assign ( resid   80 and name   HA )  ( resid   84 and name   HN ) 4.99 3.19 0.00 
assign ( resid   80 and name   HA )  ( resid   84 and name HG2# ) 4.15 2.35 0.00 
assign ( resid   80 and name   HA )  ( resid   84 and name HG1# ) 3.74 1.94 0.00 
assign ( resid   80 and name   HA )  ( resid   85 and name   HN ) 5.03 3.23 0.00 
assign ( resid   80 and name   HN )  ( resid   80 and name  HB1 ) 2.97 1.17 0.00 
assign ( resid   80 and name   HN )  ( resid   80 and name  HB2 ) 3.17 1.37 0.00 
assign ( resid   80 and name   HN )  ( resid   81 and name   HN ) 3.58 1.78 0.00 
assign ( resid   80 and name   HN )  ( resid   84 and name HG1# ) 5.50 3.70 0.00 
assign ( resid   80 and name  HB1 )  ( resid   81 and name   HA ) 5.50 3.70 0.00 
assign ( resid   80 and name  HB1 )  ( resid   84 and name HG1# ) 5.50 3.70 0.00 
assign ( resid   80 and name  HB2 )  ( resid   81 and name   HN ) 4.43 2.63 0.00 
assign ( resid   80 and name  HB2 )  ( resid   84 and name HG1# ) 5.50 3.70 0.00 
assign ( resid   81 and name   HA )  ( resid   81 and name HD21 ) 5.29 3.49 0.00 
assign ( resid   81 and name   HA )  ( resid   81 and name HD22 ) 5.25 3.45 0.00 
assign ( resid   81 and name   HA )  ( resid   82 and name  HB# ) 5.47 3.67 0.00 
assign ( resid   81 and name   HA )  ( resid   82 and name  HG# ) 5.50 3.70 0.00 
assign ( resid   81 and name   HA )  ( resid   84 and name   HN ) 5.24 3.44 0.00 
assign ( resid   81 and name   HA )  ( resid   85 and name  HD# ) 5.50 3.70 0.00 
assign ( resid   81 and name   HA )  ( resid   85 and name  HG# ) 5.34 3.54 0.00 
assign ( resid   81 and name   HN )  ( resid   81 and name  HB1 ) 3.27 1.47 0.00 
assign ( resid   81 and name   HN )  ( resid   81 and name  HB2 ) 4.05 2.25 0.00 
assign ( resid   81 and name   HN )  ( resid   81 and name HD21 ) 3.64 1.84 0.00 
assign ( resid   81 and name   HN )  ( resid   81 and name HD22 ) 3.93 2.13 0.00 
assign ( resid   81 and name   HN )  ( resid   82 and name   HA ) 5.49 3.69 0.00 
assign ( resid   81 and name   HN )  ( resid   82 and name   HN ) 4.66 2.86 0.00 
assign ( resid   81 and name   HN )  ( resid   83 and name   HN ) 5.50 3.70 0.00 
assign ( resid   81 and name   HN )  ( resid   84 and name   HA ) 4.90 3.10 0.00 
assign ( resid   81 and name   HN )  ( resid   84 and name   HB ) 2.54 0.74 0.00 
assign ( resid   81 and name   HN )  ( resid   84 and name   HN ) 3.27 1.47 0.00 
assign ( resid   81 and name   HN )  ( resid   84 and name HG1# ) 3.72 1.92 0.00 
assign ( resid   81 and name   HN )  ( resid   84 and name HG2# ) 2.99 1.19 0.00 
assign ( resid   81 and name   HN )  ( resid   85 and name   HN ) 3.90 2.10 0.00 
assign ( resid   81 and name   HN )  ( resid   85 and name  HE# ) 5.34 3.54 0.00 
assign ( resid   81 and name  HB1 )  ( resid   82 and name   HN ) 3.95 2.15 0.00 
assign ( resid   81 and name  HB2 )  ( resid   82 and name   HN ) 3.15 1.35 0.00 
assign ( resid   81 and name  HB2 )  ( resid   83 and name   HN ) 5.04 3.24 0.00 
assign ( resid   81 and name HD21 )  ( resid   82 and name  HB# ) 5.50 3.70 0.00 
assign ( resid   81 and name HD21 )  ( resid   83 and name  HB# ) 3.19 1.39 0.40  
assign ( resid   81 and name HD21 )  ( resid   84 and name   HN ) 4.36 2.56 0.00 
assign ( resid   81 and name HD21 )  ( resid   84 and name HG1# ) 5.50 3.70 0.00 
assign ( resid   81 and name HD21 )  ( resid   85 and name   HN ) 5.50 3.70 0.00 
assign ( resid   81 and name HD22 )  ( resid   82 and name   HN ) 5.50 3.70 0.00 
assign ( resid   81 and name HD22 )  ( resid   82 and name  HB# ) 5.24 3.44 0.00 
assign ( resid   81 and name HD22 )  ( resid   84 and name   HN ) 5.50 3.70 0.00 
assign ( resid   81 and name HD22 )  ( resid   84 and name HG2# ) 5.45 3.65 0.00 
assign ( resid   81 and name  OD1 )  ( resid   84 and name   HN ) 2.00 0.20 0.00 
assign ( resid   81 and name  OD1 )  ( resid   84 and name    N ) 3.00 1.20 0.00 
assign ( resid   82 and name   HA )  ( resid   82 and name  HG# ) 3.55 1.75 0.00 
assign ( resid   82 and name   HA )  ( resid   85 and name   HA ) 5.50 3.70 0.00 
assign ( resid   82 and name   HA )  ( resid   85 and name   HN ) 3.72 1.92 0.00 
assign ( resid   82 and name   HA )  ( resid   85 and name  HB1 ) 4.93 3.13 0.00 
assign ( resid   82 and name   HA )  ( resid   85 and name  HB2 ) 4.19 2.39 0.00 
assign ( resid   82 and name   HA )  ( resid   85 and name  HD# ) 4.09 2.29 0.00 
assign ( resid   82 and name   HA )  ( resid   85 and name  HE# ) 5.21 3.41 0.00 
assign ( resid   82 and name   HA )  ( resid   85 and name  HG# ) 5.34 3.54 0.00 
assign ( resid   82 and name   HA )  ( resid   86 and name   HN ) 3.96 2.16 0.00 
assign ( resid   82 and name   HN )  ( resid   82 and name  HB# ) 3.14 1.34 0.00 
assign ( resid   82 and name   HN )  ( resid   82 and name  HG# ) 3.85 2.05 0.00 
assign ( resid   82 and name   HN )  ( resid   83 and name   HN ) 3.78 1.98 0.00 
assign ( resid   82 and name   HN )  ( resid   84 and name   HN ) 5.07 3.27 0.00 
assign ( resid   82 and name   HN )  ( resid   85 and name   HN ) 4.66 2.86 0.00 
assign ( resid   82 and name  HB# )  ( resid   82 and name  HG# ) 2.71 0.91 0.00 
assign ( resid   82 and name  HB# )  ( resid   83 and name   HN ) 3.29 1.49 0.00 
assign ( resid   82 and name  HB# )  ( resid   84 and name   HN ) 5.13 3.33 0.00 
assign ( resid   82 and name  HB# )  ( resid   85 and name   HN ) 5.38 3.58 0.00 
assign ( resid   82 and name  HB# )  ( resid   86 and name  HB# ) 5.50 3.70 0.00 
assign ( resid   82 and name  HG# )  ( resid   85 and name   HN ) 5.41 3.61 0.00 
assign ( resid   83 and name   HA )  ( resid   85 and name   HN ) 5.40 3.60 0.00 
assign ( resid   83 and name   HA )  ( resid   86 and name  HB# ) 3.60 1.80 0.00 
assign ( resid   83 and name   HN )  ( resid   83 and name  HB1 ) 3.66 1.86 0.00 
assign ( resid   83 and name   HN )  ( resid   83 and name  HB2 ) 3.66 1.86 0.00 
assign ( resid   83 and name   HN )  ( resid   83 and name  HB# ) 3.06 1.26 0.00 
assign ( resid   83 and name   HN )  ( resid   84 and name   HN ) 3.43 1.63 0.00 
assign ( resid   83 and name   HN )  ( resid   85 and name   HN ) 4.61 2.81 0.00 
assign ( resid   83 and name   HN )  ( resid   86 and name  HB# ) 5.50 3.70 0.00 
assign ( resid   83 and name  HB# )  ( resid   83 and name HD2# ) 3.19 1.39 0.00 
assign ( resid   83 and name  HB# )  ( resid   84 and name   HN ) 2.78 0.98 0.00 
assign ( resid   83 and name  HB# )  ( resid   84 and name HG2# ) 5.34 3.54 0.00 
assign ( resid   83 and name  HB# )  ( resid   84 and name HG1# ) 5.34 3.54 0.00 
assign ( resid   83 and name  HB# )  ( resid   85 and name   HN ) 5.27 3.47 0.00 
assign ( resid   83 and name  HB# )  ( resid   86 and name  HB# ) 5.34 3.54 0.00 
assign ( resid   83 and name HD2# )  ( resid   84 and name HG2# ) 5.34 3.54 0.00 
assign ( resid   84 and name   HA )  ( resid   84 and name HG2# ) 3.27 1.47 0.00 
assign ( resid   84 and name   HA )  ( resid   84 and name HG1# ) 3.51 1.71 0.00 
assign ( resid   84 and name   HA )  ( resid   86 and name   HN ) 5.03 3.23 0.00 
assign ( resid   84 and name   HA )  ( resid   87 and name   HN ) 3.66 1.86 0.00 
assign ( resid   84 and name   HA )  ( resid   87 and name  HB# ) 4.08 2.28 0.00 
assign ( resid   84 and name   HB )  ( resid   85 and name   HN ) 2.98 1.18 0.00  
assign ( resid   84 and name   HN )  ( resid   84 and name   HB ) 2.40 0.60 0.00  
assign ( resid   84 and name   HN )  ( resid   84 and name HG1# ) 3.91 2.11 0.00 
assign ( resid   84 and name   HN )  ( resid   84 and name HG2# ) 2.67 0.87 0.00  
assign ( resid   84 and name   HN )  ( resid   85 and name   HN ) 2.81 1.01 0.00 
assign ( resid   84 and name   HN )  ( resid   85 and name  HB2 ) 4.83 3.03 0.00 
assign ( resid   84 and name   HN )  ( resid   85 and name  HE# ) 5.34 3.54 0.00 
assign ( resid   84 and name   HN )  ( resid   87 and name  HB# ) 5.50 3.70 0.00 
assign ( resid   84 and name HG2# )  ( resid   85 and name   HN ) 3.91 2.11 0.00 
assign ( resid   84 and name HG2# )  ( resid   87 and name   HN ) 5.39 3.59 0.00 
assign ( resid   84 and name HG2# )  ( resid   87 and name  HE# ) 5.46 3.66 0.00 
assign ( resid   84 and name HG1# )  ( resid   85 and name   HA ) 5.37 3.57 0.00 
assign ( resid   84 and name HG1# )  ( resid   87 and name   HN ) 5.23 3.43 0.00 
assign ( resid   84 and name HG1# )  ( resid   87 and name  HB# ) 4.88 3.08 0.00 
assign ( resid   84 and name HG1# )  ( resid   87 and name  HD# ) 5.13 3.33 0.00 
assign ( resid   84 and name HG1# )  ( resid   88 and name   HB ) 5.50 3.70 0.00 
assign ( resid   85 and name   HA )  ( resid   85 and name  HD# ) 5.39 3.59 0.00 
assign ( resid   85 and name   HA )  ( resid   85 and name  HE1 ) 5.50 3.70 0.00 
assign ( resid   85 and name   HA )  ( resid   85 and name  HE2 ) 5.50 3.70 0.00 
assign ( resid   85 and name   HA )  ( resid   85 and name  HG# ) 3.54 1.74 0.00 
assign ( resid   85 and name   HA )  ( resid   88 and name   HB ) 3.77 1.97 0.00 
assign ( resid   85 and name   HA )  ( resid   88 and name   HN ) 3.75 1.95 0.00 
assign ( resid   85 and name   HA )  ( resid   89 and name   HN ) 3.93 2.13 0.00 
assign ( resid   85 and name   HA )  ( resid   89 and name  HD# ) 4.95 3.15 0.00 
assign ( resid   85 and name   HN )  ( resid   85 and name  HB2 ) 2.79 0.99 0.00 
assign ( resid   85 and name   HN )  ( resid   85 and name  HE# ) 4.88 3.08 0.00 
assign ( resid   85 and name   HN )  ( resid   85 and name  HG# ) 3.95 2.15 0.00 
assign ( resid   85 and name   HN )  ( resid   86 and name  HB# ) 4.91 3.11 0.00 
assign ( resid   85 and name   HN )  ( resid   87 and name  HB# ) 5.50 3.70 0.00 
assign ( resid   85 and name   HN )  ( resid   88 and name   HB ) 5.50 3.70 0.00 
assign ( resid   85 and name  HB1 )  ( resid   86 and name   HN ) 3.42 1.62 0.00 
assign ( resid   85 and name  HB2 )  ( resid   85 and name  HD# ) 3.73 1.93 0.00 
assign ( resid   85 and name  HB2 )  ( resid   85 and name  HE# ) 5.16 3.36 0.00 
assign ( resid   85 and name  HB2 )  ( resid   86 and name   HN ) 3.00 1.20 0.00 
assign ( resid   85 and name  HB2 )  ( resid   87 and name   HN ) 5.50 3.70 0.00 
assign ( resid   85 and name  HE# )  ( resid   86 and name   HN ) 5.34 3.54 0.00 
assign ( resid   85 and name  HG# )  ( resid   85 and name  HE# ) 3.17 1.37 0.00 
assign ( resid   85 and name  HG# )  ( resid   86 and name   HN ) 4.80 3.00 0.00 
assign ( resid   85 and name  HG# )  ( resid   88 and name   HB ) 5.34 3.54 0.00 
assign ( resid   86 and name   HA )  ( resid   86 and name  HD2 ) 5.50 3.70 0.00
assign ( resid   86 and name   HA )  ( resid   87 and name   HN ) 3.57 1.77 0.00 
assign ( resid   86 and name   HA )  ( resid   88 and name   HN ) 4.99 3.19 0.00 
assign ( resid   86 and name   HA )  ( resid   89 and name  HD# ) 4.92 3.12 0.00 
assign ( resid   86 and name   HA )  ( resid   89 and name  HE# ) 5.50 3.70 0.00 
assign ( resid   86 and name   HA )  ( resid   89 and name  HG2 ) 5.43 3.63 0.00 
assign ( resid   86 and name   HA )  ( resid   90 and name   HN ) 4.28 2.48 0.00 
assign ( resid   86 and name   HA )  ( resid   90 and name  HG# ) 3.70 1.90 0.00 
assign ( resid   86 and name   HN )  ( resid   86 and name   HA ) 2.89 1.09 0.00 
assign ( resid   86 and name   HN )  ( resid   86 and name  HB# ) 2.40 0.60 0.00 
assign ( resid   86 and name   HN )  ( resid   87 and name   HA ) 5.44 3.64 0.00 
assign ( resid   86 and name   HN )  ( resid   87 and name   HN ) 2.71 0.91 0.00 
assign ( resid   86 and name   HN )  ( resid   89 and name  HD# ) 5.08 3.28 0.00 
assign ( resid   86 and name   HN )  ( resid   89 and name  HG1 ) 5.23 3.43 0.00 
assign ( resid   86 and name  HB# )  ( resid   87 and name   HN ) 3.37 1.57 0.00 
assign ( resid   86 and name  HB# )  ( resid   87 and name  HB# ) 5.50 3.70 0.00 
assign ( resid   86 and name  HB# )  ( resid   90 and name  HG# ) 5.34 3.54 0.00 
assign ( resid   86 and name  HD2 )  ( resid   87 and name   HN ) 5.07 3.27 0.00
assign ( resid   86 and name  HD2 )  ( resid   90 and name  HG2 ) 5.50 3.70 0.00
assign ( resid   87 and name   HA )  ( resid   87 and name  HD# ) 3.91 2.11 0.00 
assign ( resid   87 and name   HA )  ( resid   87 and name  HE# ) 4.81 3.01 0.00 
assign ( resid   87 and name   HA )  ( resid   87 and name  HG# ) 3.45 1.65 0.00 
assign ( resid   87 and name   HA )  ( resid   88 and name   HN ) 3.53 1.73 0.00 
assign ( resid   87 and name   HN )  ( resid   87 and name  HB# ) 2.70 0.90 0.00 
assign ( resid   87 and name   HN )  ( resid   87 and name  HE# ) 5.43 3.63 0.00 
assign ( resid   87 and name   HN )  ( resid   87 and name  HG# ) 3.85 2.05 0.00 
assign ( resid   87 and name   HN )  ( resid   88 and name   HB ) 4.35 2.55 0.00 
assign ( resid   87 and name   HN )  ( resid   88 and name   HN ) 2.79 0.99 0.00 
assign ( resid   87 and name   HN )  ( resid   88 and name HG2# ) 5.50 3.70 0.00 
assign ( resid   87 and name   HN )  ( resid   89 and name   HN ) 5.13 3.33 0.00 
assign ( resid   87 and name   HN )  ( resid   90 and name   HN ) 5.48 3.68 0.00 
assign ( resid   87 and name  HB# )  ( resid   87 and name  HD# ) 3.24 1.44 0.00 
assign ( resid   87 and name  HB# )  ( resid   87 and name  HE# ) 3.68 1.88 0.00 
assign ( resid   87 and name  HB# )  ( resid   87 and name  HG# ) 2.99 1.19 0.00 
assign ( resid   87 and name  HB# )  ( resid   88 and name   HN ) 3.49 1.69 0.00 
assign ( resid   87 and name  HG# )  ( resid   87 and name  HD# ) 2.63 0.83 0.00 
assign ( resid   87 and name  HG# )  ( resid   87 and name  HE# ) 3.35 1.55 0.00 
assign ( resid   88 and name   HA )  ( resid   88 and name HG2# ) 3.46 1.66 0.00 
assign ( resid   88 and name   HA )  ( resid   89 and name  HD# ) 5.50 3.70 0.00 
assign ( resid   88 and name   HA )  ( resid   91 and name   HN ) 3.56 1.76 0.00 
assign ( resid   88 and name   HA )  ( resid   91 and name  HB# ) 3.68 1.88 0.00 
assign ( resid   88 and name   HA )  ( resid   91 and name  HD# ) 3.71 1.91 0.00 
assign ( resid   88 and name   HA )  ( resid   92 and name   HN ) 3.90 2.10 0.00 
assign ( resid   88 and name   HB )  ( resid   89 and name   HA ) 5.50 3.70 0.00 
assign ( resid   88 and name   HB )  ( resid   89 and name   HN ) 2.94 1.14 0.00 
assign ( resid   88 and name   HB )  ( resid   89 and name  HD# ) 4.92 3.12 0.00 
assign ( resid   88 and name   HB )  ( resid   90 and name   HN ) 4.90 3.10 0.00 
assign ( resid   88 and name   HB )  ( resid   91 and name  HB# ) 5.42 3.62 0.00 
assign ( resid   88 and name   HN )  ( resid   88 and name   HB ) 2.66 0.86 0.00 
assign ( resid   88 and name   HN )  ( resid   88 and name HG2# ) 3.80 2.00 0.00 
assign ( resid   88 and name   HN )  ( resid   89 and name   HN ) 3.06 1.26 0.00 
assign ( resid   88 and name   HN )  ( resid   89 and name  HD# ) 3.90 2.10 0.00 
assign ( resid   88 and name   HN )  ( resid   89 and name  HG1 ) 3.69 1.89 0.00 
assign ( resid   88 and name   HN )  ( resid   90 and name   HN ) 3.93 2.13 0.00 
assign ( resid   88 and name   HN )  ( resid   92 and name   HN ) 5.50 3.70 0.00 
assign ( resid   88 and name HG2# )  ( resid   89 and name   HA ) 4.93 3.13 0.00 
assign ( resid   88 and name HG2# )  ( resid   89 and name   HN ) 3.61 1.81 0.00 
assign ( resid   88 and name HG2# )  ( resid   89 and name  HD# ) 4.44 2.64 0.00 
assign ( resid   88 and name HG2# )  ( resid   91 and name  HD# ) 3.73 1.93 0.00 
assign ( resid   88 and name HG2# )  ( resid   92 and name   HB ) 5.50 3.70 0.00 
assign ( resid   88 and name HG2# )  ( resid   92 and name   HN ) 3.95 2.15 0.00 
assign ( resid   88 and name HG2# )  ( resid   92 and name HD1# ) 3.05 1.25 0.00 
assign ( resid   88 and name HG2# )  ( resid   92 and name HG11 ) 5.50 3.70 0.00 
assign ( resid   88 and name HG2# )  ( resid   92 and name HG12 ) 3.74 1.94 0.00 
assign ( resid   88 and name HG2# )  ( resid   92 and name HG2# ) 5.09 3.29 0.00 
assign ( resid   89 and name   HA )  ( resid   89 and name  HD# ) 4.23 2.43 0.00 
assign ( resid   89 and name   HA )  ( resid   89 and name  HE# ) 5.50 3.70 0.00 
assign ( resid   89 and name   HA )  ( resid   89 and name  HG1 ) 3.62 1.82 0.00 
assign ( resid   89 and name   HA )  ( resid   89 and name  HG2 ) 4.24 2.44 0.00 
assign ( resid   89 and name   HA )  ( resid   92 and name   HB ) 3.67 1.87 0.00 
assign ( resid   89 and name   HA )  ( resid   92 and name HD1# ) 4.78 2.98 0.00 
assign ( resid   89 and name   HA )  ( resid   92 and name HG2# ) 5.50 3.70 0.00 
assign ( resid   89 and name   HN )  ( resid   89 and name   HA ) 2.89 1.09 0.00 
assign ( resid   89 and name   HN )  ( resid   89 and name  HB1 ) 2.92 1.12 0.00 
assign ( resid   89 and name   HN )  ( resid   89 and name  HD# ) 3.63 1.83 0.00 
assign ( resid   89 and name   HN )  ( resid   89 and name  HG2 ) 3.41 1.61 0.00 
assign ( resid   89 and name   HN )  ( resid   90 and name   HN ) 3.15 1.35 0.00 
assign ( resid   89 and name   HN )  ( resid   91 and name   HN ) 4.82 3.02 0.00 
assign ( resid   89 and name   HN )  ( resid   92 and name   HN ) 4.96 3.16 0.00 
assign ( resid   89 and name  HB1 )  ( resid   89 and name  HD# ) 3.42 1.62 0.00 
assign ( resid   89 and name  HB1 )  ( resid   89 and name  HE# ) 5.50 3.70 0.00 
assign ( resid   89 and name  HB2 )  ( resid   89 and name  HD# ) 2.96 1.16 0.00 
assign ( resid   89 and name  HB2 )  ( resid   89 and name  HE# ) 5.04 3.24 0.00 
assign ( resid   89 and name  HD# )  ( resid   90 and name   HA ) 5.50 3.70 0.00 
assign ( resid   89 and name  HD# )  ( resid   90 and name   HN ) 4.28 2.48 0.00 
assign ( resid   89 and name  HD# )  ( resid   90 and name  HG# ) 3.80 2.00 0.00 
assign ( resid   89 and name  HE# )  ( resid   90 and name  HB# ) 5.34 3.54 0.00 
assign ( resid   89 and name  HE# )  ( resid   90 and name  HG# ) 4.20 2.40 0.00 
assign ( resid   89 and name  HG1 )  ( resid   89 and name  HD# ) 2.87 1.07 0.00 
assign ( resid   89 and name  HG1 )  ( resid   89 and name  HE# ) 3.98 2.18 0.00 
assign ( resid   89 and name  HG2 )  ( resid   89 and name  HD# ) 2.68 0.88 0.00 
assign ( resid   89 and name  HG2 )  ( resid   89 and name  HE# ) 3.86 2.06 0.00 
assign ( resid   89 and name  HG2 )  ( resid   90 and name   HN ) 4.12 2.32 0.00 
assign ( resid   90 and name   HA )  ( resid   90 and name  HG1 ) 3.94 2.14 0.00 
assign ( resid   90 and name   HA )  ( resid   90 and name  HG2 ) 3.94 2.14 0.00 
assign ( resid   90 and name   HA )  ( resid   90 and name  HG# ) 3.22 1.42 0.00 
assign ( resid   90 and name   HA )  ( resid   93 and name  HG# ) 4.70 2.90 0.00 
assign ( resid   90 and name   HN )  ( resid   90 and name   HA ) 2.94 1.14 0.00 
assign ( resid   90 and name   HN )  ( resid   90 and name  HG# ) 2.68 0.88 0.00 
assign ( resid   90 and name   HN )  ( resid   91 and name   HN ) 2.86 1.06 0.00 
assign ( resid   90 and name   HN )  ( resid   91 and name  HB# ) 4.43 2.63 0.00 
assign ( resid   90 and name   HN )  ( resid   92 and name   HN ) 4.53 2.73 0.00 
assign ( resid   90 and name  HB# )  ( resid   91 and name   HN ) 2.80 1.00 0.00 
assign ( resid   90 and name  HG# )  ( resid   91 and name   HN ) 5.10 3.30 0.00 
assign ( resid   91 and name   HA )  ( resid   91 and name  HD# ) 3.33 1.53 0.00 
assign ( resid   91 and name   HA )  ( resid   91 and name  HE# ) 5.19 3.39 0.00 
assign ( resid   91 and name   HA )  ( resid   94 and name   HN ) 3.80 2.00 0.00 
assign ( resid   91 and name   HA )  ( resid   94 and name  HB# ) 3.89 2.09 0.00 
assign ( resid   91 and name   HA )  ( resid   95 and name   HN ) 4.51 2.71 0.00 
assign ( resid   91 and name   HN )  ( resid   91 and name  HB# ) 2.67 0.87 0.00 
assign ( resid   91 and name   HN )  ( resid   91 and name  HD# ) 4.31 2.51 0.00 
assign ( resid   91 and name   HN )  ( resid   92 and name   HN ) 3.04 1.24 0.00 
assign ( resid   91 and name   HN )  ( resid   93 and name   HN ) 4.84 3.04 0.00 
assign ( resid   91 and name  HB# )  ( resid   92 and name   HN ) 2.93 1.13 0.00 
assign ( resid   91 and name  HD# )  ( resid   92 and name   HA ) 5.03 3.23 0.00 
assign ( resid   91 and name  HD# )  ( resid   92 and name   HN ) 3.61 1.81 0.00 
assign ( resid   91 and name  HD# )  ( resid   92 and name HD1# ) 3.70 1.90 0.00 
assign ( resid   91 and name  HD# )  ( resid   92 and name HG11 ) 5.50 3.70 0.00 
assign ( resid   91 and name  HD# )  ( resid   92 and name HG12 ) 3.33 1.53 0.00 
assign ( resid   91 and name  HD# )  ( resid   92 and name HG2# ) 5.12 3.32 0.00 
assign ( resid   91 and name  HD# )  ( resid   94 and name   HN ) 5.50 3.70 0.00 
assign ( resid   91 and name  HD# )  ( resid   94 and name  HB# ) 3.98 2.18 0.00 
assign ( resid   91 and name  HD# )  ( resid   95 and name  HB1 ) 4.52 2.72 0.00 
assign ( resid   91 and name  HD# )  ( resid   95 and name  HB2 ) 4.43 2.63 0.00 
assign ( resid   91 and name  HE# )  ( resid   92 and name   HA ) 4.60 2.80 0.00 
assign ( resid   91 and name  HE# )  ( resid   92 and name HD1# ) 3.92 2.12 0.00 
assign ( resid   91 and name  HE# )  ( resid   92 and name HG12 ) 4.22 2.42 0.00 
assign ( resid   91 and name  HE# )  ( resid   95 and name   HN ) 5.37 3.57 0.00 
assign ( resid   91 and name  HE# )  ( resid   95 and name  HB2 ) 4.18 2.38 0.00 
assign ( resid   91 and name  HE# )  ( resid   95 and name  HD# ) 3.63 1.83 0.00 
assign ( resid   92 and name   HA )  ( resid   92 and name HD1# ) 4.30 2.50 0.00 
assign ( resid   92 and name   HA )  ( resid   92 and name HG11 ) 3.96 2.16 0.00 
assign ( resid   92 and name   HA )  ( resid   92 and name HG12 ) 3.81 2.01 0.00 
assign ( resid   92 and name   HA )  ( resid   92 and name HG2# ) 3.56 1.76 0.00 
assign ( resid   92 and name   HA )  ( resid   94 and name   HN ) 4.59 2.79 0.00 
assign ( resid   92 and name   HA )  ( resid   95 and name   HN ) 3.33 1.53 0.00 
assign ( resid   92 and name   HA )  ( resid   95 and name  HB1 ) 3.76 1.96 0.00 
assign ( resid   92 and name   HA )  ( resid   95 and name  HB2 ) 3.80 2.00 0.00 
assign ( resid   92 and name   HA )  ( resid   95 and name  HD# ) 3.93 2.13 0.00 
assign ( resid   92 and name   HA )  ( resid   96 and name   HN ) 3.82 2.02 0.00 
assign ( resid   92 and name   HB )  ( resid   92 and name HD1# ) 3.35 1.55 0.00 
assign ( resid   92 and name   HN )  ( resid   92 and name   HB ) 2.78 0.98 0.00 
assign ( resid   92 and name   HN )  ( resid   92 and name HD1# ) 3.81 2.01 0.00 
assign ( resid   92 and name   HN )  ( resid   92 and name HG11 ) 3.20 1.40 0.00 
assign ( resid   92 and name   HN )  ( resid   92 and name HG12 ) 2.70 0.90 0.00 
assign ( resid   92 and name   HN )  ( resid   92 and name HG2# ) 3.97 2.17 0.00 
assign ( resid   92 and name   HN )  ( resid   93 and name   HN ) 3.10 1.30 0.00 
assign ( resid   92 and name   HN )  ( resid   93 and name  HG# ) 4.80 3.00 0.00 
assign ( resid   92 and name   HN )  ( resid   94 and name   HN ) 4.59 2.79 0.00 
assign ( resid   92 and name   HN )  ( resid   95 and name  HB1 ) 5.22 3.42 0.00 
assign ( resid   92 and name   HN )  ( resid   95 and name  HB2 ) 5.50 3.70 0.00 
assign ( resid   92 and name HD1# )  ( resid   95 and name   HN ) 5.50 3.70 0.00 
assign ( resid   92 and name HD1# )  ( resid   96 and name   HN ) 5.31 3.51 0.00 
assign ( resid   92 and name HG12 )  ( resid   95 and name  HD# ) 5.50 3.70 0.00 
assign ( resid   92 and name HG2# )  ( resid   92 and name HD1# ) 2.96 1.16 0.00 
assign ( resid   92 and name HG2# )  ( resid   92 and name HG11 ) 3.69 1.89 0.00 
assign ( resid   92 and name HG2# )  ( resid   92 and name HG12 ) 4.19 2.39 0.00 
assign ( resid   92 and name HG2# )  ( resid   93 and name   HA ) 4.22 2.42 0.00 
assign ( resid   92 and name HG2# )  ( resid   93 and name  HG# ) 5.01 3.21 0.00 
assign ( resid   92 and name HG2# )  ( resid   94 and name   HN ) 5.28 3.48 0.00 
assign ( resid   92 and name HG2# )  ( resid   95 and name   HN ) 4.56 2.76 0.00 
assign ( resid   92 and name HG2# )  ( resid   95 and name  HD# ) 4.48 2.68 0.00 
assign ( resid   92 and name HG2# )  ( resid   96 and name   HN ) 3.89 2.09 0.00 
assign ( resid   92 and name HG2# )  ( resid   96 and name  HE# ) 4.63 2.83 0.00 
assign ( resid   92 and name HG2# )  ( resid   96 and name  HG1 ) 4.23 2.43 0.00 
assign ( resid   92 and name HG2# )  ( resid   96 and name  HG2 ) 4.23 2.43 0.00 
assign ( resid   92 and name HG2# )  ( resid   96 and name  HG# ) 3.70 1.90 0.00 
assign ( resid   93 and name   HA )  ( resid   94 and name   HN ) 3.51 1.71 0.00 
assign ( resid   93 and name   HA )  ( resid   96 and name   HN ) 4.43 2.63 0.00 
assign ( resid   93 and name   HN )  ( resid   93 and name   HA ) 2.93 1.13 0.00 
assign ( resid   93 and name   HN )  ( resid   94 and name   HN ) 2.90 1.10 0.00 
assign ( resid   94 and name   HA )  ( resid   95 and name   HN ) 3.44 1.64 0.00 
assign ( resid   94 and name   HA )  ( resid   97 and name   HN ) 4.11 2.31 0.00 
assign ( resid   94 and name   HA )  ( resid   97 and name  HB# ) 3.80 2.00 0.50 
assign ( resid   94 and name   HA )  ( resid   97 and name  HG1 ) 4.14 2.34 0.00 
assign ( resid   94 and name   HA )  ( resid   97 and name  HG2 ) 4.14 2.34 0.00 
assign ( resid   94 and name   HA )  ( resid   97 and name  HG# ) 3.64 1.84 0.00 
assign ( resid   94 and name   HA )  ( resid   97 and name HE22 ) 5.09 3.29 0.00
assign ( resid   94 and name   HA )  ( resid   97 and name HE21 ) 4.09 2.29 0.00
assign ( resid   94 and name   HN )  ( resid   94 and name  HB# ) 2.42 0.62 0.00 
assign ( resid   94 and name   HN )  ( resid   95 and name   HA ) 5.22 3.42 0.00 
assign ( resid   94 and name   HN )  ( resid   95 and name   HN ) 2.80 1.00 0.00 
assign ( resid   94 and name   HN )  ( resid   95 and name  HB1 ) 4.21 2.41 0.00 
assign ( resid   94 and name   HN )  ( resid   96 and name   HN ) 4.26 2.46 0.00 
assign ( resid   94 and name  HB# )  ( resid   95 and name   HN ) 3.15 1.35 0.00 
assign ( resid   95 and name   HA )  ( resid   95 and name  HD# ) 3.06 1.26 0.00 
assign ( resid   95 and name   HA )  ( resid   95 and name  HE# ) 5.12 3.32 0.00 
assign ( resid   95 and name   HA )  ( resid   97 and name   HN ) 4.29 2.49 0.00 
assign ( resid   95 and name   HA )  ( resid   98 and name   HN ) 4.13 2.33 0.00 
assign ( resid   95 and name   HA )  ( resid   98 and name  HD# ) 5.50 3.70 0.00 
assign ( resid   95 and name   HA )  ( resid   98 and name  HG2 ) 5.04 3.24 0.00 
assign ( resid   95 and name   HN )  ( resid   95 and name  HB1 ) 2.74 0.94 0.00 
assign ( resid   95 and name   HN )  ( resid   95 and name  HB2 ) 3.12 1.32 0.00 
assign ( resid   95 and name   HN )  ( resid   95 and name  HD# ) 4.32 2.52 0.00 
assign ( resid   95 and name   HN )  ( resid   96 and name   HN ) 3.02 1.22 0.00 
assign ( resid   95 and name   HN )  ( resid   97 and name   HN ) 4.22 2.42 0.00 
assign ( resid   95 and name  HB1 )  ( resid   96 and name   HN ) 2.90 1.10 0.00 
assign ( resid   95 and name  HB1 )  ( resid   97 and name   HN ) 4.97 3.17 0.00 
assign ( resid   95 and name  HB1 )  ( resid   97 and name HE2# ) 5.34 3.54 0.00 
assign ( resid   95 and name  HB2 )  ( resid   96 and name   HN ) 4.03 2.23 0.00 
assign ( resid   95 and name  HD# )  ( resid   96 and name   HA ) 3.76 1.96 0.00 
assign ( resid   95 and name  HD# )  ( resid   96 and name   HN ) 4.07 2.27 0.00 
assign ( resid   95 and name  HD# )  ( resid   96 and name  HB1 ) 4.70 2.90 0.00 
assign ( resid   95 and name  HD# )  ( resid   96 and name  HB2 ) 4.73 2.93 0.00 
assign ( resid   95 and name  HD# )  ( resid   96 and name  HE# ) 3.90 2.10 0.00 
assign ( resid   95 and name  HD# )  ( resid   98 and name  HD# ) 4.57 2.77 0.00 
assign ( resid   95 and name  HD# )  ( resid   98 and name  HG2 ) 3.93 2.13 0.00 
assign ( resid   95 and name  HD# )  ( resid   99 and name   HZ ) 4.79 2.99 0.00 
assign ( resid   95 and name  HD# )  ( resid   99 and name  HD# ) 4.60 2.80 0.00 
assign ( resid   95 and name  HD# )  ( resid   99 and name  HE# ) 3.47 1.67 0.00 
assign ( resid   95 and name  HD# )  ( resid  109 and name   HB ) 5.11 3.31 0.00 
assign ( resid   95 and name  HD# )  ( resid  109 and name HG2# ) 4.08 2.28 0.00 
assign ( resid   95 and name  HE# )  ( resid   96 and name   HA ) 5.19 3.39 0.00 
assign ( resid   95 and name  HE# )  ( resid   96 and name  HB1 ) 5.50 3.70 0.00 
assign ( resid   95 and name  HE# )  ( resid   96 and name  HE# ) 3.93 2.13 0.00 
assign ( resid   95 and name  HE# )  ( resid   98 and name  HD# ) 4.52 2.72 0.00 
assign ( resid   95 and name  HE# )  ( resid   98 and name  HG2 ) 3.97 2.17 0.00 
assign ( resid   95 and name  HE# )  ( resid   99 and name   HZ ) 3.22 1.42 0.00 
assign ( resid   95 and name  HE# )  ( resid   99 and name  HD# ) 5.01 3.21 0.00 
assign ( resid   95 and name  HE# )  ( resid   99 and name  HE# ) 3.10 1.30 0.00 
assign ( resid   95 and name  HE# )  ( resid  103 and name  HD# ) 5.50 3.70 0.00 
assign ( resid   95 and name  HE# )  ( resid  103 and name  HE# ) 4.05 2.25 0.00 
assign ( resid   95 and name  HE# )  ( resid  105 and name   HA ) 5.42 3.62 0.00 
assign ( resid   95 and name  HE# )  ( resid  108 and name   HA ) 5.50 3.70 0.00 
assign ( resid   95 and name  HE# )  ( resid  108 and name  HB2 ) 4.34 2.54 0.00 
assign ( resid   95 and name  HE# )  ( resid  109 and name   HB ) 4.57 2.77 0.00 
assign ( resid   95 and name  HE# )  ( resid  109 and name HG2# ) 4.21 2.41 0.00 
assign ( resid   96 and name   HA )  ( resid   96 and name  HE# ) 4.02 2.22 0.00 
assign ( resid   96 and name   HA )  ( resid   98 and name   HN ) 4.41 2.61 0.00 
assign ( resid   96 and name   HA )  ( resid   99 and name   HN ) 4.77 2.97 0.00 
assign ( resid   96 and name   HA )  ( resid   99 and name  HD# ) 2.88 1.08 0.00 
assign ( resid   96 and name   HA )  ( resid   99 and name  HE# ) 3.41 1.61 0.00 
assign ( resid   96 and name   HN )  ( resid   96 and name  HB1 ) 3.64 1.84 0.00 
assign ( resid   96 and name   HN )  ( resid   96 and name  HB2 ) 2.80 1.00 0.00 
assign ( resid   96 and name   HN )  ( resid   96 and name  HE# ) 4.41 2.61 0.00 
assign ( resid   96 and name   HN )  ( resid   96 and name  HG# ) 2.73 0.93 0.00 
assign ( resid   96 and name   HN )  ( resid   97 and name   HN ) 2.91 1.11 0.00 
assign ( resid   96 and name   HN )  ( resid   98 and name   HN ) 4.46 2.66 0.00 
assign ( resid   96 and name  HB1 )  ( resid   96 and name  HE# ) 3.73 1.93 0.00 
assign ( resid   96 and name  HB1 )  ( resid   97 and name   HN ) 4.18 2.38 0.00 
assign ( resid   96 and name  HB1 )  ( resid   97 and name HE2# ) 5.34 3.54 0.00 
assign ( resid   96 and name  HB1 )  ( resid   98 and name   HN ) 5.11 3.31 0.00 
assign ( resid   96 and name  HB1 )  ( resid   99 and name  HD# ) 4.35 2.55 0.00 
assign ( resid   96 and name  HB1 )  ( resid   99 and name  HE# ) 4.82 3.02 0.00 
assign ( resid   96 and name  HB2 )  ( resid   96 and name  HE# ) 3.90 2.10 0.00 
assign ( resid   96 and name  HB2 )  ( resid   97 and name   HN ) 3.26 1.46 0.00 
assign ( resid   96 and name  HB2 )  ( resid   97 and name HE21 ) 5.24 3.44 0.00 
assign ( resid   96 and name  HB2 )  ( resid   97 and name HE22 ) 5.24 3.44 0.00 
assign ( resid   96 and name  HB2 )  ( resid   97 and name HE2# ) 4.45 2.65 0.00 
assign ( resid   96 and name  HB2 )  ( resid   98 and name   HN ) 4.98 3.18 0.00 
assign ( resid   96 and name  HB2 )  ( resid   99 and name   HN ) 5.50 3.70 0.00 
assign ( resid   96 and name  HE# )  ( resid   97 and name HE21 ) 5.23 3.43 0.00 
assign ( resid   96 and name  HE# )  ( resid   97 and name HE22 ) 5.23 3.43 0.00 
assign ( resid   96 and name  HE# )  ( resid   99 and name   HZ ) 4.86 3.06 0.00 
assign ( resid   96 and name  HE# )  ( resid   99 and name  HD# ) 3.35 1.55 0.00 
assign ( resid   96 and name  HE# )  ( resid   99 and name  HE# ) 3.55 1.75 0.00 
assign ( resid   96 and name  HE# )  ( resid  103 and name   HA ) 5.35 3.55 0.00 
assign ( resid   96 and name  HE# )  ( resid  103 and name  HB1 ) 4.15 2.35 0.00 
assign ( resid   96 and name  HE# )  ( resid  103 and name  HB2 ) 3.95 2.15 0.00 
assign ( resid   96 and name  HE# )  ( resid  103 and name  HD# ) 4.66 2.86 0.00 
assign ( resid   96 and name  HE# )  ( resid  103 and name  HE# ) 4.32 2.52 0.00 
assign ( resid   96 and name  HG1 )  ( resid   96 and name  HE# ) 3.86 2.06 0.00 
assign ( resid   96 and name  HG2 )  ( resid   96 and name  HE# ) 3.86 2.06 0.00 
assign ( resid   96 and name  HG# )  ( resid   96 and name  HE# ) 3.32 1.52 0.00 
assign ( resid   96 and name  HG# )  ( resid   99 and name  HD# ) 5.34 3.54 0.00 
assign ( resid   97 and name   HA )  ( resid   97 and name  HB# ) 2.91 1.11 0.00 
assign ( resid   97 and name   HA )  ( resid   97 and name  HG1 ) 3.96 2.16 0.00 
assign ( resid   97 and name   HA )  ( resid   97 and name  HG2 ) 3.96 2.16 0.00 
assign ( resid   97 and name   HA )  ( resid   98 and name   HN ) 3.36 1.56 0.00 
assign ( resid   97 and name   HN )  ( resid   97 and name  HB# ) 2.80 1.00 0.00 
assign ( resid   97 and name   HN )  ( resid   97 and name  HG1 ) 3.74 1.94 0.00  
assign ( resid   97 and name   HN )  ( resid   97 and name  HG2 ) 3.00 1.20 0.00  
assign ( resid   97 and name   HN )  ( resid   97 and name  HG# ) 2.84 1.04 0.00 
assign ( resid   97 and name   HN )  ( resid   98 and name   HN ) 2.89 1.09 0.00 
assign ( resid   97 and name   HN )  ( resid   98 and name  HB# ) 4.69 2.89 0.00 
assign ( resid   97 and name   HN )  ( resid   98 and name  HG1 ) 5.27 3.47 0.00 
assign ( resid   97 and name   HN )  ( resid   98 and name  HG2 ) 5.32 3.52 0.00 
assign ( resid   97 and name   HN )  ( resid  100 and name   HN ) 5.50 3.70 0.00 
assign ( resid   97 and name  HB# )  ( resid   97 and name HE21 ) 5.21 3.41 0.00 
assign ( resid   97 and name  HB# )  ( resid   97 and name HE22 ) 5.21 3.41 0.00 
assign ( resid   97 and name  HB# )  ( resid   98 and name   HN ) 3.60 1.80 0.00 
assign ( resid   97 and name  HG# )  ( resid   97 and name HE2# ) 3.21 1.41 0.00 
assign ( resid   97 and name  HG# )  ( resid   98 and name   HN ) 4.50 2.70 0.00 
assign ( resid   98 and name   HA )  ( resid   98 and name  HB# ) 2.89 1.09 0.00 
assign ( resid   98 and name   HA )  ( resid   98 and name  HD# ) 4.58 2.78 0.00 
assign ( resid   98 and name   HA )  ( resid   98 and name  HE1 ) 5.50 3.70 0.00 
assign ( resid   98 and name   HA )  ( resid   98 and name  HE2 ) 5.50 3.70 0.00 
assign ( resid   98 and name   HA )  ( resid   98 and name  HG1 ) 3.99 2.19 0.00 
assign ( resid   98 and name   HA )  ( resid   99 and name   HN ) 3.49 1.69 0.00 
assign ( resid   98 and name   HN )  ( resid   98 and name  HB# ) 2.58 0.78 0.00 
assign ( resid   98 and name   HN )  ( resid   98 and name  HD# ) 4.59 2.79 0.00 
assign ( resid   98 and name   HN )  ( resid   98 and name  HG1 ) 2.98 1.18 0.00 
assign ( resid   98 and name   HN )  ( resid   98 and name  HG2 ) 3.27 1.47 0.00 
assign ( resid   98 and name   HN )  ( resid   99 and name   HA ) 5.19 3.39 0.00 
assign ( resid   98 and name   HN )  ( resid   99 and name   HN ) 2.48 0.68 0.00 
assign ( resid   98 and name   HN )  ( resid   99 and name  HB2 ) 5.01 3.21 0.00 
assign ( resid   98 and name   HN )  ( resid  100 and name   HN ) 4.31 2.51 0.00 
assign ( resid   98 and name  HB# )  ( resid   98 and name  HD# ) 3.58 1.78 0.00 
assign ( resid   98 and name  HB# )  ( resid   98 and name  HE1 ) 4.48 2.68 0.00 
assign ( resid   98 and name  HB# )  ( resid   98 and name  HE2 ) 4.48 2.68 0.00 
assign ( resid   98 and name  HB# )  ( resid   98 and name  HE# ) 3.91 2.11 0.00 
assign ( resid   98 and name  HB# )  ( resid   99 and name   HN ) 3.71 1.91 0.00 
assign ( resid   98 and name  HB# )  ( resid   99 and name  HD# ) 5.50 3.70 0.00 
assign ( resid   98 and name  HB# )  ( resid  100 and name   HN ) 5.50 3.70 0.00 
assign ( resid   98 and name  HD# )  ( resid   99 and name   HZ ) 4.72 2.92 0.00 
assign ( resid   98 and name  HD# )  ( resid   99 and name  HD# ) 4.31 2.51 0.00 
assign ( resid   98 and name  HD# )  ( resid   99 and name  HE# ) 4.30 2.50 0.00 
assign ( resid   98 and name  HE# )  ( resid   99 and name   HZ ) 5.10 3.30 0.00 
assign ( resid   98 and name  HE# )  ( resid   99 and name  HE# ) 3.93 2.13 0.00 
assign ( resid   98 and name  HG1 )  ( resid   98 and name  HD# ) 3.00 1.20 0.00 
assign ( resid   98 and name  HG1 )  ( resid   99 and name   HN ) 4.31 2.51 0.00 
assign ( resid   98 and name  HG1 )  ( resid   99 and name   HZ ) 5.50 3.70 0.00 
assign ( resid   98 and name  HG1 )  ( resid   99 and name  HD# ) 4.46 2.66 0.00 
assign ( resid   98 and name  HG1 )  ( resid   99 and name  HE# ) 5.15 3.35 0.00 
assign ( resid   98 and name  HG2 )  ( resid   99 and name   HN ) 4.20 2.40 0.00 
assign ( resid   98 and name  HG2 )  ( resid   99 and name  HD# ) 5.23 3.43 0.00 
assign ( resid   98 and name  HG2 )  ( resid   99 and name  HE# ) 5.06 3.26 0.00 
assign ( resid   99 and name   HA )  ( resid   99 and name  HD# ) 3.27 1.47 0.00 
assign ( resid   99 and name   HA )  ( resid   99 and name  HE# ) 4.50 2.70 0.00 
assign ( resid   99 and name   HA )  ( resid  100 and name  HA1 ) 5.50 3.70 0.00 
assign ( resid   99 and name   HA )  ( resid  100 and name  HA2 ) 5.50 3.70 0.00 
assign ( resid   99 and name   HA )  ( resid  103 and name   HA ) 5.50 3.70 0.00 
assign ( resid   99 and name   HA )  ( resid  104 and name  HE# ) 5.50 3.70 0.00 
assign ( resid   99 and name   HN )  ( resid   99 and name  HB1 ) 3.74 1.94 0.00 
assign ( resid   99 and name   HN )  ( resid   99 and name  HB2 ) 2.74 0.94 0.00 
assign ( resid   99 and name   HN )  ( resid  100 and name   HN ) 2.68 0.88 0.00 
assign ( resid   99 and name   HN )  ( resid  100 and name  HA# ) 4.67 2.87 0.00 
assign ( resid   99 and name   HZ )  ( resid  103 and name  HD# ) 4.77 2.97 0.00 
assign ( resid   99 and name   HZ )  ( resid  103 and name  HE# ) 3.15 1.35 0.00 
assign ( resid   99 and name   HZ )  ( resid  108 and name   HA ) 3.87 2.07 0.00 
assign ( resid   99 and name   HZ )  ( resid  108 and name  HB1 ) 4.13 2.33 0.00 
assign ( resid   99 and name   HZ )  ( resid  108 and name  HB2 ) 4.69 2.89 0.00 
assign ( resid   99 and name  HB1 )  ( resid  100 and name   HN ) 4.08 2.28 0.00 
assign ( resid   99 and name  HB1 )  ( resid  100 and name  HA# ) 5.34 3.54 0.00 
assign ( resid   99 and name  HB1 )  ( resid  102 and name   HN ) 4.79 2.99 0.00 
assign ( resid   99 and name  HB1 )  ( resid  104 and name  HB1 ) 5.50 3.70 0.00 
assign ( resid   99 and name  HB1 )  ( resid  104 and name  HB2 ) 5.50 3.70 0.00 
assign ( resid   99 and name  HB1 )  ( resid  104 and name  HG# ) 5.34 3.54 0.00 
assign ( resid   99 and name  HB2 )  ( resid  100 and name   HN ) 3.48 1.68 0.00 
assign ( resid   99 and name  HB2 )  ( resid  102 and name   HN ) 5.21 3.41 0.00 
assign ( resid   99 and name  HB2 )  ( resid  103 and name   HA ) 4.70 2.90 0.00 
assign ( resid   99 and name  HB2 )  ( resid  103 and name   HN ) 5.34 3.54 0.00 
assign ( resid   99 and name  HB2 )  ( resid  104 and name   HN ) 4.28 2.48 0.00 
assign ( resid   99 and name  HD# )  ( resid   99 and name   HZ ) 3.96 2.16 0.00 
assign ( resid   99 and name  HD# )  ( resid  103 and name   HA ) 4.94 3.14 0.00 
assign ( resid   99 and name  HD# )  ( resid  103 and name   HN ) 5.46 3.66 0.00 
assign ( resid   99 and name  HD# )  ( resid  103 and name  HB2 ) 3.93 2.13 0.00 
assign ( resid   99 and name  HD# )  ( resid  103 and name  HD# ) 4.41 2.61 0.00 
assign ( resid   99 and name  HD# )  ( resid  103 and name  HE# ) 4.77 2.97 0.00 
assign ( resid   99 and name  HD# )  ( resid  104 and name   HN ) 3.24 1.44 0.00 
assign ( resid   99 and name  HD# )  ( resid  104 and name  HB1 ) 4.51 2.71 0.00 
assign ( resid   99 and name  HD# )  ( resid  104 and name  HB2 ) 4.51 2.71 0.00 
assign ( resid   99 and name  HD# )  ( resid  104 and name  HB# ) 3.89 2.09 0.00 
assign ( resid   99 and name  HD# )  ( resid  107 and name  HB# ) 4.28 2.48 0.00 
assign ( resid   99 and name  HD# )  ( resid  108 and name   HA ) 5.50 3.70 0.00 
assign ( resid   99 and name  HE# )  ( resid  103 and name   HA ) 4.51 2.71 0.00 
assign ( resid   99 and name  HE# )  ( resid  103 and name  HD# ) 4.30 2.50 0.00 
assign ( resid   99 and name  HE# )  ( resid  103 and name  HE# ) 3.11 1.31 0.00 
assign ( resid   99 and name  HE# )  ( resid  104 and name   HN ) 4.09 2.29 0.00 
assign ( resid   99 and name  HE# )  ( resid  104 and name  HB# ) 5.34 3.54 0.00 
assign ( resid   99 and name  HE# )  ( resid  105 and name   HA ) 5.50 3.70 0.00 
assign ( resid   99 and name  HE# )  ( resid  105 and name  HB# ) 4.14 2.34 0.00 
assign ( resid   99 and name  HE# )  ( resid  105 and name  HG1 ) 5.50 3.70 0.00 
assign ( resid   99 and name  HE# )  ( resid  105 and name  HG2 ) 5.49 3.69 0.00 
assign ( resid   99 and name  HE# )  ( resid  107 and name   HN ) 5.33 3.53 0.00 
assign ( resid   99 and name  HE# )  ( resid  107 and name  HB1 ) 5.50 3.70 0.00 
assign ( resid   99 and name  HE# )  ( resid  107 and name  HB2 ) 5.50 3.70 0.00 
assign ( resid   99 and name  HE# )  ( resid  108 and name   HA ) 3.79 1.99 0.00 
assign ( resid   99 and name  HE# )  ( resid  108 and name  HB1 ) 3.53 1.73 0.00 
assign ( resid   99 and name  HE# )  ( resid  108 and name  HB2 ) 4.58 2.78 0.00 
assign ( resid   99 and name  HE# )  ( resid  109 and name   HN ) 5.50 3.70 0.00 
assign ( resid  100 and name   HN )  ( resid  100 and name  HA# ) 2.39 0.59 0.00 
assign ( resid  100 and name   HN )  ( resid  101 and name   HN ) 4.19 2.39 0.00 
assign ( resid  100 and name   HN )  ( resid  101 and name  HB# ) 5.50 3.70 0.00 
assign ( resid  100 and name  HA1 )  ( resid  101 and name  HB# ) 5.50 3.70 0.00 
assign ( resid  100 and name  HA1 )  ( resid  102 and name   HN ) 5.01 3.21 0.00 
assign ( resid  100 and name  HA2 )  ( resid  101 and name  HB# ) 5.50 3.70 0.00 
assign ( resid  100 and name  HA2 )  ( resid  102 and name   HN ) 5.01 3.21 0.00 
assign ( resid  100 and name  HA# )  ( resid  101 and name   HA ) 5.34 3.54 0.00 
assign ( resid  100 and name  HA# )  ( resid  102 and name   HN ) 4.25 2.45 0.00 
assign ( resid  101 and name   HN )  ( resid  101 and name  HB# ) 3.03 1.23 0.00 
assign ( resid  101 and name   HN )  ( resid  102 and name   HN ) 3.87 2.07 0.00 
assign ( resid  101 and name   HN )  ( resid  102 and name HG2# ) 5.50 3.70 0.00 
assign ( resid  101 and name  HB# )  ( resid  102 and name   HN ) 2.69 0.89 0.00 
assign ( resid  101 and name  HB# )  ( resid  102 and name HG1# ) 4.42 2.62 0.00 
assign ( resid  101 and name  HB# )  ( resid  102 and name HG2# ) 3.33 1.53 0.00 
assign ( resid  102 and name   HA )  ( resid  102 and name HG1# ) 3.40 1.60 0.00 
assign ( resid  102 and name   HA )  ( resid  102 and name HG2# ) 3.67 1.87 0.00 
assign ( resid  102 and name   HA )  ( resid  103 and name   HN ) 2.68 0.88 0.00 
assign ( resid  102 and name   HB )  ( resid  103 and name   HN ) 3.21 1.41 0.00 
assign ( resid  102 and name   HB )  ( resid  104 and name   HN ) 5.04 3.24 0.00 
assign ( resid  102 and name   HB )  ( resid  104 and name  HB# ) 5.34 3.54 0.00 
assign ( resid  102 and name   HB )  ( resid  104 and name  HE# ) 4.16 2.36 0.00 
assign ( resid  102 and name   HN )  ( resid  102 and name   HB ) 3.37 1.57 0.00 
assign ( resid  102 and name   HN )  ( resid  102 and name HG1# ) 3.90 2.10 0.00 
assign ( resid  102 and name   HN )  ( resid  102 and name HG2# ) 2.97 1.17 0.00 
assign ( resid  102 and name   HN )  ( resid  103 and name   HN ) 4.59 2.79 0.00 
assign ( resid  102 and name   HN )  ( resid  104 and name  HE# ) 4.83 3.03 0.00 
assign ( resid  102 and name   HN )  ( resid  104 and name  HG# ) 5.34 3.54 0.00 
assign ( resid  102 and name HG1# )  ( resid  103 and name   HN ) 3.06 1.26 0.00 
assign ( resid  102 and name HG1# )  ( resid  104 and name  HB# ) 5.34 3.54 0.00 
assign ( resid  102 and name HG1# )  ( resid  104 and name  HE# ) 5.01 3.21 0.00 
assign ( resid  102 and name HG2# )  ( resid  104 and name   HN ) 5.50 3.70 0.00 
assign ( resid  102 and name HG2# )  ( resid  104 and name  HE# ) 4.53 2.73 0.00 
assign ( resid  103 and name   HA )  ( resid  103 and name  HD# ) 3.65 1.85 0.00 
assign ( resid  103 and name   HA )  ( resid  103 and name  HE# ) 5.50 3.70 0.00 
assign ( resid  103 and name   HA )  ( resid  104 and name   HA ) 5.50 3.70 0.00 
assign ( resid  103 and name   HA )  ( resid  104 and name   HN ) 2.50 0.70 0.00 
assign ( resid  103 and name   HN )  ( resid  103 and name  HB1 ) 2.70 0.90 0.00 
assign ( resid  103 and name   HN )  ( resid  103 and name  HB2 ) 3.49 1.69 0.00 
assign ( resid  103 and name   HN )  ( resid  103 and name  HD# ) 4.21 2.41 0.00 
assign ( resid  103 and name   HN )  ( resid  104 and name   HN ) 4.59 2.79 0.00 
assign ( resid  103 and name   HN )  ( resid  104 and name  HE# ) 5.50 3.70 0.00 
assign ( resid  103 and name   HN )  ( resid  105 and name  HD1 ) 5.50 3.70 0.00 
assign ( resid  103 and name  HB1 )  ( resid  104 and name   HN ) 4.75 2.95 0.00 
assign ( resid  103 and name  HB2 )  ( resid  104 and name   HN ) 4.60 2.80 0.00 
assign ( resid  103 and name  HD# )  ( resid  104 and name   HN ) 3.69 1.89 0.00 
assign ( resid  103 and name  HD# )  ( resid  105 and name  HD1 ) 5.50 3.70 0.00 
assign ( resid  103 and name  HD# )  ( resid  105 and name  HD2 ) 5.50 3.70 0.00 
assign ( resid  103 and name  HE# )  ( resid  104 and name   HA ) 5.01 3.21 0.00 
assign ( resid  103 and name  HE# )  ( resid  104 and name   HN ) 4.74 2.94 0.00 
assign ( resid  103 and name  HE# )  ( resid  105 and name   HA ) 3.57 1.77 0.00 
assign ( resid  103 and name  HE# )  ( resid  105 and name  HB# ) 3.64 1.84 0.00 
assign ( resid  103 and name  HE# )  ( resid  105 and name  HD1 ) 2.99 1.19 0.00 
assign ( resid  103 and name  HE# )  ( resid  105 and name  HD2 ) 4.35 2.55 0.00 
assign ( resid  103 and name  HE# )  ( resid  105 and name  HG1 ) 3.41 1.61 0.00 
assign ( resid  103 and name  HE# )  ( resid  105 and name  HG2 ) 4.50 2.70 0.00 
assign ( resid  103 and name  HE# )  ( resid  108 and name   HA ) 5.50 3.70 0.00 
assign ( resid  103 and name  HE# )  ( resid  108 and name  HB1 ) 4.94 3.14 0.00 
assign ( resid  103 and name  HE# )  ( resid  108 and name  HB2 ) 5.50 3.70 0.00 
assign ( resid  104 and name   HA )  ( resid  104 and name  HD# ) 4.34 2.54 0.00 
assign ( resid  104 and name   HA )  ( resid  104 and name  HE# ) 5.50 3.70 0.00 
assign ( resid  104 and name   HA )  ( resid  104 and name  HG# ) 3.61 1.81 0.00 
assign ( resid  104 and name   HA )  ( resid  105 and name  HD1 ) 3.31 1.51 0.00 
assign ( resid  104 and name   HA )  ( resid  105 and name  HD2 ) 3.36 1.56 0.00 
assign ( resid  104 and name   HA )  ( resid  106 and name   HN ) 3.98 2.18 0.00 
assign ( resid  104 and name   HA )  ( resid  106 and name  HD# ) 4.85 3.05 0.00 
assign ( resid  104 and name   HN )  ( resid  104 and name  HB1 ) 3.85 2.05 0.00 
assign ( resid  104 and name   HN )  ( resid  104 and name  HB2 ) 3.85 2.05 0.00 
assign ( resid  104 and name   HN )  ( resid  104 and name  HE# ) 4.55 2.75 0.00 
assign ( resid  104 and name   HN )  ( resid  104 and name  HG# ) 3.26 1.46 0.00 
assign ( resid  104 and name   HN )  ( resid  105 and name   HA ) 5.16 3.36 0.00 
assign ( resid  104 and name   HN )  ( resid  105 and name  HD1 ) 4.82 3.02 0.00 
assign ( resid  104 and name   HN )  ( resid  107 and name   HN ) 5.50 3.70 0.00 
assign ( resid  104 and name  HB1 )  ( resid  104 and name  HD# ) 3.13 1.33 0.00 
assign ( resid  104 and name  HB1 )  ( resid  104 and name  HE# ) 5.50 3.70 0.00 
assign ( resid  104 and name  HB1 )  ( resid  105 and name  HD2 ) 5.50 3.70 0.00 
assign ( resid  104 and name  HB1 )  ( resid  107 and name  HG# ) 5.50 3.70 0.00 
assign ( resid  104 and name  HB2 )  ( resid  104 and name  HD# ) 3.13 1.33 0.00 
assign ( resid  104 and name  HB2 )  ( resid  104 and name  HE# ) 5.50 3.70 0.00 
assign ( resid  104 and name  HB2 )  ( resid  105 and name  HD2 ) 5.50 3.70 0.00 
assign ( resid  104 and name  HB2 )  ( resid  107 and name  HG# ) 5.50 3.70 0.00 
assign ( resid  104 and name  HB# )  ( resid  104 and name  HD# ) 2.46 0.66 0.00 
assign ( resid  104 and name  HB# )  ( resid  105 and name  HD1 ) 5.34 3.54 0.00 
assign ( resid  104 and name  HB# )  ( resid  107 and name  HB# ) 4.50 2.70 0.00 
assign ( resid  104 and name  HB# )  ( resid  107 and name  HG# ) 4.65 2.85 0.00 
assign ( resid  104 and name  HG1 )  ( resid  105 and name  HD1 ) 5.50 3.70 0.00 
assign ( resid  104 and name  HG1 )  ( resid  105 and name  HD2 ) 5.50 3.70 0.00 
assign ( resid  104 and name  HG2 )  ( resid  105 and name  HD1 ) 5.50 3.70 0.00 
assign ( resid  104 and name  HG2 )  ( resid  105 and name  HD2 ) 5.50 3.70 0.00 
assign ( resid  104 and name  HG# )  ( resid  106 and name   HN ) 5.34 3.54 0.00 
assign ( resid  105 and name   HA )  ( resid  106 and name   HN ) 3.46 1.66 0.00 
assign ( resid  105 and name   HA )  ( resid  108 and name   HN ) 4.27 2.47 0.00 
assign ( resid  105 and name   HA )  ( resid  108 and name  HB1 ) 3.50 1.70 0.00  
assign ( resid  105 and name   HA )  ( resid  108 and name  HB2 ) 4.50 2.70 0.00 
assign ( resid  105 and name  HB# )  ( resid  108 and name   HN ) 5.19 3.39 0.00 
assign ( resid  105 and name  HD1 )  ( resid  106 and name   HN ) 4.06 2.26 0.00 
assign ( resid  105 and name  HD2 )  ( resid  106 and name   HN ) 3.74 1.94 0.00 
assign ( resid  105 and name  HD2 )  ( resid  106 and name  HD# ) 4.79 2.99 0.00 
assign ( resid  106 and name   HA )  ( resid  106 and name  HD# ) 4.32 2.52 0.00 
assign ( resid  106 and name   HA )  ( resid  106 and name  HE# ) 5.50 3.70 0.00 
assign ( resid  106 and name   HA )  ( resid  106 and name  HG# ) 3.80 2.00 0.00 
assign ( resid  106 and name   HN )  ( resid  106 and name  HB# ) 2.53 0.73 0.00 
assign ( resid  106 and name   HN )  ( resid  106 and name  HD# ) 3.76 1.96 0.00 
assign ( resid  106 and name   HN )  ( resid  106 and name  HG# ) 3.40 1.60 0.00 
assign ( resid  106 and name   HN )  ( resid  107 and name   HN ) 2.74 0.94 0.00 
assign ( resid  106 and name   HN )  ( resid  107 and name  HG# ) 5.04 3.24 0.00 
assign ( resid  106 and name  HB# )  ( resid  106 and name  HD# ) 3.13 1.33 0.00 
assign ( resid  106 and name  HB# )  ( resid  106 and name  HE# ) 4.55 2.75 0.00 
assign ( resid  106 and name  HB# )  ( resid  106 and name  HG# ) 2.88 1.08 0.00 
assign ( resid  106 and name  HB# )  ( resid  107 and name   HA ) 4.99 3.19 0.00 
assign ( resid  106 and name  HB# )  ( resid  108 and name   HN ) 4.98 3.18 0.00 
assign ( resid  106 and name  HG# )  ( resid  106 and name  HD# ) 2.81 1.01 0.00 
assign ( resid  106 and name  HG# )  ( resid  106 and name  HE# ) 2.95 1.15 0.00 
assign ( resid  107 and name   HA )  ( resid  107 and name  HG# ) 3.19 1.39 0.00 
assign ( resid  107 and name   HN )  ( resid  107 and name  HB# ) 2.59 0.79 0.00 
assign ( resid  107 and name   HN )  ( resid  107 and name  HG# ) 3.43 1.63 0.00 
assign ( resid  107 and name   HN )  ( resid  108 and name   HN ) 2.40 0.60 0.00 
assign ( resid  107 and name   HN )  ( resid  108 and name  HB1 ) 4.55 2.75 0.00 
assign ( resid  107 and name  HB1 )  ( resid  108 and name   HN ) 4.55 2.75 0.00 
assign ( resid  107 and name  HB2 )  ( resid  108 and name   HN ) 4.55 2.75 0.00 
assign ( resid  107 and name  HB# )  ( resid  108 and name   HN ) 3.88 2.08 0.00 
assign ( resid  108 and name   HA )  ( resid  109 and name   HN ) 2.82 1.02 0.00 
assign ( resid  108 and name   HA )  ( resid  110 and name   HN ) 5.12 3.32 0.00 
assign ( resid  108 and name   HN )  ( resid  108 and name  HB1 ) 2.98 1.18 0.00 
assign ( resid  108 and name   HN )  ( resid  108 and name  HB2 ) 3.73 1.93 0.00 
assign ( resid  108 and name   HN )  ( resid  109 and name   HN ) 4.70 2.90 0.00 
assign ( resid  108 and name   HN )  ( resid  109 and name HG2# ) 5.50 3.70 0.00 
assign ( resid  108 and name  HB2 )  ( resid  109 and name   HN ) 4.10 2.30 0.00 
assign ( resid  108 and name  HB2 )  ( resid  110 and name   HN ) 4.97 3.17 0.00 
assign ( resid  109 and name   HA )  ( resid  109 and name   HB ) 2.98 1.18 0.00 
assign ( resid  109 and name   HA )  ( resid  109 and name HG2# ) 3.37 1.57 0.00 
assign ( resid  109 and name   HA )  ( resid  110 and name   HN ) 3.42 1.62 0.00 
assign ( resid  109 and name   HN )  ( resid  109 and name   HB ) 3.89 2.09 0.00 
assign ( resid  109 and name   HN )  ( resid  109 and name HG2# ) 3.60 1.80 0.00 
assign ( resid  109 and name   HN )  ( resid  110 and name   HN ) 3.47 1.67 0.00 
assign ( resid  109 and name   HN )  ( resid  110 and name  HB# ) 5.33 3.53 0.00 
assign ( resid  109 and name   HN )  ( resid  110 and name  HG# ) 5.50 3.70 0.00 
assign ( resid  109 and name HG2# )  ( resid  110 and name   HN ) 3.99 2.19 0.00 
assign ( resid  110 and name   HA )  ( resid  110 and name  HG# ) 3.78 1.98 0.00 
assign ( resid  110 and name   HA )  ( resid  111 and name   HN ) 3.78 1.98 0.00 
assign ( resid  110 and name   HN )  ( resid  110 and name  HB# ) 2.90 1.10 0.00  
assign ( resid  110 and name   HN )  ( resid  110 and name  HG# ) 3.69 1.89 0.00 
assign ( resid  110 and name   HN )  ( resid  111 and name   HG ) 5.50 3.70 0.00 
assign ( resid  110 and name   HN )  ( resid  111 and name  HB# ) 5.34 3.54 0.00 
assign ( resid  110 and name   HN )  ( resid  111 and name  HD# ) 5.44 3.64 0.00 
assign ( resid  110 and name  HB1 )  ( resid  110 and name  HG# ) 2.87 1.07 0.00 
assign ( resid  110 and name  HB2 )  ( resid  110 and name  HG# ) 2.87 1.07 0.00 
assign ( resid  110 and name  HB# )  ( resid  110 and name  HG# ) 2.42 0.62 0.00 
assign ( resid  110 and name  HB# )  ( resid  111 and name   HN ) 3.07 1.27 0.00 
assign ( resid  110 and name  HG# )  ( resid  111 and name   HN ) 3.81 2.01 0.00 
assign ( resid  110 and name  HG# )  ( resid  112 and name   HN ) 5.50 3.70 0.00 
assign ( resid  111 and name   HA )  ( resid  111 and name   HN ) 3.78 1.98 0.00 
assign ( resid  111 and name   HA )  ( resid  111 and name   HG ) 4.10 2.30 0.00 
assign ( resid  111 and name   HA )  ( resid  111 and name  HD# ) 3.35 1.55 0.00 
assign ( resid  111 and name   HA )  ( resid  111 and name HD1# ) 4.26 2.46 0.00 
assign ( resid  111 and name   HA )  ( resid  111 and name HD2# ) 4.26 2.46 0.00 
assign ( resid  111 and name   HA )  ( resid  112 and name   HN ) 2.57 0.77 0.00 
assign ( resid  111 and name   HN )  ( resid  111 and name  HD# ) 4.08 2.28 0.00 
assign ( resid  111 and name   HN )  ( resid  112 and name   HN ) 4.37 2.57 0.00 
assign ( resid  111 and name  HB1 )  ( resid  111 and name HD1# ) 4.00 2.20 0.00 
assign ( resid  111 and name  HB1 )  ( resid  111 and name HD2# ) 4.00 2.20 0.00 
assign ( resid  111 and name  HB2 )  ( resid  111 and name HD1# ) 4.00 2.20 0.00 
assign ( resid  111 and name  HB2 )  ( resid  111 and name HD2# ) 4.00 2.20 0.00 
assign ( resid  111 and name  HB# )  ( resid  112 and name   HN ) 3.29 1.49 0.00 
assign ( resid  111 and name  HD# )  ( resid  112 and name   HN ) 4.32 2.52 0.00 
assign ( resid  112 and name   HA )  ( resid  112 and name  HG# ) 4.00 2.20 0.00 
assign ( resid  112 and name   HN )  ( resid  112 and name  HB1 ) 3.64 1.84 0.00 
assign ( resid  112 and name   HN )  ( resid  112 and name  HB2 ) 3.64 1.84 0.00 
assign ( resid  112 and name   HN )  ( resid  112 and name  HB# ) 2.84 1.04 0.00 
assign ( resid  112 and name   HN )  ( resid  112 and name  HG# ) 3.34 1.54 0.00 

! H-bond constraints
assign ( resid   21 and name   HN )  ( resid   17 and name    O ) 2.00 0.20 0.00 
assign ( resid   21 and name    N )  ( resid   17 and name    O ) 3.00 1.20 0.00 
assign ( resid   22 and name   HN )  ( resid   18 and name    O ) 2.00 0.20 0.00 
assign ( resid   22 and name    N )  ( resid   18 and name    O ) 3.00 1.20 0.00 
assign ( resid   23 and name   HN )  ( resid   19 and name    O ) 2.00 0.20 0.00 
assign ( resid   23 and name    N )  ( resid   19 and name    O ) 3.00 1.20 0.00 
assign ( resid   24 and name   HN )  ( resid   20 and name    O ) 2.00 0.20 0.00 
assign ( resid   24 and name    N )  ( resid   20 and name    O ) 3.00 1.20 0.00 
assign ( resid   25 and name   HN )  ( resid   21 and name    O ) 2.00 0.20 0.00 
assign ( resid   25 and name    N )  ( resid   21 and name    O ) 3.00 1.20 0.00 
assign ( resid   26 and name   HN )  ( resid   22 and name    O ) 2.00 0.20 0.00 
assign ( resid   26 and name    N )  ( resid   22 and name    O ) 3.00 1.20 0.00 
assign ( resid   27 and name   HN )  ( resid   23 and name    O ) 2.00 0.20 0.00 
assign ( resid   27 and name    N )  ( resid   23 and name    O ) 3.00 1.20 0.00 
assign ( resid   28 and name   HN )  ( resid   24 and name    O ) 2.00 0.20 0.00 
assign ( resid   28 and name    N )  ( resid   24 and name    O ) 3.00 1.20 0.00 
assign ( resid   29 and name   HN )  ( resid   25 and name    O ) 2.00 0.20 0.00 
assign ( resid   29 and name    N )  ( resid   25 and name    O ) 3.00 1.20 0.00 
assign ( resid   30 and name   HN )  ( resid   26 and name    O ) 2.00 0.20 0.00 
assign ( resid   30 and name    N )  ( resid   26 and name    O ) 3.00 1.20 0.00 
assign ( resid   31 and name   HN )  ( resid   27 and name    O ) 2.00 0.20 0.00 
assign ( resid   31 and name    N )  ( resid   27 and name    O ) 3.00 1.20 0.00 
assign ( resid   32 and name   HN )  ( resid   28 and name    O ) 2.00 0.20 0.00 
assign ( resid   32 and name    N )  ( resid   28 and name    O ) 3.00 1.20 0.00 
assign ( resid   33 and name   HN )  ( resid   29 and name    O ) 2.00 0.20 0.00 
assign ( resid   33 and name    N )  ( resid   29 and name    O ) 3.00 1.20 0.00 
assign ( resid   34 and name   HN )  ( resid   30 and name    O ) 2.00 0.20 0.00 
assign ( resid   34 and name    N )  ( resid   30 and name    O ) 3.00 1.20 0.00 
assign ( resid   35 and name   HN )  ( resid   31 and name    O ) 2.00 0.20 0.00 
assign ( resid   35 and name    N )  ( resid   31 and name    O ) 3.00 1.20 0.00 
assign ( resid   54 and name   HN )  ( resid   50 and name    O ) 2.00 0.20 0.00 
assign ( resid   54 and name    N )  ( resid   50 and name    O ) 3.00 1.20 0.00 
assign ( resid   55 and name   HN )  ( resid   51 and name    O ) 2.00 0.20 0.00 
assign ( resid   55 and name    N )  ( resid   51 and name    O ) 3.00 1.20 0.00 
assign ( resid   56 and name   HN )  ( resid   52 and name    O ) 2.00 0.20 0.00 
assign ( resid   56 and name    N )  ( resid   52 and name    O ) 3.00 1.20 0.00 
assign ( resid   57 and name   HN )  ( resid   53 and name    O ) 2.00 0.20 0.00 
assign ( resid   57 and name    N )  ( resid   53 and name    O ) 3.00 1.20 0.00 
assign ( resid   58 and name   HN )  ( resid   54 and name    O ) 2.00 0.20 0.00 
assign ( resid   58 and name    N )  ( resid   54 and name    O ) 3.00 1.20 0.00 
assign ( resid   59 and name   HN )  ( resid   55 and name    O ) 2.00 0.20 0.00 
assign ( resid   59 and name    N )  ( resid   55 and name    O ) 3.00 1.20 0.00 
assign ( resid   60 and name   HN )  ( resid   56 and name    O ) 2.00 0.20 0.00 
assign ( resid   60 and name    N )  ( resid   56 and name    O ) 3.00 1.20 0.00 
assign ( resid   61 and name   HN )  ( resid   57 and name    O ) 2.00 0.20 0.00 
assign ( resid   61 and name    N )  ( resid   57 and name    O ) 3.00 1.20 0.00 
assign ( resid   62 and name   HN )  ( resid   58 and name    O ) 2.00 0.20 0.00 
assign ( resid   62 and name    N )  ( resid   58 and name    O ) 3.00 1.20 0.00 
assign ( resid   68 and name   HN )  ( resid   64 and name    O ) 2.00 0.20 0.00 
assign ( resid   68 and name    N )  ( resid   64 and name    O ) 3.00 1.20 0.00 
assign ( resid   69 and name   HN )  ( resid   65 and name    O ) 2.00 0.20 0.00 
assign ( resid   69 and name    N )  ( resid   65 and name    O ) 3.00 1.20 0.00 
assign ( resid   70 and name   HN )  ( resid   66 and name    O ) 2.00 0.20 0.00 
assign ( resid   70 and name    N )  ( resid   66 and name    O ) 3.00 1.20 0.00 
assign ( resid   71 and name   HN )  ( resid   67 and name    O ) 2.00 0.20 0.00 
assign ( resid   71 and name    N )  ( resid   67 and name    O ) 3.00 1.20 0.00 
assign ( resid   86 and name   HN )  ( resid   82 and name    O ) 2.00 0.20 0.00 
assign ( resid   86 and name    N )  ( resid   82 and name    O ) 3.00 1.20 0.00 
assign ( resid   87 and name   HN )  ( resid   83 and name    O ) 2.00 0.20 0.00 
assign ( resid   87 and name    N )  ( resid   83 and name    O ) 3.00 1.20 0.00 
assign ( resid   88 and name   HN )  ( resid   84 and name    O ) 2.00 0.20 0.00 
assign ( resid   88 and name    N )  ( resid   84 and name    O ) 3.00 1.20 0.00 
assign ( resid   89 and name   HN )  ( resid   85 and name    O ) 2.00 0.20 0.00 
assign ( resid   89 and name    N )  ( resid   85 and name    O ) 3.00 1.20 0.00 
assign ( resid   90 and name   HN )  ( resid   86 and name    O ) 2.00 0.20 0.00 
assign ( resid   90 and name    N )  ( resid   86 and name    O ) 3.00 1.20 0.00 
assign ( resid   91 and name   HN )  ( resid   87 and name    O ) 2.00 0.20 0.00 
assign ( resid   91 and name    N )  ( resid   87 and name    O ) 3.00 1.20 0.00 
assign ( resid   92 and name   HN )  ( resid   88 and name    O ) 2.00 0.20 0.00 
assign ( resid   92 and name    N )  ( resid   88 and name    O ) 3.00 1.20 0.00 
assign ( resid   93 and name   HN )  ( resid   89 and name    O ) 2.00 0.20 0.00 
assign ( resid   93 and name    N )  ( resid   89 and name    O ) 3.00 1.20 0.00 
assign ( resid   94 and name   HN )  ( resid   90 and name    O ) 2.00 0.20 0.00 
assign ( resid   94 and name    N )  ( resid   90 and name    O ) 3.00 1.20 0.00 
assign ( resid   95 and name   HN )  ( resid   91 and name    O ) 2.00 0.20 0.00 
assign ( resid   95 and name    N )  ( resid   91 and name    O ) 3.00 1.20 0.00 
assign ( resid   96 and name   HN )  ( resid   92 and name    O ) 2.00 0.20 0.00 
assign ( resid   96 and name    N )  ( resid   92 and name    O ) 3.00 1.20 0.00 
assign ( resid   97 and name   HN )  ( resid   93 and name    O ) 2.00 0.20 0.00 
assign ( resid   97 and name    N )  ( resid   93 and name    O ) 3.00 1.20 0.00 


! Dihedral angle constraints
assign (resid  10 and name C  )   (resid  11 and name N  )
       (resid  11 and name CA )   (resid  11 and name C  )  1.0  -64.4  36.4 2

assign (resid  11 and name N  )   (resid  11 and name CA )
       (resid  11 and name C  )   (resid  12 and name N  )  1.0  -36.2  33.8 2

assign (resid  11 and name C  )   (resid  12 and name N  )
       (resid  12 and name CA )   (resid  12 and name C  )  1.0  -68.4  33.4 2
assign (resid  12 and name N  )   (resid  12 and name CA )
       (resid  12 and name C  )   (resid  13 and name N  )  1.0  -33.2  31.8 2

assign (resid  12 and name C  )   (resid  13 and name N  ) 
       (resid  13 and name CA )   (resid  13 and name C  )  1.0  -57.4  21.4 2 
assign (resid  13 and name N  )   (resid  13 and name CA ) 
       (resid  13 and name C  )   (resid  14 and name N  )  1.0  -37.2  26.8 2 

assign (resid  13 and name C  )   (resid  14 and name N  ) 
       (resid  14 and name CA )   (resid  14 and name C  )  1.0  -63.9  19.0 2 
assign (resid  14 and name N  )   (resid  14 and name CA ) 
       (resid  14 and name C  )   (resid  15 and name N  )  1.0  -39.6  20.7 2 

assign (resid  14 and name C  )   (resid  15 and name N  ) 
       (resid  15 and name CA )   (resid  15 and name C  )  1.0  -68.3  32.6 2 
assign (resid  15 and name N  )   (resid  15 and name CA ) 
       (resid  15 and name C  )   (resid  16 and name N  )  1.0  -37.2  31.9 2 

assign (resid  15 and name C  )   (resid  16 and name N  ) 
       (resid  16 and name CA )   (resid  16 and name C  )  1.0  -65.4  22.5 2 
assign (resid  16 and name N  )   (resid  16 and name CA ) 
       (resid  16 and name C  )   (resid  17 and name N  )  1.0  -41.7  19.1 2 

assign (resid  16 and name C  )   (resid  17 and name N  ) 
       (resid  17 and name CA )   (resid  17 and name C  )  1.0  -63.2  17.1 2 
assign (resid  17 and name N  )   (resid  17 and name CA ) 
       (resid  17 and name C  )   (resid  18 and name N  )  1.0  -42.6  36.8 2 

assign (resid  17 and name C  )   (resid  18 and name N  ) 
       (resid  18 and name CA )   (resid  18 and name C  )  1.0  -66.7  23.6 2 
assign (resid  18 and name N  )   (resid  18 and name CA ) 
       (resid  18 and name C  )   (resid  19 and name N  )  1.0  -36.5  28.6 2 

assign (resid  18 and name C  )   (resid  19 and name N  ) 
       (resid  19 and name CA )   (resid  19 and name C  )  1.0  -62.0  15.9 2 
assign (resid  19 and name N  )   (resid  19 and name CA ) 
       (resid  19 and name C  )   (resid  20 and name N  )  1.0  -43.0  14.0 2 

assign (resid  19 and name C  )   (resid  20 and name N  ) 
       (resid  20 and name CA )   (resid  20 and name C  )  1.0  -66.4  14.7 2 
assign (resid  20 and name N  )   (resid  20 and name CA ) 
       (resid  20 and name C  )   (resid  21 and name N  )  1.0  -35.3  18.0 2 

assign (resid  20 and name C  )   (resid  21 and name N  ) 
       (resid  21 and name CA )   (resid  21 and name C  )  1.0  -67.4  16.1 2 
assign (resid  21 and name N  )   (resid  21 and name CA ) 
       (resid  21 and name CB )   (resid  21 and name CG1)  1.0  180.0  15.0 2 
assign (resid  21 and name N  )   (resid  21 and name CA ) 
       (resid  21 and name C  )   (resid  22 and name N  )  1.0  -44.4  12.1 2 

assign (resid  21 and name C  )   (resid  22 and name N  ) 
       (resid  22 and name CA )   (resid  22 and name C  )  1.0  -59.5   9.0 2 
assign (resid  22 and name N  )   (resid  22 and name CA ) 
       (resid  22 and name C  )   (resid  23 and name N  )  1.0  -44.0   9.8 2 

assign (resid  22 and name C  )   (resid  23 and name N  ) 
       (resid  23 and name CA )   (resid  23 and name C  )  1.0  -64.1  18.1 2 
assign (resid  23 and name N  )   (resid  23 and name CA ) 
       (resid  23 and name C  )   (resid  24 and name N  )  1.0  -41.2  14.2 2 

assign (resid  23 and name C  )   (resid  24 and name N  ) 
       (resid  24 and name CA )   (resid  24 and name C  )  1.0  -64.7  20.4 2 
assign (resid  24 and name N  )   (resid  24 and name CA ) 
       (resid  24 and name C  )   (resid  25 and name N  )  1.0  -42.2  18.0 2 

assign (resid  24 and name C  )   (resid  25 and name N  ) 
       (resid  25 and name CA )   (resid  25 and name C  )  1.0  -65.6  13.0 2 
assign (resid  25 and name N  )   (resid  25 and name CA ) 
       (resid  25 and name C  )   (resid  26 and name N  )  1.0  -43.8  16.6 2 

assign (resid  25 and name C  )   (resid  26 and name N  ) 
       (resid  26 and name CA )   (resid  26 and name C  )  1.0  -67.0  21.5 2 
assign (resid  26 and name N  )   (resid  26 and name CA ) 
       (resid  26 and name C  )   (resid  27 and name N  )  1.0  -41.0  28.0 2 

assign (resid  26 and name C  )   (resid  27 and name N  ) 
       (resid  27 and name CA )   (resid  27 and name C  )  1.0  -66.4  19.0 2 
assign (resid  27 and name N  )   (resid  27 and name CA ) 
       (resid  27 and name C  )   (resid  28 and name N  )  1.0  -39.3  29.7 2 

assign (resid  27 and name C  )   (resid  28 and name N  ) 
       (resid  28 and name CA )   (resid  28 and name C  )  1.0  -65.9  24.7 2 
assign (resid  28 and name N  )   (resid  28 and name CA ) 
       (resid  28 and name C  )   (resid  29 and name N  )  1.0  -39.5  30.0 2 

assign (resid  28 and name C  )   (resid  29 and name N  ) 
       (resid  29 and name CA )   (resid  29 and name C  )  1.0  -69.6  22.3 2 
assign (resid  29 and name N  )   (resid  29 and name CA ) 
       (resid  29 and name C  )   (resid  30 and name N  )  1.0  -41.2  31.2 2 

assign (resid  29 and name C  )   (resid  30 and name N  ) 
       (resid  30 and name CA )   (resid  30 and name C  )  1.0  -62.4  10.0 2 
assign (resid  30 and name N  )   (resid  30 and name CA ) 
       (resid  30 and name C  )   (resid  31 and name N  )  1.0  -43.9  30.4 2 

assign (resid  30 and name C  )   (resid  31 and name N  ) 
       (resid  31 and name CA )   (resid  31 and name C  )  1.0  -63.8  34.8 2 
assign (resid  31 and name N  )   (resid  31 and name CA ) 
       (resid  31 and name CB )   (resid  31 and name CG1)  1.0  180.0  20.2 2 
assign (resid  31 and name N  )   (resid  31 and name CA ) 
       (resid  31 and name C  )   (resid  32 and name N  )  1.0  -44.0  37.2 2 

assign (resid  31 and name C  )   (resid  32 and name N  ) 
       (resid  32 and name CA )   (resid  32 and name C  )  1.0  -61.8  15.8 2 
assign (resid  32 and name N  )   (resid  32 and name CA ) 
       (resid  32 and name CB )   (resid  32 and name CG )  1.0  180.0  15.0 2 
assign (resid  32 and name N  )   (resid  32 and name CA ) 
       (resid  32 and name C  )   (resid  33 and name N  )  1.0  -40.8  19.2 2 

assign (resid  32 and name C  )   (resid  33 and name N  ) 
       (resid  33 and name CA )   (resid  33 and name C  )  1.0  -61.8  18.5 2 
assign (resid  33 and name N  )   (resid  33 and name CA ) 
       (resid  33 and name C  )   (resid  34 and name N  )  1.0  -42.5  31.4 2 

assign (resid  33 and name C  )   (resid  34 and name N  ) 
       (resid  34 and name CA )   (resid  34 and name C  )  1.0  -81.9  36.0 2 
assign (resid  34 and name N  )   (resid  34 and name CA ) 
       (resid  34 and name C  )   (resid  35 and name N  )  1.0  -27.8  73.2 2 

assign (resid  34 and name C  )   (resid  35 and name N  ) 
       (resid  35 and name CA )   (resid  35 and name C  )  1.0  -52.2  27.2 2 
assign (resid  35 and name N  )   (resid  35 and name CA ) 
       (resid  35 and name C  )   (resid  36 and name N  )  1.0  -43.9  29.8 2 

assign (resid  35 and name C  )   (resid  36 and name N  ) 
       (resid  36 and name CA )   (resid  36 and name C  )  1.0  -65.8  34.7 2 
assign (resid  36 and name N  )   (resid  36 and name CA ) 
       (resid  36 and name C  )   (resid  37 and name N  )  1.0  -30.7  41.8 2 

assign (resid  38 and name C  )   (resid  39 and name N  ) 
       (resid  39 and name CA )   (resid  39 and name C  )  1.0  -76.4  28.2 2 
assign (resid  39 and name N  )   (resid  39 and name CA ) 
       (resid  39 and name C  )   (resid  40 and name N  )  1.0  148.2  39.8 2 

assign (resid  39 and name C  )   (resid  40 and name N  ) 
       (resid  40 and name CA )   (resid  40 and name C  )  1.0  -59.2  22.9 2 
assign (resid  40 and name N  )   (resid  40 and name CA ) 
       (resid  40 and name C  )   (resid  41 and name N  )  1.0  -22.1  29.4 2 

assign (resid  41 and name C  )   (resid  42 and name N  ) 
       (resid  42 and name CA )   (resid  42 and name C  )  1.0  -74.3  40.8 2 
assign (resid  42 and name N  )   (resid  42 and name CA ) 
       (resid  42 and name C  )   (resid  43 and name N  )  1.0  133.6  43.5 2 

assign (resid  43 and name C  )   (resid  44 and name N  ) 
       (resid  44 and name CA )   (resid  44 and name C  )  1.0 -129.6  53.1 2 
assign (resid  44 and name N  )   (resid  44 and name CA ) 
       (resid  44 and name C  )   (resid  45 and name N  )  1.0  143.8  70.1 2 

assign (resid  47 and name C  )   (resid  48 and name N  ) 
       (resid  48 and name CA )   (resid  48 and name C  )  1.0  -85.3  57.7 2 
assign (resid  48 and name N  )   (resid  48 and name CA ) 
       (resid  48 and name C  )   (resid  49 and name N  )  1.0  -20.8  44.2 2 

assign (resid  48 and name C  )   (resid  49 and name N  ) 
       (resid  49 and name CA )   (resid  49 and name C  )  1.0 -128.2  59.2 2 
assign (resid  49 and name N  )   (resid  49 and name CA ) 
       (resid  49 and name C  )   (resid  50 and name N  )  1.0  155.2  20.8 2 

assign (resid  50 and name C  )   (resid  51 and name N  ) 
       (resid  51 and name CA )   (resid  51 and name C  )  1.0  -62.1   9.0 2 
assign (resid  51 and name N  )   (resid  51 and name CA ) 
       (resid  51 and name C  )   (resid  52 and name N  )  1.0  -37.7  17.3 2 

assign (resid  51 and name C  )   (resid  52 and name N  ) 
       (resid  52 and name CA )   (resid  52 and name C  )  1.0  -69.0  18.1 2 
assign (resid  52 and name N  )   (resid  52 and name CA ) 
       (resid  52 and name C  )   (resid  53 and name N  )  1.0  -38.0  30.0 2 

assign (resid  52 and name C  )   (resid  53 and name N  ) 
       (resid  53 and name CA )   (resid  53 and name C  )  1.0  -62.7  23.8 2 
assign (resid  53 and name N  )   (resid  53 and name CA ) 
       (resid  53 and name C  )   (resid  54 and name N  )  1.0  -44.8  20.8 2 

assign (resid  53 and name C  )   (resid  54 and name N  ) 
       (resid  54 and name CA )   (resid  54 and name C  )  1.0  -61.5  17.0 2 
assign (resid  54 and name N  )   (resid  54 and name CA ) 
       (resid  54 and name C  )   (resid  55 and name N  )  1.0  -38.5  12.4 2 

assign (resid  54 and name C  )   (resid  55 and name N  ) 
       (resid  55 and name CA )   (resid  55 and name C  )  1.0  -67.0  14.8 2 
assign (resid  55 and name N  )   (resid  55 and name CA ) 
       (resid  55 and name CB )   (resid  55 and name CG )  1.0  180.0  15.0 2  
assign (resid  55 and name N  )   (resid  55 and name CA ) 
       (resid  55 and name C  )   (resid  56 and name N  )  1.0  -42.4  22.3 2 

assign (resid  55 and name C  )   (resid  56 and name N  ) 
       (resid  56 and name CA )   (resid  56 and name C  )  1.0  -68.6  28.3 2 
assign (resid  56 and name N  )   (resid  56 and name CA ) 
       (resid  56 and name C  )   (resid  57 and name N  )  1.0  -41.2  18.8 2 

assign (resid  56 and name C  )   (resid  57 and name N  ) 
       (resid  57 and name CA )   (resid  57 and name C  )  1.0  -64.4  18.7 2 
assign (resid  57 and name N  )   (resid  57 and name CA ) 
       (resid  57 and name C  )   (resid  58 and name N  )  1.0  -38.4  14.7 2 

assign (resid  57 and name C  )   (resid  58 and name N  ) 
       (resid  58 and name CA )   (resid  58 and name C  )  1.0  -63.4   9.8 2 
assign (resid  58 and name N  )   (resid  58 and name CA ) 
       (resid  58 and name C  )   (resid  59 and name N  )  1.0  -43.3  16.1 2 

assign (resid  58 and name C  )   (resid  59 and name N  ) 
       (resid  59 and name CA )   (resid  59 and name C  )  1.0  -65.4  20.5 2 
assign (resid  59 and name N  )   (resid  59 and name CA ) 
       (resid  59 and name C  )   (resid  60 and name N  )  1.0  -40.9  20.9 2 

assign (resid  59 and name C  )   (resid  60 and name N  ) 
       (resid  60 and name CA )   (resid  60 and name C  )  1.0  -67.7  14.4 2 
assign (resid  60 and name N  )   (resid  60 and name CA ) 
       (resid  60 and name C  )   (resid  61 and name N  )  1.0  -41.2  24.2 2 

assign (resid  60 and name C  )   (resid  61 and name N  ) 
       (resid  61 and name CA )   (resid  61 and name C  )  1.0  -66.6  29.0 2 
assign (resid  61 and name N  )   (resid  61 and name CA ) 
       (resid  61 and name C  )   (resid  62 and name N  )  1.0  -41.9  21.4 2 

assign (resid  61 and name C  )   (resid  62 and name N  ) 
       (resid  62 and name CA )   (resid  62 and name C  )  1.0  -63.9  19.3 2 
assign (resid  62 and name N  )   (resid  62 and name CA ) 
       (resid  62 and name CB )   (resid  62 and name CG )  1.0  180.0  15.0 2  
assign (resid  62 and name N  )   (resid  62 and name CA ) 
       (resid  62 and name C  )   (resid  63 and name N  )  1.0  -36.4  28.5 2 

assign (resid  62 and name C  )   (resid  63 and name N  ) 
       (resid  63 and name CA )   (resid  63 and name C  )  1.0  -65.3  21.0 2 
assign (resid  63 and name N  )   (resid  63 and name CA ) 
       (resid  63 and name C  )   (resid  64 and name N  )  1.0  -41.8  20.4 2 

assign (resid  63 and name C  )   (resid  64 and name N  ) 
       (resid  64 and name CA )   (resid  64 and name C  )  1.0  -67.1  10.3 2 
assign (resid  64 and name N  )   (resid  64 and name CA ) 
       (resid  64 and name C  )   (resid  65 and name N  )  1.0  -40.0  15.1 2 

assign (resid  64 and name C  )   (resid  65 and name N  ) 
       (resid  65 and name CA )   (resid  65 and name C  )  1.0  -58.8   9.8 2 
assign (resid  65 and name N  )   (resid  65 and name CA ) 
       (resid  65 and name C  )   (resid  66 and name N  )  1.0  -43.6  11.1 2 

assign (resid  65 and name C  )   (resid  66 and name N  ) 
       (resid  66 and name CA )   (resid  66 and name C  )  1.0  -63.9  13.6 2 
assign (resid  66 and name N  )   (resid  66 and name CA ) 
       (resid  66 and name C  )   (resid  67 and name N  )  1.0  -40.3  21.0 2 

assign (resid  66 and name C  )   (resid  67 and name N  ) 
       (resid  67 and name CA )   (resid  67 and name C  )  1.0  -61.8  19.8 2 
assign (resid  67 and name N  )   (resid  67 and name CA ) 
       (resid  67 and name C  )   (resid  68 and name N  )  1.0  -37.1  12.6 2 

assign (resid  67 and name C  )   (resid  68 and name N  ) 
       (resid  68 and name CA )   (resid  68 and name C  )  1.0  -66.6  23.4 2 

assign (resid  68 and name N  )   (resid  68 and name CA ) 
       (resid  68 and name C  )   (resid  69 and name N  )  1.0  -38.9  29.5 2 

assign (resid  68 and name C  )   (resid  69 and name N  ) 
       (resid  69 and name CA )   (resid  69 and name C  )  1.0  -63.7  22.2 2 

assign (resid  69 and name N  )   (resid  69 and name CA ) 
       (resid  69 and name C  )   (resid  70 and name N  )  1.0  -39.8  14.4 2 

assign (resid  69 and name C  )   (resid  70 and name N  ) 
       (resid  70 and name CA )   (resid  70 and name C  )  1.0  -65.8  26.4 2 
assign (resid  70 and name N  )   (resid  70 and name CA ) 
       (resid  70 and name C  )   (resid  71 and name N  )  1.0  -33.6  20.6 2 

assign (resid  70 and name C  )   (resid  71 and name N  ) 
       (resid  71 and name CA )   (resid  71 and name C  )  1.0  -91.0  64.2 2 
assign (resid  71 and name N  )   (resid  71 and name CA ) 
       (resid  71 and name C  )   (resid  72 and name N  )  1.0   -9.9  51.8 2 

assign (resid  73 and name C  )   (resid  74 and name N  ) 
       (resid  74 and name CA )   (resid  74 and name C  )  1.0 -120.0  48.0 2 
assign (resid  74 and name N  )   (resid  74 and name CA ) 
       (resid  74 and name C  )   (resid  75 and name N  )  1.0  130.4  90.0 2 

assign (resid  74 and name C  )   (resid  75 and name N  )
       (resid  75 and name CA )   (resid  75 and name C  )  1.0  -62.0  10.0 2
assign (resid  75 and name N  )   (resid  75 and name CA )
       (resid  75 and name C  )   (resid  76 and name N  )  1.0   65.0 100.0 2

assign (resid  75 and name C  )   (resid  76 and name N  ) 
       (resid  76 and name CA )   (resid  76 and name C  )  1.0  -67.2  27.1 2 
assign (resid  76 and name N  )   (resid  76 and name CA ) 
       (resid  76 and name C  )   (resid  77 and name N  )  1.0  -25.2  50.5 2 

assign (resid  76 and name N  )   (resid  76 and name CA ) 
       (resid  76 and name CB )   (resid  76 and name CG )  1.0  180.0  30.0 2 

assign (resid  76 and name C  )   (resid  77 and name N  ) 
       (resid  77 and name CA )   (resid  77 and name C  )  1.0  -90.2  50.0 2 
assign (resid  77 and name N  )   (resid  77 and name CA ) 
       (resid  77 and name C  )   (resid  78 and name N  )  1.0  -13.1  52.9 2 

assign (resid  77 and name C  )   (resid  78 and name N  ) 
       (resid  78 and name CA )   (resid  78 and name C  )  1.0  -81.2  41.5 2 

assign (resid  78 and name N  )   (resid  78 and name CA ) 
       (resid  78 and name C  )   (resid  79 and name N  )  1.0  131.9  34.0 2 

assign (resid  78 and name C  )   (resid  79 and name N  ) 
       (resid  79 and name CA )   (resid  79 and name C  )  1.0 -105.0  69.0 2 

assign (resid  79 and name N  )   (resid  79 and name CA )  
       (resid  79 and name CB )   (resid  79 and name CG )  1.0  180.0  15.0 2  

assign (resid  79 and name N  )   (resid  79 and name CA ) 
       (resid  79 and name C  )   (resid  80 and name N  )  1.0  125.0  39.0 2 

assign (resid  79 and name C  )   (resid  80 and name N  ) 
       (resid  80 and name CA )   (resid  80 and name C  )  1.0 -86.0  45.0 2 
assign (resid  80 and name N  )   (resid  80 and name CA ) 
       (resid  80 and name CB )   (resid  80 and name SG )  1.0 180.0  30.0 2 
assign (resid  80 and name N  )   (resid  80 and name CA ) 
       (resid  80 and name C  )   (resid  81 and name N  )  1.0 117.0  60.0 2 

assign (resid  80 and name C  )   (resid  81 and name N  ) 
       (resid  81 and name CA )   (resid  81 and name C  )  1.0 -104.0 72.0 2 
assign (resid  81 and name N  )   (resid  81 and name CA ) 
       (resid  81 and name CB )   (resid  81 and name CG )  1.0  60.0  30.0 2 
assign (resid  81 and name N  )   (resid  81 and name CA ) 
       (resid  81 and name C  )   (resid  82 and name N  )  1.0 153.0  102.0 2 

assign (resid  81 and name C  )   (resid  82 and name N  ) 
       (resid  82 and name CA )   (resid  82 and name C  )  1.0  -58.8  19.2 2 
assign (resid  82 and name N  )   (resid  82 and name CA ) 
       (resid  82 and name C  )   (resid  83 and name N  )  1.0  -35.3  19.4 2 

assign (resid  82 and name C  )   (resid  83 and name N  ) 
       (resid  83 and name CA )   (resid  83 and name C  )  1.0  -63.0  12.0 2 
assign (resid  83 and name N  )   (resid  83 and name CA ) 
       (resid  83 and name C  )   (resid  84 and name N  )  1.0  -39.3  17.6 2 

assign (resid  83 and name C  )   (resid  84 and name N  ) 
       (resid  84 and name CA )   (resid  84 and name C  )  1.0  -66.2  18.3 2 

assign (resid  84 and name N  )   (resid  84 and name CA ) 
       (resid  84 and name CB )   (resid  84 and name CG1)  1.0  180.5  15.0 2 

assign (resid  84 and name N  )   (resid  84 and name CA ) 
       (resid  84 and name C  )   (resid  85 and name N  )  1.0  -40.5  18.5 2 

assign (resid  84 and name C  )   (resid  85 and name N  ) 
       (resid  85 and name CA )   (resid  85 and name C  )  1.0  -63.9   8.4 2 

assign (resid  85 and name N  )   (resid  85 and name CA ) 
       (resid  85 and name C  )   (resid  86 and name N  )  1.0  -40.7  13.8 2 

assign (resid  85 and name C  )   (resid  86 and name N  ) 
       (resid  86 and name CA )   (resid  86 and name C  )  1.0  -62.4  14.6 2 
assign (resid  86 and name N  )   (resid  86 and name CA ) 
       (resid  86 and name C  )   (resid  87 and name N  )  1.0  -44.7  11.4 2 

assign (resid  86 and name C  )   (resid  87 and name N  ) 
       (resid  87 and name CA )   (resid  87 and name C  )  1.0  -66.2  14.4 2 
assign (resid  87 and name N  )   (resid  87 and name CA ) 
       (resid  87 and name C  )   (resid  88 and name N  )  1.0  -37.5  21.6 2 

assign (resid  87 and name C  )   (resid  88 and name N  ) 
       (resid  88 and name CA )   (resid  88 and name C  )  1.0  -71.8  24.4 2 
assign (resid  88 and name N  )   (resid  88 and name CA ) 
       (resid  88 and name C  )   (resid  89 and name N  )  1.0  -38.8  20.7 2 

assign (resid  88 and name C  )   (resid  89 and name N  ) 
       (resid  89 and name CA )   (resid  89 and name C  )  1.0  -63.5  17.5 2 
assign (resid  89 and name N  )   (resid  89 and name CA ) 
       (resid  89 and name C  )   (resid  90 and name N  )  1.0  -39.0  14.8 2 

assign (resid  89 and name C  )   (resid  90 and name N  ) 
       (resid  90 and name CA )   (resid  90 and name C  )  1.0  -67.6  18.5 2 
assign (resid  90 and name N  )   (resid  90 and name CA ) 
       (resid  90 and name C  )   (resid  91 and name N  )  1.0  -38.4  32.5 2 

assign (resid  90 and name C  )   (resid  91 and name N  ) 
       (resid  91 and name CA )   (resid  91 and name C  )  1.0  -68.8  24.2 2 
assign (resid  91 and name N  )   (resid  91 and name CA ) 
       (resid  91 and name C  )   (resid  92 and name N  )  1.0  -39.6  24.5 2 

assign (resid  91 and name C  )   (resid  92 and name N  ) 
       (resid  92 and name CA )   (resid  92 and name C  )  1.0  -64.0  12.9 2 
assign (resid  92 and name N  )   (resid  92 and name CA ) 
       (resid  92 and name C  )   (resid  93 and name N  )  1.0  -44.0  17.0 2 

assign (resid  92 and name C  )   (resid  93 and name N  ) 
       (resid  93 and name CA )   (resid  93 and name C  )  1.0  -58.4  16.0 2 
assign (resid  93 and name N  )   (resid  93 and name CA ) 
       (resid  93 and name C  )   (resid  94 and name N  )  1.0  -44.5  17.4 2 

assign (resid  93 and name C  )   (resid  94 and name N  ) 
       (resid  94 and name CA )   (resid  94 and name C  )  1.0  -65.9  12.0 2 
assign (resid  94 and name N  )   (resid  94 and name CA ) 
       (resid  94 and name C  )   (resid  95 and name N  )  1.0  -41.9  16.5 2 

assign (resid  94 and name C  )   (resid  95 and name N  ) 
       (resid  95 and name CA )   (resid  95 and name C  )  1.0  -63.8  29.8 2 
assign (resid  95 and name N  )   (resid  95 and name CA ) 
       (resid  95 and name C  )   (resid  96 and name N  )  1.0  -40.8  26.6 2 

assign (resid  95 and name C  )   (resid  96 and name N  ) 
       (resid  96 and name CA )   (resid  96 and name C  )  1.0  -61.8  17.7 2 
assign (resid  96 and name N  )   (resid  96 and name CA ) 
       (resid  96 and name C  )   (resid  97 and name N  )  1.0  -29.1  41.5 2 

assign (resid  96 and name C  )   (resid  97 and name N  ) 
       (resid  97 and name CA )   (resid  97 and name C  )  1.0  -70.3  47.6 2 
assign (resid  97 and name N  )   (resid  97 and name CA ) 
       (resid  97 and name C  )   (resid  98 and name N  )  1.0  -30.2  35.3 2 

assign (resid  98 and name C  )   (resid  99 and name N  ) 
       (resid  99 and name CA )   (resid  99 and name C  )  1.0  -81.6  54.1 2 
assign (resid  99 and name N  )   (resid  99 and name CA ) 
       (resid  99 and name C  )   (resid 100 and name N  )  1.0  -27.1  61.9 2 

assign (resid 100 and name C  )   (resid 101 and name N  ) 
       (resid 101 and name CA )   (resid 101 and name C  )  1.0  -78.6  42.1 2 
assign (resid 101 and name N  )   (resid 101 and name CA ) 
       (resid 101 and name C  )   (resid 102 and name N  )  1.0  -38.3  39.3 2 

assign (resid 101 and name C  )   (resid 102 and name N  ) 
       (resid 102 and name CA )   (resid 102 and name C  )  1.0 -126.6  48.1 2 
assign (resid 102 and name N  )   (resid 102 and name CA ) 
       (resid 102 and name C  )   (resid 103 and name N  )  1.0  154.3  40.3 2 

assign (resid 103 and name C  )   (resid 104 and name N  ) 
       (resid 104 and name CA )   (resid 104 and name C  )  1.0  -95.6  67.1 2 
assign (resid 104 and name N  )   (resid 104 and name CA ) 
       (resid 104 and name C  )   (resid 105 and name N  )  1.0  132.3  72.3 2 

assign (resid 105 and name C  )   (resid 106 and name N  ) 
       (resid 106 and name CA )   (resid 106 and name C  )  1.0  -75.3  43.3 2 
assign (resid 106 and name N  )   (resid 106 and name CA ) 
       (resid 106 and name C  )   (resid 107 and name N  )  1.0  -22.0  77.2 2 

assign (resid 107 and name C  )   (resid 108 and name N  ) 
       (resid 108 and name CA )   (resid 108 and name C  )  1.0 -100.0  60.0 2  
assign (resid 108 and name N  )   (resid 108 and name CA ) 
       (resid 108 and name C  )   (resid 109 and name N  )  1.0  70.0  120.0 2  

assign (resid 108 and name C  )   (resid 109 and name N  )
       (resid 109 and name CA )   (resid 109 and name C  )  1.0  -66.0  30.0 2  
assign (resid 109 and name N  )   (resid 109 and name CA )  
       (resid 109 and name C  )   (resid 110 and name N  )  1.0  -37.0  50.0 2  

! Residual Dipolar Couplings (HN)

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  13  and name N   ) 
       ( resid  13  and name HN  ) 21.20 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  15  and name N   ) 
       ( resid  15  and name HN  ) 14.40 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  19  and name N   ) 
       ( resid  19  and name HN  ) 15.70 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  21  and name N   ) 
       ( resid  21  and name HN  ) 16.90 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  22  and name N   ) 
       ( resid  22  and name HN  ) 13.20 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  23  and name N   ) 
       ( resid  23  and name HN  ) 19.70 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  25  and name N   ) 
       ( resid  25  and name HN  ) 13.80 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  26  and name N   ) 
       ( resid  26  and name HN  ) 16.10 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  27  and name N   ) 
       ( resid  27  and name HN  ) 22.00 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  28  and name N   ) 
       ( resid  28  and name HN  ) 25.00 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  29  and name N   ) 
       ( resid  29  and name HN  ) 20.10 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  30  and name N   ) 
       ( resid  30  and name HN  ) 17.50 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  31  and name N   ) 
       ( resid  31  and name HN  ) 17.50 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  32  and name N   ) 
       ( resid  32  and name HN  ) 24.90 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  33  and name N   ) 
       ( resid  33  and name HN  ) 18.60 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  34  and name N   ) 
       ( resid  34  and name HN  ) 14.50 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  37  and name N   ) 
       ( resid  37  and name HN  ) 22.10 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  38  and name N   ) 
       ( resid  38  and name HN  ) 23.10 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  39  and name N   ) 
       ( resid  39  and name HN  ) -18.80 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  41  and name N   ) 
       ( resid  41  and name HN  ) 16.90 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  42  and name N   ) 
       ( resid  42  and name HN  ) -29.00 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  45  and name N   ) 
       ( resid  45  and name HN  ) 16.80 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  46  and name N   ) 
       ( resid  46  and name HN  ) 16.60 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  47  and name N   ) 
       ( resid  47  and name HN  ) 13.20 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  49  and name N   ) 
       ( resid  49  and name HN  ) -15.70 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  51  and name N   ) 
       ( resid  51  and name HN  ) 2.80 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  52  and name N   ) 
       ( resid  52  and name HN  ) 12.70 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  53  and name N   ) 
       ( resid  53  and name HN  ) -14.50 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  54  and name N   ) 
       ( resid  54  and name HN  ) -4.30 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  55  and name N   ) 
       ( resid  55  and name HN  ) 15.20 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  56  and name N   ) 
       ( resid  56  and name HN  ) 1.60 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  57  and name N   ) 
       ( resid  57  and name HN  ) -12.80 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  58  and name N   ) 
       ( resid  58  and name HN  ) 4.20 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  60  and name N   ) 
       ( resid  60  and name HN  ) -7.30 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  61  and name N   ) 
       ( resid  61  and name HN  ) -12.00 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  62  and name N   ) 
       ( resid  62  and name HN  ) 6.90 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  63  and name N   ) 
       ( resid  63  and name HN  ) 4.50 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  64  and name N   ) 
       ( resid  64  and name HN  ) -20.80 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  65  and name N   ) 
       ( resid  65  and name HN  ) 3.10 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  66  and name N   ) 
       ( resid  66  and name HN  ) 8.40 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  67  and name N   ) 
       ( resid  67  and name HN  ) -3.70 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  69  and name N   ) 
       ( resid  69  and name HN  ) -10.60 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  70  and name N   ) 
       ( resid  70  and name HN  ) 17.00 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  80  and name N   ) 
       ( resid  80  and name HN  ) -13.90 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  82  and name N   ) 
       ( resid  82  and name HN  ) 21.20 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  85  and name N   ) 
       ( resid  85  and name HN  ) 22.90 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  86  and name N   ) 
       ( resid  86  and name HN  ) 26.50 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  87  and name N   ) 
       ( resid  87  and name HN  ) 27.70 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  88  and name N   ) 
       ( resid  88  and name HN  ) 23.00 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  89  and name N   ) 
       ( resid  89  and name HN  ) 21.90 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  90  and name N   ) 
       ( resid  90  and name HN  ) 24.30 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  91  and name N   ) 
       ( resid  91  and name HN  ) 10.80 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  94  and name N   ) 
       ( resid  94  and name HN  ) 27.30 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  95  and name N   ) 
       ( resid  95  and name HN  ) 21.80 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  96  and name N   ) 
       ( resid  96  and name HN  ) 22.80 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  97  and name N   ) 
       ( resid  97  and name HN  ) 22.00 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  98  and name N   ) 
       ( resid  98  and name HN  ) 18.70 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  99  and name N   ) 
       ( resid  99  and name HN  ) 18.50 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid 101  and name N   ) 
       ( resid 101  and name HN  ) 16.10 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid 104  and name N   ) 
       ( resid 104  and name HN  ) -29.60 2.0 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid 106  and name N   ) 
       ( resid 106  and name HN  ) -17.50 2.0 

! HaCa RDCs are scaled.

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  13  and name CA  ) 
       ( resid  13  and name HA  ) 10.20 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  14  and name CA  ) 
       ( resid  14  and name HA  ) -13.80 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  16  and name CA  ) 
       ( resid  16  and name HA  ) 14.00 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  17  and name CA  ) 
       ( resid  17  and name HA  ) -14.40 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  18  and name CA  ) 
       ( resid  18  and name HA  ) -0.50 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  19  and name CA  ) 
       ( resid  19  and name HA  ) -13.40 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  20  and name CA  ) 
       ( resid  20  and name HA  ) 23.00 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  21  and name CA  ) 
       ( resid  21  and name HA  ) -19.40 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  22  and name CA  ) 
       ( resid  22  and name HA  ) 4.30 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  24  and name CA  ) 
       ( resid  24  and name HA  ) 7.60 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  25  and name CA  ) 
       ( resid  25  and name HA  ) -12.90 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  26  and name CA  ) 
       ( resid  26  and name HA  ) -2.70 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  28  and name CA  ) 
       ( resid  28  and name HA  ) -3.60 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  29  and name CA  ) 
       ( resid  29  and name HA  ) 5.90 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  30  and name CA  ) 
       ( resid  30  and name HA  ) -20.10 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  32  and name CA  ) 
       ( resid  32  and name HA  ) -23.60 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  33  and name CA  ) 
       ( resid  33  and name HA  ) 2.20 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  50  and name CA  ) 
       ( resid  50  and name HA  ) -2.90 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  51  and name CA  ) 
       ( resid  51  and name HA  ) 21.00 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  52  and name CA  ) 
       ( resid  52  and name HA  ) 3.10 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  53  and name CA  ) 
       ( resid  53  and name HA  ) -33.10 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  54  and name CA  ) 
       ( resid  54  and name HA  ) 22.10 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  55  and name CA  ) 
       ( resid  55  and name HA  ) 16.50 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  56  and name CA  ) 
       ( resid  56  and name HA  ) -11.30 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  57  and name CA  ) 
       ( resid  57  and name HA  ) -24.80 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  59  and name CA  ) 
       ( resid  59  and name HA  ) 11.50 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  60  and name CA  ) 
       ( resid  60  and name HA  ) -11.90 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  61  and name CA  ) 
       ( resid  61  and name HA  ) 2.50 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  62  and name CA  ) 
       ( resid  62  and name HA  ) 25.70 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  64  and name CA  ) 
       ( resid  64  and name HA  ) -30.90 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  65  and name CA  ) 
       ( resid  65  and name HA  ) 14.60 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  66  and name CA  ) 
       ( resid  66  and name HA  ) 20.30 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  68  and name CA  ) 
       ( resid  68  and name HA  ) -34.00 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  69  and name CA  ) 
       ( resid  69  and name HA  ) 22.30 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  70  and name CA  ) 
       ( resid  70  and name HA  ) 11.10 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  71  and name CA  ) 
       ( resid  71  and name HA  ) -19.20 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  75  and name CA  ) 
       ( resid  75  and name HA  ) 19.40 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  76  and name CA  ) 
       ( resid  76  and name HA  ) -28.80 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  77  and name CA  ) 
       ( resid  77  and name HA  ) 9.20 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  79  and name CA  ) 
       ( resid  79  and name HA  ) -31.50 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  81  and name CA  ) 
       ( resid  81  and name HA  ) -19.80 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  82  and name CA  ) 
       ( resid  82  and name HA  ) -7.70 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  84  and name CA  ) 
       ( resid  84  and name HA  ) -11.70 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  86  and name CA  ) 
       ( resid  86  and name HA  ) 8.50 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  87  and name CA  ) 
       ( resid  87  and name HA  ) -9.20 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  88  and name CA  ) 
       ( resid  88  and name HA  ) 12.80 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  89  and name CA  ) 
       ( resid  89  and name HA  ) -17.30 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  91  and name CA  ) 
       ( resid  91  and name HA  ) -23.70 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  93  and name CA  ) 
       ( resid  93  and name HA  ) -14.00 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  94  and name CA  ) 
       ( resid  94  and name HA  ) 13.30 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  95  and name CA  ) 
       ( resid  95  and name HA  ) -5.90 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  96  and name CA  ) 
       ( resid  96  and name HA  ) -1.40 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  98  and name CA  ) 
       ( resid  98  and name HA  ) -18.70 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid  99  and name CA  ) 
       ( resid  99  and name HA  ) 10.30 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid 101  and name CA  ) 
       ( resid 101  and name HA  ) 8.30 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid 102  and name CA  ) 
       ( resid 102  and name HA  ) 11.00 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid 103  and name CA  ) 
       ( resid 103  and name HA  ) -33.10 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid 105  and name CA  ) 
       ( resid 105  and name HA  ) -13.10 3.5 

assign ( resid 500  and name OO  ) 
       ( resid 500  and name Z   ) 
       ( resid 500  and name X   ) 
       ( resid 500  and name Y   ) 
       ( resid 106  and name CA  ) 
       ( resid 106  and name HA  ) 14.60 3.5 



  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    THR  10           H        THR  10  -3.757 -23.690   3.942
    2    HA   THR  10           HA       THR  10  -2.293 -22.841   5.416
    3    HB   THR  10           HB       THR  10   0.024 -22.361   4.494
    4    HG1  THR  10           1HG      THR  10  -1.338 -22.140   2.180
    5   1HG2  THR  10          1HG2      THR  10  -0.648 -24.603   5.167
    6   2HG2  THR  10          2HG2      THR  10   0.425 -24.670   3.766
    7   3HG2  THR  10          3HG2      THR  10  -1.312 -24.901   3.560
    8    H    SER  11           H        SER  11  -4.136 -20.780   4.204
    9    HA   SER  11           HA       SER  11  -2.418 -18.462   3.784
   10   1HB   SER  11          1HB       SER  11  -5.283 -18.883   3.540
   11   2HB   SER  11          2HB       SER  11  -4.400 -17.419   3.044
   12    HG   SER  11           HG       SER  11  -3.510 -19.878   2.006
   13    H    SER  12           H        SER  12  -3.917 -19.721   6.421
   14    HA   SER  12           HA       SER  12  -4.635 -17.178   7.391
   15   1HB   SER  12          1HB       SER  12  -4.819 -18.384   9.547
   16   2HB   SER  12          2HB       SER  12  -5.638 -19.134   8.152
   17    HG   SER  12           HG       SER  12  -4.465 -20.836   8.345
   18    H    GLU  13           H        GLU  13  -1.776 -19.361   7.881
   19    HA   GLU  13           HA       GLU  13  -0.362 -17.336   9.195
   20   1HB   GLU  13          1HB       GLU  13   1.434 -19.032   9.185
   21   2HB   GLU  13          2HB       GLU  13  -0.072 -19.573   9.900
   22   1HG   GLU  13          1HG       GLU  13  -0.628 -20.762   7.849
   23   2HG   GLU  13          2HG       GLU  13   0.853 -20.208   7.114
   24    H    LEU  14           H        LEU  14  -0.467 -18.659   5.933
   25    HA   LEU  14           HA       LEU  14   1.890 -17.660   4.806
   26   1HB   LEU  14          1HB       LEU  14  -0.056 -19.098   3.790
   27   2HB   LEU  14          2HB       LEU  14  -0.789 -17.553   3.478
   28    HG   LEU  14           HG       LEU  14   1.859 -18.344   2.264
   29   1HD1  LEU  14          1HD1      LEU  14   0.128 -19.902   1.556
   30   2HD1  LEU  14          2HD1      LEU  14   0.594 -18.838   0.231
   31   3HD1  LEU  14          3HD1      LEU  14  -0.913 -18.552   1.103
   32   1HD2  LEU  14          1HD2      LEU  14   1.370 -15.921   2.326
   33   2HD2  LEU  14          2HD2      LEU  14  -0.147 -16.221   1.469
   34   3HD2  LEU  14          3HD2      LEU  14   1.398 -16.558   0.684
   35    H    ALA  15           H        ALA  15  -1.070 -16.313   5.564
   36    HA   ALA  15           HA       ALA  15  -0.574 -13.830   4.229
   37   1HB   ALA  15          1HB       ALA  15  -2.862 -14.601   5.942
   38   2HB   ALA  15          2HB       ALA  15  -2.767 -14.604   4.162
   39   3HB   ALA  15          3HB       ALA  15  -2.678 -13.086   5.064
   40    H    LYS  16           H        LYS  16  -0.269 -15.079   7.448
   41    HA   LYS  16           HA       LYS  16  -0.177 -12.658   8.838
   42   1HB   LYS  16          1HB       LYS  16   1.351 -15.231   9.300
   43   2HB   LYS  16          2HB       LYS  16   1.430 -13.875  10.407
   44   1HG   LYS  16          1HG       LYS  16  -1.074 -15.383   9.687
   45   2HG   LYS  16          2HG       LYS  16  -0.116 -15.637  11.149
   46   1HD   LYS  16          1HD       LYS  16  -0.546 -13.315  11.819
   47   2HD   LYS  16          2HD       LYS  16  -1.509 -13.069  10.365
   48   1HE   LYS  16          1HE       LYS  16  -2.958 -13.490  12.253
   49   2HE   LYS  16          2HE       LYS  16  -3.055 -14.829  11.115
   50   1HZ   LYS  16          1HZ       LYS  16  -1.432 -14.805  13.595
   51   2HZ   LYS  16          2HZ       LYS  16  -1.625 -16.138  12.559
   52   3HZ   LYS  16          3HZ       LYS  16  -2.933 -15.526  13.434
   53    H    LYS  17           H        LYS  17   2.158 -14.460   7.072
   54    HA   LYS  17           HA       LYS  17   4.185 -12.466   7.389
   55   1HB   LYS  17          1HB       LYS  17   4.142 -14.863   5.565
   56   2HB   LYS  17          2HB       LYS  17   5.559 -13.938   6.054
   57   1HG   LYS  17          1HG       LYS  17   3.810 -15.632   7.837
   58   2HG   LYS  17          2HG       LYS  17   5.451 -16.013   7.332
   59   1HD   LYS  17          1HD       LYS  17   4.648 -13.621   8.995
   60   2HD   LYS  17          2HD       LYS  17   5.279 -15.114   9.657
   61   1HE   LYS  17          1HE       LYS  17   7.393 -14.813   8.481
   62   2HE   LYS  17          2HE       LYS  17   6.772 -13.372   7.683
   63   1HZ   LYS  17          1HZ       LYS  17   7.033 -13.596  10.629
   64   2HZ   LYS  17          2HZ       LYS  17   6.731 -12.211   9.713
   65   3HZ   LYS  17          3HZ       LYS  17   8.232 -12.950   9.640
   66    H    SER  18           H        SER  18   1.771 -13.320   4.944
   67    HA   SER  18           HA       SER  18   3.045 -11.811   2.950
   68   1HB   SER  18          1HB       SER  18   1.349 -13.704   2.556
   69   2HB   SER  18          2HB       SER  18   0.105 -12.524   2.956
   70    HG   SER  18           HG       SER  18   0.453 -11.470   1.080
   71    H    LYS  19           H        LYS  19   0.655 -10.953   5.421
   72    HA   LYS  19           HA       LYS  19  -0.035  -8.457   4.182
   73   1HB   LYS  19          1HB       LYS  19  -0.289  -9.035   7.143
   74   2HB   LYS  19          2HB       LYS  19  -1.142  -7.816   6.220
   75   1HG   LYS  19          1HG       LYS  19  -2.145  -9.882   4.946
   76   2HG   LYS  19          2HG       LYS  19  -1.613 -10.758   6.363
   77   1HD   LYS  19          1HD       LYS  19  -3.519  -8.421   6.333
   78   2HD   LYS  19          2HD       LYS  19  -3.946 -10.109   6.567
   79   1HE   LYS  19          1HE       LYS  19  -2.218  -8.441   8.365
   80   2HE   LYS  19          2HE       LYS  19  -3.908  -8.855   8.647
   81   1HZ   LYS  19          1HZ       LYS  19  -2.474 -10.283   9.910
   82   2HZ   LYS  19          2HZ       LYS  19  -1.624 -10.775   8.558
   83   3HZ   LYS  19          3HZ       LYS  19  -3.248 -11.221   8.760
   84    H    GLU  20           H        GLU  20   2.301  -9.389   6.640
   85    HA   GLU  20           HA       GLU  20   3.103  -6.704   7.013
   86   1HB   GLU  20          1HB       GLU  20   5.126  -7.703   8.168
   87   2HB   GLU  20          2HB       GLU  20   3.559  -8.128   8.834
   88   1HG   GLU  20          1HG       GLU  20   3.682 -10.282   7.666
   89   2HG   GLU  20          2HG       GLU  20   5.289  -9.850   7.086
   90    H    VAL  21           H        VAL  21   4.348  -9.299   4.940
   91    HA   VAL  21           HA       VAL  21   6.456  -7.719   3.862
   92    HB   VAL  21           HB       VAL  21   4.970 -10.084   2.638
   93   1HG1  VAL  21          1HG1      VAL  21   6.084  -8.728   0.913
   94   2HG1  VAL  21          2HG1      VAL  21   6.913 -10.273   1.123
   95   3HG1  VAL  21          3HG1      VAL  21   7.588  -8.807   1.827
   96   1HG2  VAL  21          1HG2      VAL  21   6.949 -11.391   3.281
   97   2HG2  VAL  21          2HG2      VAL  21   6.141 -10.688   4.684
   98   3HG2  VAL  21          3HG2      VAL  21   7.621  -9.960   4.060
   99    H    PHE  22           H        PHE  22   3.102  -8.228   2.839
  100    HA   PHE  22           HA       PHE  22   3.197  -6.693   0.491
  101   1HB   PHE  22          1HB       PHE  22   1.288  -7.987   0.691
  102   2HB   PHE  22          2HB       PHE  22   1.069  -7.572   2.384
  103    HD1  PHE  22           1HD      PHE  22   1.214  -5.720  -0.850
  104    HD2  PHE  22           2HD      PHE  22  -0.841  -6.377   2.788
  105    HE1  PHE  22           1HE      PHE  22  -0.453  -3.999  -1.472
  106    HE2  PHE  22           2HE      PHE  22  -2.488  -4.699   2.178
  107    HZ   PHE  22           HZ       PHE  22  -2.335  -3.509   0.091
  108    H    ARG  23           H        ARG  23   2.182  -5.856   3.695
  109    HA   ARG  23           HA       ARG  23   1.729  -3.154   3.037
  110   1HB   ARG  23          1HB       ARG  23   1.405  -2.667   5.350
  111   2HB   ARG  23          2HB       ARG  23   0.804  -4.287   5.070
  112   1HG   ARG  23          1HG       ARG  23   1.926  -4.711   6.999
  113   2HG   ARG  23          2HG       ARG  23   3.246  -4.891   5.872
  114   1HD   ARG  23          1HD       ARG  23   4.044  -2.673   6.198
  115   2HD   ARG  23          2HD       ARG  23   2.650  -2.254   7.185
  116    HE   ARG  23           HE       ARG  23   3.585  -4.100   8.689
  117   1HH1  ARG  23          1HH1      ARG  23   5.638  -1.952   6.739
  118   2HH1  ARG  23          2HH1      ARG  23   6.852  -1.804   7.910
  119   1HH2  ARG  23          1HH2      ARG  23   5.241  -3.829  10.351
  120   2HH2  ARG  23          2HH2      ARG  23   6.611  -2.879  10.033
  121    H    LYS  24           H        LYS  24   4.673  -4.781   3.920
  122    HA   LYS  24           HA       LYS  24   6.221  -2.437   4.396
  123   1HB   LYS  24          1HB       LYS  24   6.828  -4.676   5.174
  124   2HB   LYS  24          2HB       LYS  24   7.061  -5.170   3.506
  125   1HG   LYS  24          1HG       LYS  24   8.863  -3.543   3.266
  126   2HG   LYS  24          2HG       LYS  24   8.628  -3.039   4.939
  127   1HD   LYS  24          1HD       LYS  24  10.483  -4.587   4.785
  128   2HD   LYS  24          2HD       LYS  24   9.133  -5.288   5.685
  129   1HE   LYS  24          1HE       LYS  24   8.462  -6.602   3.779
  130   2HE   LYS  24          2HE       LYS  24   9.663  -5.808   2.762
  131   1HZ   LYS  24          1HZ       LYS  24  11.391  -6.838   4.079
  132   2HZ   LYS  24          2HZ       LYS  24  10.352  -7.974   3.427
  133   3HZ   LYS  24          3HZ       LYS  24  10.238  -7.601   5.070
  134    H    GLU  25           H        GLU  25   5.743  -4.598   1.555
  135    HA   GLU  25           HA       GLU  25   7.565  -3.475  -0.246
  136   1HB   GLU  25          1HB       GLU  25   4.826  -4.438  -0.901
  137   2HB   GLU  25          2HB       GLU  25   6.233  -4.443  -1.936
  138   1HG   GLU  25          1HG       GLU  25   6.191  -5.995   0.551
  139   2HG   GLU  25          2HG       GLU  25   5.270  -6.482  -0.871
  140    H    MET  26           H        MET  26   4.194  -3.126   0.293
  141    HA   MET  26           HA       MET  26   3.707  -1.124  -1.609
  142   1HB   MET  26          1HB       MET  26   2.053  -2.671  -0.818
  143   2HB   MET  26          2HB       MET  26   2.117  -1.895   0.760
  144   1HG   MET  26          1HG       MET  26   0.183  -1.215  -0.809
  145   2HG   MET  26          2HG       MET  26   1.070   0.045   0.041
  146   1HE   MET  26          1HE       MET  26   0.056  -1.353  -3.504
  147   2HE   MET  26          2HE       MET  26   1.721  -1.993  -3.504
  148   3HE   MET  26          3HE       MET  26   1.269  -0.598  -4.516
  149    H    SER  27           H        SER  27   4.326  -0.895   1.818
  150    HA   SER  27           HA       SER  27   3.933   1.885   1.937
  151   1HB   SER  27          1HB       SER  27   5.686   0.166   3.713
  152   2HB   SER  27          2HB       SER  27   5.530   1.909   3.943
  153    HG   SER  27           HG       SER  27   3.132   0.925   3.649
  154    H    GLN  28           H        GLN  28   6.698  -0.068   0.963
  155    HA   GLN  28           HA       GLN  28   8.422   2.171   0.637
  156   1HB   GLN  28          1HB       GLN  28   8.490  -0.626  -0.489
  157   2HB   GLN  28          2HB       GLN  28   9.770   0.554  -0.738
  158   1HG   GLN  28          1HG       GLN  28   8.830  -0.360   1.955
  159   2HG   GLN  28          2HG       GLN  28  10.187  -1.080   1.094
  160   1HE2  GLN  28          1HE2      GLN  28  12.059   0.127   0.842
  161   2HE2  GLN  28          2HE2      GLN  28  12.394   1.527   1.775
  162    H    PHE  29           H        PHE  29   6.393   0.357  -1.545
  163    HA   PHE  29           HA       PHE  29   6.926   1.747  -3.891
  164   1HB   PHE  29          1HB       PHE  29   5.714  -0.368  -3.860
  165   2HB   PHE  29          2HB       PHE  29   4.397   0.379  -2.972
  166    HD1  PHE  29           1HD      PHE  29   6.103   0.242  -6.235
  167    HD2  PHE  29           2HD      PHE  29   2.688   1.550  -4.073
  168    HE1  PHE  29           1HE      PHE  29   4.938   0.727  -8.345
  169    HE2  PHE  29           2HE      PHE  29   1.538   2.042  -6.177
  170    HZ   PHE  29           HZ       PHE  29   2.623   1.636  -8.281
  171    H    ILE  30           H        ILE  30   4.387   2.276  -1.502
  172    HA   ILE  30           HA       ILE  30   3.297   4.571  -2.646
  173    HB   ILE  30           HB       ILE  30   3.261   3.615   0.229
  174   1HG1  ILE  30          1HG1      ILE  30   1.078   3.700  -1.859
  175   2HG1  ILE  30          2HG1      ILE  30   2.083   2.298  -1.551
  176   1HG2  ILE  30          1HG2      ILE  30   1.509   5.289   0.650
  177   2HG2  ILE  30          2HG2      ILE  30   1.735   5.915  -0.989
  178   3HG2  ILE  30          3HG2      ILE  30   3.034   6.059   0.181
  179   1HD1  ILE  30          1HD1      ILE  30   0.189   3.561   0.440
  180   2HD1  ILE  30          2HD1      ILE  30   1.193   2.159   0.729
  181   3HD1  ILE  30          3HD1      ILE  30  -0.078   2.077  -0.449
  182    H    VAL  31           H        VAL  31   5.785   4.211  -0.107
  183    HA   VAL  31           HA       VAL  31   6.394   6.864   0.249
  184    HB   VAL  31           HB       VAL  31   8.136   4.399   0.252
  185   1HG1  VAL  31          1HG1      VAL  31  10.056   5.652   1.074
  186   2HG1  VAL  31          2HG1      VAL  31   9.164   7.154   0.984
  187   3HG1  VAL  31          3HG1      VAL  31   9.602   6.306  -0.505
  188   1HG2  VAL  31          1HG2      VAL  31   7.364   6.365   2.405
  189   2HG2  VAL  31          2HG2      VAL  31   8.260   4.862   2.658
  190   3HG2  VAL  31          3HG2      VAL  31   6.582   4.824   2.098
  191    H    GLN  32           H        GLN  32   7.636   4.755  -2.329
  192    HA   GLN  32           HA       GLN  32   9.255   6.485  -3.624
  193   1HB   GLN  32          1HB       GLN  32   9.014   4.066  -3.978
  194   2HB   GLN  32          2HB       GLN  32   7.496   4.341  -4.790
  195   1HG   GLN  32          1HG       GLN  32   8.685   5.614  -6.514
  196   2HG   GLN  32          2HG       GLN  32  10.206   5.202  -5.707
  197   1HE2  GLN  32          1HE2      GLN  32   7.541   3.984  -7.575
  198   2HE2  GLN  32          2HE2      GLN  32   8.235   2.468  -7.958
  199    H    CYS  33           H        CYS  33   5.832   5.788  -4.054
  200    HA   CYS  33           HA       CYS  33   5.223   7.468  -6.215
  201   1HB   CYS  33          1HB       CYS  33   3.574   6.309  -4.023
  202   2HB   CYS  33          2HB       CYS  33   2.869   7.130  -5.428
  203    HG   CYS  33           HG       CYS  33   4.541   4.186  -5.237
  204    H    LEU  34           H        LEU  34   5.122   7.983  -2.767
  205    HA   LEU  34           HA       LEU  34   3.955  10.595  -2.944
  206   1HB   LEU  34          1HB       LEU  34   5.297   9.246  -0.634
  207   2HB   LEU  34          2HB       LEU  34   4.468  10.779  -0.542
  208    HG   LEU  34           HG       LEU  34   3.235   8.120  -1.172
  209   1HD1  LEU  34          1HD1      LEU  34   3.012   9.944   1.222
  210   2HD1  LEU  34          2HD1      LEU  34   3.910   8.431   1.159
  211   3HD1  LEU  34          3HD1      LEU  34   2.152   8.418   1.006
  212   1HD2  LEU  34          1HD2      LEU  34   2.075   9.871  -2.370
  213   2HD2  LEU  34          2HD2      LEU  34   1.979  10.841  -0.902
  214   3HD2  LEU  34          3HD2      LEU  34   1.095   9.319  -1.011
  215    H    ASN  35           H        ASN  35   7.235   9.404  -2.846
  216    HA   ASN  35           HA       ASN  35   8.718  11.383  -2.109
  217   1HB   ASN  35          1HB       ASN  35   9.123   9.417  -4.132
  218   2HB   ASN  35          2HB       ASN  35  10.122  10.870  -4.399
  219   1HD2  ASN  35          1HD2      ASN  35   9.018   8.636  -2.021
  220   2HD2  ASN  35          2HD2      ASN  35  10.320   8.887  -0.960
  221    HA   PRO  36           HA       PRO  36   8.348  14.257  -6.007
  222   1HB   PRO  36          1HB       PRO  36   6.067  14.039  -7.499
  223   2HB   PRO  36          2HB       PRO  36   7.556  13.184  -7.904
  224   1HG   PRO  36          1HG       PRO  36   5.145  12.164  -6.459
  225   2HG   PRO  36          2HG       PRO  36   6.107  11.383  -7.726
  226   1HD   PRO  36          1HD       PRO  36   6.364  10.794  -5.128
  227   2HD   PRO  36          2HD       PRO  36   7.747  10.726  -6.220
  228    H    TYR  37           H        TYR  37   5.783  13.335  -3.914
  229    HA   TYR  37           HA       TYR  37   4.340  15.815  -4.188
  230   1HB   TYR  37          1HB       TYR  37   3.933  13.470  -2.327
  231   2HB   TYR  37          2HB       TYR  37   2.904  14.895  -2.361
  232    HD1  TYR  37           1HD      TYR  37   4.026  11.991  -4.315
  233    HD2  TYR  37           2HD      TYR  37   1.169  15.100  -3.981
  234    HE1  TYR  37           1HE      TYR  37   2.717  10.923  -6.028
  235    HE2  TYR  37           2HE      TYR  37  -0.173  14.113  -5.708
  236    HH   TYR  37           HH       TYR  37   0.147  12.555  -7.632
  237    H    ARG  38           H        ARG  38   6.779  14.493  -2.176
  238    HA   ARG  38           HA       ARG  38   6.338  16.471  -0.075
  239   1HB   ARG  38          1HB       ARG  38   8.244  15.475   1.056
  240   2HB   ARG  38          2HB       ARG  38   7.113  14.233   0.533
  241   1HG   ARG  38          1HG       ARG  38   8.510  13.693  -1.333
  242   2HG   ARG  38          2HG       ARG  38   9.615  15.001  -0.931
  243   1HD   ARG  38          1HD       ARG  38  10.011  13.901   1.272
  244   2HD   ARG  38          2HD       ARG  38   8.960  12.591   0.727
  245    HE   ARG  38           HE       ARG  38  10.619  12.152  -1.034
  246   1HH1  ARG  38          1HH1      ARG  38  11.721  14.053   1.749
  247   2HH1  ARG  38          2HH1      ARG  38  13.286  13.401   1.737
  248   1HH2  ARG  38          1HH2      ARG  38  12.784  11.301  -1.062
  249   2HH2  ARG  38          2HH2      ARG  38  13.905  11.836   0.116
  250    H    LYS  39           H        LYS  39   7.605  16.647  -2.969
  251    HA   LYS  39           HA       LYS  39   9.994  18.183  -2.488
  252   1HB   LYS  39          1HB       LYS  39   8.349  17.949  -5.021
  253   2HB   LYS  39          2HB       LYS  39   9.995  18.550  -4.897
  254   1HG   LYS  39          1HG       LYS  39   9.088  15.735  -4.367
  255   2HG   LYS  39          2HG       LYS  39   9.961  16.309  -5.787
  256   1HD   LYS  39          1HD       LYS  39  11.875  16.889  -4.398
  257   2HD   LYS  39          2HD       LYS  39  10.983  16.392  -2.955
  258   1HE   LYS  39          1HE       LYS  39  10.829  14.135  -3.805
  259   2HE   LYS  39          2HE       LYS  39  11.710  14.597  -5.261
  260   1HZ   LYS  39          1HZ       LYS  39  12.806  14.605  -2.479
  261   2HZ   LYS  39          2HZ       LYS  39  13.601  15.178  -3.823
  262   3HZ   LYS  39          3HZ       LYS  39  13.230  13.557  -3.733
  263    HA   PRO  40           HA       PRO  40   8.010  22.016  -1.557
  264   1HB   PRO  40          1HB       PRO  40   9.866  23.777  -2.535
  265   2HB   PRO  40          2HB       PRO  40  10.025  22.908  -1.005
  266   1HG   PRO  40          1HG       PRO  40  11.203  22.261  -3.677
  267   2HG   PRO  40          2HG       PRO  40  11.963  22.210  -2.076
  268   1HD   PRO  40          1HD       PRO  40  11.099  19.971  -3.276
  269   2HD   PRO  40          2HD       PRO  40  10.945  20.193  -1.520
  270    H    ASP  41           H        ASP  41   8.661  21.144  -4.806
  271    HA   ASP  41           HA       ASP  41   7.092  23.434  -5.765
  272   1HB   ASP  41          1HB       ASP  41   9.339  23.299  -6.738
  273   2HB   ASP  41          2HB       ASP  41   9.033  21.649  -7.255
  274    H    CYS  42           H        CYS  42   6.477  20.600  -4.716
  275    HA   CYS  42           HA       CYS  42   4.936  19.392  -6.790
  276   1HB   CYS  42          1HB       CYS  42   5.532  18.182  -4.672
  277   2HB   CYS  42          2HB       CYS  42   4.360  19.201  -3.852
  278    HG   CYS  42           HG       CYS  42   2.337  17.591  -4.314
  279    H    LYS  43           H        LYS  43   3.108  19.969  -7.663
  280    HA   LYS  43           HA       LYS  43   1.862  22.397  -6.832
  281   1HB   LYS  43          1HB       LYS  43   2.207  21.917  -9.182
  282   2HB   LYS  43          2HB       LYS  43   1.225  20.467  -9.053
  283   1HG   LYS  43          1HG       LYS  43  -0.704  21.867  -8.454
  284   2HG   LYS  43          2HG       LYS  43   0.294  23.300  -8.711
  285   1HD   LYS  43          1HD       LYS  43   0.629  22.689 -11.007
  286   2HD   LYS  43          2HD       LYS  43  -0.274  21.191 -10.773
  287   1HE   LYS  43          1HE       LYS  43  -1.366  23.986 -10.473
  288   2HE   LYS  43          2HE       LYS  43  -1.665  22.911 -11.836
  289   1HZ   LYS  43          1HZ       LYS  43  -2.786  21.384 -10.317
  290   2HZ   LYS  43          2HZ       LYS  43  -3.517  22.886 -10.287
  291   3HZ   LYS  43          3HZ       LYS  43  -2.525  22.423  -9.017
  292    H    VAL  44           H        VAL  44   1.101  18.954  -6.677
  293    HA   VAL  44           HA       VAL  44  -1.366  19.705  -5.333
  294    HB   VAL  44           HB       VAL  44  -1.999  19.052  -7.600
  295   1HG1  VAL  44          1HG1      VAL  44  -0.167  17.640  -8.223
  296   2HG1  VAL  44          2HG1      VAL  44  -1.696  16.790  -8.450
  297   3HG1  VAL  44          3HG1      VAL  44  -0.677  16.415  -7.060
  298   1HG2  VAL  44          1HG2      VAL  44  -3.628  17.300  -7.062
  299   2HG2  VAL  44          2HG2      VAL  44  -3.552  18.538  -5.807
  300   3HG2  VAL  44          3HG2      VAL  44  -2.769  16.978  -5.556
  301    H    GLY  45           H        GLY  45  -1.560  18.899  -3.462
  302   1HA   GLY  45          1HA       GLY  45  -1.416  17.486  -1.671
  303   2HA   GLY  45          2HA       GLY  45  -0.979  16.195  -2.790
  304    H    ARG  46           H        ARG  46   0.761  19.358  -2.063
  305    HA   ARG  46           HA       ARG  46   3.182  18.003  -2.010
  306   1HB   ARG  46          1HB       ARG  46   2.786  20.393  -2.718
  307   2HB   ARG  46          2HB       ARG  46   2.437  20.733  -1.031
  308   1HG   ARG  46          1HG       ARG  46   4.643  20.265  -0.371
  309   2HG   ARG  46          2HG       ARG  46   5.066  19.626  -1.958
  310   1HD   ARG  46          1HD       ARG  46   5.911  21.879  -1.729
  311   2HD   ARG  46          2HD       ARG  46   4.639  21.830  -2.947
  312    HE   ARG  46           HE       ARG  46   4.239  22.739  -0.192
  313   1HH1  ARG  46          1HH1      ARG  46   3.495  23.042  -3.669
  314   2HH1  ARG  46          2HH1      ARG  46   2.620  24.460  -3.526
  315   1HH2  ARG  46          1HH2      ARG  46   3.051  24.724   0.029
  316   2HH2  ARG  46          2HH2      ARG  46   2.364  25.505  -1.311
  317    H    ILE  47           H        ILE  47   3.966  16.982  -0.432
  318    HA   ILE  47           HA       ILE  47   2.696  16.937   2.117
  319    HB   ILE  47           HB       ILE  47   5.250  15.463   1.310
  320   1HG1  ILE  47          1HG1      ILE  47   2.359  14.531   1.401
  321   2HG1  ILE  47          2HG1      ILE  47   3.216  14.969  -0.064
  322   1HG2  ILE  47          1HG2      ILE  47   3.468  15.169   3.692
  323   2HG2  ILE  47          2HG2      ILE  47   5.150  15.681   3.653
  324   3HG2  ILE  47          3HG2      ILE  47   4.709  14.044   3.175
  325   1HD1  ILE  47          1HD1      ILE  47   3.997  12.734   1.780
  326   2HD1  ILE  47          2HD1      ILE  47   4.735  13.146   0.223
  327   3HD1  ILE  47          3HD1      ILE  47   3.077  12.562   0.286
  328    H    THR  48           H        THR  48   3.057  18.028   3.752
  329    HA   THR  48           HA       THR  48   4.686  20.244   3.850
  330    HB   THR  48           HB       THR  48   3.834  20.275   6.220
  331    HG1  THR  48           1HG      THR  48   2.355  18.611   6.713
  332   1HG2  THR  48          1HG2      THR  48   2.620  21.244   4.308
  333   2HG2  THR  48          2HG2      THR  48   1.519  20.531   5.520
  334   3HG2  THR  48          3HG2      THR  48   1.927  19.640   4.038
  335    H    THR  49           H        THR  49   4.830  17.269   5.692
  336    HA   THR  49           HA       THR  49   7.670  17.867   6.284
  337    HB   THR  49           HB       THR  49   5.916  16.802   8.481
  338    HG1  THR  49           1HG      THR  49   4.892  18.706   8.229
  339   1HG2  THR  49          1HG2      THR  49   8.427  18.492   8.453
  340   2HG2  THR  49          2HG2      THR  49   8.341  16.764   8.792
  341   3HG2  THR  49          3HG2      THR  49   7.597  17.918   9.900
  342    H    THR  50           H        THR  50   8.893  16.048   6.912
  343    HA   THR  50           HA       THR  50   8.559  13.672   5.602
  344    HB   THR  50           HB       THR  50  10.569  14.540   6.421
  345    HG1  THR  50           1HG      THR  50  10.457  12.294   6.056
  346   1HG2  THR  50          1HG2      THR  50  11.300  14.321   8.797
  347   2HG2  THR  50          2HG2      THR  50   9.642  13.825   9.180
  348   3HG2  THR  50          3HG2      THR  50   9.946  15.435   8.540
  349    H    GLU  51           H        GLU  51   7.725  14.446   8.949
  350    HA   GLU  51           HA       GLU  51   6.796  11.882   9.626
  351   1HB   GLU  51          1HB       GLU  51   5.590  12.995  11.486
  352   2HB   GLU  51          2HB       GLU  51   7.273  13.472  11.373
  353   1HG   GLU  51          1HG       GLU  51   6.565  15.553  10.241
  354   2HG   GLU  51          2HG       GLU  51   4.884  15.078  10.486
  355    H    ASP  52           H        ASP  52   5.151  14.508   7.897
  356    HA   ASP  52           HA       ASP  52   2.582  13.262   7.928
  357   1HB   ASP  52          1HB       ASP  52   3.909  15.570   6.577
  358   2HB   ASP  52          2HB       ASP  52   2.409  14.948   5.922
  359    H    PHE  53           H        PHE  53   5.369  13.384   5.835
  360    HA   PHE  53           HA       PHE  53   4.287  12.055   3.650
  361   1HB   PHE  53          1HB       PHE  53   6.464  13.198   3.502
  362   2HB   PHE  53          2HB       PHE  53   7.087  12.199   4.797
  363    HD1  PHE  53           1HD      PHE  53   6.274  12.356   1.271
  364    HD2  PHE  53           2HD      PHE  53   7.813   9.952   4.392
  365    HE1  PHE  53           1HE      PHE  53   7.155  10.784  -0.385
  366    HE2  PHE  53           2HE      PHE  53   8.688   8.372   2.781
  367    HZ   PHE  53           HZ       PHE  53   8.369   8.801   0.336
  368    H    LYS  54           H        LYS  54   6.038  10.862   6.377
  369    HA   LYS  54           HA       LYS  54   5.951   8.050   5.814
  370   1HB   LYS  54          1HB       LYS  54   6.326   9.567   8.373
  371   2HB   LYS  54          2HB       LYS  54   6.526   7.826   8.193
  372   1HG   LYS  54          1HG       LYS  54   8.294   8.166   6.572
  373   2HG   LYS  54          2HG       LYS  54   8.059   9.910   6.660
  374   1HD   LYS  54          1HD       LYS  54   8.727   9.904   8.975
  375   2HD   LYS  54          2HD       LYS  54   8.907   8.140   8.936
  376   1HE   LYS  54          1HE       LYS  54  10.479  10.126   7.286
  377   2HE   LYS  54          2HE       LYS  54  11.072   9.271   8.708
  378   1HZ   LYS  54          1HZ       LYS  54  11.793   8.210   6.653
  379   2HZ   LYS  54          2HZ       LYS  54  10.229   7.992   6.157
  380   3HZ   LYS  54          3HZ       LYS  54  10.791   7.165   7.497
  381    H    HIS  55           H        HIS  55   3.805  10.189   7.676
  382    HA   HIS  55           HA       HIS  55   2.155   8.110   8.743
  383   1HB   HIS  55          1HB       HIS  55   2.278  10.450   9.653
  384   2HB   HIS  55          2HB       HIS  55   1.568  11.018   8.168
  385    HD1  HIS  55           1HD      HIS  55   0.649   9.059  11.241
  386    HD2  HIS  55           2HD      HIS  55  -1.223  10.881   7.995
  387    HE1  HIS  55           1HE      HIS  55  -1.798   9.035  11.778
  388    H    LEU  56           H        LEU  56   1.954  10.194   5.933
  389    HA   LEU  56           HA       LEU  56  -0.519   9.097   5.046
  390   1HB   LEU  56          1HB       LEU  56   1.048  11.238   4.251
  391   2HB   LEU  56          2HB       LEU  56   1.222  10.090   2.946
  392    HG   LEU  56           HG       LEU  56  -0.950  11.788   3.780
  393   1HD1  LEU  56          1HD1      LEU  56  -0.191  10.708   1.117
  394   2HD1  LEU  56          2HD1      LEU  56   0.255  12.241   1.842
  395   3HD1  LEU  56          3HD1      LEU  56  -1.422  11.937   1.433
  396   1HD2  LEU  56          1HD2      LEU  56  -1.678   9.059   2.706
  397   2HD2  LEU  56          2HD2      LEU  56  -2.784  10.430   2.954
  398   3HD2  LEU  56          3HD2      LEU  56  -2.082   9.669   4.310
  399    H    ALA  57           H        ALA  57   2.886   8.289   4.184
  400    HA   ALA  57           HA       ALA  57   2.184   6.375   2.312
  401   1HB   ALA  57          1HB       ALA  57   4.525   7.125   2.695
  402   2HB   ALA  57          2HB       ALA  57   4.390   5.366   2.714
  403   3HB   ALA  57          3HB       ALA  57   4.525   6.255   4.228
  404    H    ARG  58           H        ARG  58   2.377   6.161   5.710
  405    HA   ARG  58           HA       ARG  58   1.937   3.344   6.049
  406   1HB   ARG  58          1HB       ARG  58   1.308   5.666   7.871
  407   2HB   ARG  58          2HB       ARG  58   1.057   3.992   8.330
  408   1HG   ARG  58          1HG       ARG  58   3.679   5.278   7.626
  409   2HG   ARG  58          2HG       ARG  58   3.132   4.824   9.246
  410   1HD   ARG  58          1HD       ARG  58   2.849   2.533   8.374
  411   2HD   ARG  58          2HD       ARG  58   3.669   3.080   6.913
  412    HE   ARG  58           HE       ARG  58   5.076   3.535   9.402
  413   1HH1  ARG  58          1HH1      ARG  58   4.785   1.494   6.520
  414   2HH1  ARG  58          2HH1      ARG  58   6.275   0.714   6.760
  415   1HH2  ARG  58          1HH2      ARG  58   7.087   2.424   9.757
  416   2HH2  ARG  58          2HH2      ARG  58   7.635   1.246   8.663
  417    H    LYS  59           H        LYS  59  -0.151   6.035   6.212
  418    HA   LYS  59           HA       LYS  59  -2.549   4.776   6.771
  419   1HB   LYS  59          1HB       LYS  59  -2.119   7.113   7.135
  420   2HB   LYS  59          2HB       LYS  59  -1.943   7.383   5.417
  421   1HG   LYS  59          1HG       LYS  59  -4.302   6.966   5.092
  422   2HG   LYS  59          2HG       LYS  59  -4.492   6.615   6.818
  423   1HD   LYS  59          1HD       LYS  59  -3.709   8.850   7.375
  424   2HD   LYS  59          2HD       LYS  59  -3.477   9.209   5.671
  425   1HE   LYS  59          1HE       LYS  59  -6.092   8.552   6.980
  426   2HE   LYS  59          2HE       LYS  59  -5.530  10.171   6.577
  427   1HZ   LYS  59          1HZ       LYS  59  -5.457   9.342   4.167
  428   2HZ   LYS  59          2HZ       LYS  59  -6.884   9.640   4.945
  429   3HZ   LYS  59          3HZ       LYS  59  -6.455   8.036   4.734
  430    H    LEU  60           H        LEU  60  -1.202   5.822   3.622
  431    HA   LEU  60           HA       LEU  60  -3.340   5.054   2.136
  432   1HB   LEU  60          1HB       LEU  60  -0.457   5.337   1.382
  433   2HB   LEU  60          2HB       LEU  60  -1.753   5.220   0.179
  434    HG   LEU  60           HG       LEU  60  -1.816   7.193   2.361
  435   1HD1  LEU  60          1HD1      LEU  60  -0.494   7.506  -0.350
  436   2HD1  LEU  60          2HD1      LEU  60   0.240   7.708   1.238
  437   3HD1  LEU  60          3HD1      LEU  60  -0.966   8.859   0.666
  438   1HD2  LEU  60          1HD2      LEU  60  -3.858   6.788   1.257
  439   2HD2  LEU  60          2HD2      LEU  60  -3.108   7.029  -0.326
  440   3HD2  LEU  60          3HD2      LEU  60  -3.274   8.388   0.796
  441    H    THR  61           H        THR  61  -0.386   3.429   2.980
  442    HA   THR  61           HA       THR  61  -0.614   1.002   1.571
  443    HB   THR  61           HB       THR  61   0.393   1.318   4.411
  444    HG1  THR  61           1HG      THR  61   1.528   2.641   2.854
  445   1HG2  THR  61          1HG2      THR  61  -0.018  -1.008   3.832
  446   2HG2  THR  61          2HG2      THR  61   1.721  -0.701   3.910
  447   3HG2  THR  61          3HG2      THR  61   0.912  -0.818   2.348
  448    H    HIS  62           H        HIS  62  -1.939   2.100   4.555
  449    HA   HIS  62           HA       HIS  62  -3.107  -0.374   5.263
  450   1HB   HIS  62          1HB       HIS  62  -2.433   1.235   6.977
  451   2HB   HIS  62          2HB       HIS  62  -3.522   2.433   6.315
  452    HD1  HIS  62           1HD      HIS  62  -3.325  -0.351   8.738
  453    HD2  HIS  62           2HD      HIS  62  -6.299   1.972   6.997
  454    HE1  HIS  62           1HE      HIS  62  -5.283  -0.558  10.248
  455    H    GLY  63           H        GLY  63  -4.354   2.450   3.501
  456   1HA   GLY  63          1HA       GLY  63  -7.031   1.491   3.602
  457   2HA   GLY  63          2HA       GLY  63  -6.474   2.810   2.609
  458    H    VAL  64           H        VAL  64  -4.393   1.250   1.248
  459    HA   VAL  64           HA       VAL  64  -5.951   0.036  -0.859
  460    HB   VAL  64           HB       VAL  64  -2.975  -0.280  -0.220
  461   1HG1  VAL  64          1HG1      VAL  64  -2.705  -1.110  -2.543
  462   2HG1  VAL  64          2HG1      VAL  64  -4.420  -0.969  -2.801
  463   3HG1  VAL  64          3HG1      VAL  64  -3.807  -2.143  -1.653
  464   1HG2  VAL  64          1HG2      VAL  64  -4.357   1.517  -2.209
  465   2HG2  VAL  64          2HG2      VAL  64  -2.614   1.316  -2.054
  466   3HG2  VAL  64          3HG2      VAL  64  -3.542   2.031  -0.730
  467    H    MET  65           H        MET  65  -4.280  -0.990   1.777
  468    HA   MET  65           HA       MET  65  -4.316  -3.817   1.454
  469   1HB   MET  65          1HB       MET  65  -2.772  -2.846   3.035
  470   2HB   MET  65          2HB       MET  65  -4.077  -2.114   3.927
  471   1HG   MET  65          1HG       MET  65  -4.842  -4.242   4.647
  472   2HG   MET  65          2HG       MET  65  -3.522  -5.044   3.801
  473   1HE   MET  65          1HE       MET  65  -4.253  -5.049   6.872
  474   2HE   MET  65          2HE       MET  65  -2.644  -5.112   7.623
  475   3HE   MET  65          3HE       MET  65  -3.006  -6.100   6.177
  476    H    ASN  66           H        ASN  66  -6.371  -1.672   3.370
  477    HA   ASN  66           HA       ASN  66  -8.139  -3.705   4.227
  478   1HB   ASN  66          1HB       ASN  66  -7.969  -0.788   4.364
  479   2HB   ASN  66          2HB       ASN  66  -9.595  -1.400   4.525
  480   1HD2  ASN  66          1HD2      ASN  66  -6.488  -1.061   5.832
  481   2HD2  ASN  66          2HD2      ASN  66  -6.781  -1.706   7.407
  482    H    LYS  67           H        LYS  67  -8.275  -1.489   1.516
  483    HA   LYS  67           HA       LYS  67 -10.895  -2.287   0.860
  484   1HB   LYS  67          1HB       LYS  67  -8.820  -0.850  -0.783
  485   2HB   LYS  67          2HB       LYS  67 -10.452  -1.174  -1.362
  486   1HG   LYS  67          1HG       LYS  67 -11.371   0.070   0.531
  487   2HG   LYS  67          2HG       LYS  67  -9.739   0.411   1.094
  488   1HD   LYS  67          1HD       LYS  67  -9.288   1.703  -0.904
  489   2HD   LYS  67          2HD       LYS  67 -10.871   1.288  -1.566
  490   1HE   LYS  67          1HE       LYS  67 -11.934   2.385   0.375
  491   2HE   LYS  67          2HE       LYS  67 -10.341   2.845   0.957
  492   1HZ   LYS  67          1HZ       LYS  67 -11.447   4.645  -0.201
  493   2HZ   LYS  67          2HZ       LYS  67 -11.561   3.747  -1.608
  494   3HZ   LYS  67          3HZ       LYS  67 -10.065   4.218  -1.036
  495    H    GLU  68           H        GLU  68  -7.717  -3.536  -0.224
  496    HA   GLU  68           HA       GLU  68  -9.142  -5.240  -1.959
  497   1HB   GLU  68          1HB       GLU  68  -7.002  -6.272  -2.427
  498   2HB   GLU  68          2HB       GLU  68  -7.039  -4.505  -2.594
  499   1HG   GLU  68          1HG       GLU  68  -5.869  -4.267  -0.506
  500   2HG   GLU  68          2HG       GLU  68  -5.747  -6.016  -0.331
  501    H    LEU  69           H        LEU  69  -7.750  -5.609   1.297
  502    HA   LEU  69           HA       LEU  69  -8.410  -8.262   1.537
  503   1HB   LEU  69          1HB       LEU  69  -8.454  -6.031   3.550
  504   2HB   LEU  69          2HB       LEU  69  -8.874  -7.673   3.989
  505    HG   LEU  69           HG       LEU  69  -6.214  -6.892   2.806
  506   1HD1  LEU  69          1HD1      LEU  69  -6.519  -5.819   4.968
  507   2HD1  LEU  69          2HD1      LEU  69  -5.339  -7.120   5.067
  508   3HD1  LEU  69          3HD1      LEU  69  -6.973  -7.364   5.692
  509   1HD2  LEU  69          1HD2      LEU  69  -7.237  -9.404   4.125
  510   2HD2  LEU  69          2HD2      LEU  69  -5.560  -9.097   3.706
  511   3HD2  LEU  69          3HD2      LEU  69  -6.771  -9.215   2.431
  512    H    LYS  70           H        LYS  70 -10.641  -5.487   1.439
  513    HA   LYS  70           HA       LYS  70 -12.866  -6.988   2.355
  514   1HB   LYS  70          1HB       LYS  70 -12.622  -4.469   0.732
  515   2HB   LYS  70          2HB       LYS  70 -14.160  -5.134   1.288
  516   1HG   LYS  70          1HG       LYS  70 -13.352  -4.913   3.556
  517   2HG   LYS  70          2HG       LYS  70 -11.868  -4.183   2.952
  518   1HD   LYS  70          1HD       LYS  70 -13.365  -2.382   3.648
  519   2HD   LYS  70          2HD       LYS  70 -13.204  -2.369   1.893
  520   1HE   LYS  70          1HE       LYS  70 -15.521  -2.009   2.516
  521   2HE   LYS  70          2HE       LYS  70 -15.363  -3.557   1.704
  522   1HZ   LYS  70          1HZ       LYS  70 -15.388  -4.642   3.884
  523   2HZ   LYS  70          2HZ       LYS  70 -16.776  -3.752   3.624
  524   3HZ   LYS  70          3HZ       LYS  70 -15.585  -3.146   4.639
  525    H    TYR  71           H        TYR  71 -11.655  -6.031  -0.762
  526    HA   TYR  71           HA       TYR  71 -13.735  -7.525  -2.217
  527   1HB   TYR  71          1HB       TYR  71 -11.532  -5.709  -3.175
  528   2HB   TYR  71          2HB       TYR  71 -12.631  -6.564  -4.253
  529    HD1  TYR  71           1HD      TYR  71 -14.240  -5.146  -5.140
  530    HD2  TYR  71           2HD      TYR  71 -13.032  -4.615  -1.133
  531    HE1  TYR  71           1HE      TYR  71 -15.858  -3.289  -4.915
  532    HE2  TYR  71           2HE      TYR  71 -14.615  -2.766  -0.860
  533    HH   TYR  71           HH       TYR  71 -15.697  -1.126  -2.364
  534    H    CYS  72           H        CYS  72 -11.090  -8.593  -0.880
  535    HA   CYS  72           HA       CYS  72 -10.659 -10.606  -2.985
  536   1HB   CYS  72          1HB       CYS  72  -8.626  -9.343  -1.172
  537   2HB   CYS  72          2HB       CYS  72  -8.257 -10.835  -2.002
  538    HG   CYS  72           HG       CYS  72  -7.126  -8.409  -3.167
  539    H    LYS  73           H        LYS  73 -10.358  -9.913   0.476
  540    HA   LYS  73           HA       LYS  73 -11.037 -10.965   2.301
  541   1HB   LYS  73          1HB       LYS  73 -12.461 -12.839   0.415
  542   2HB   LYS  73          2HB       LYS  73 -12.701 -12.786   2.154
  543   1HG   LYS  73          1HG       LYS  73 -13.595 -10.572   2.063
  544   2HG   LYS  73          2HG       LYS  73 -13.149 -10.385   0.379
  545   1HD   LYS  73          1HD       LYS  73 -14.686 -12.122  -0.248
  546   2HD   LYS  73          2HD       LYS  73 -15.156 -12.365   1.446
  547   1HE   LYS  73          1HE       LYS  73 -15.493  -9.824  -0.154
  548   2HE   LYS  73          2HE       LYS  73 -16.778 -10.971   0.202
  549   1HZ   LYS  73          1HZ       LYS  73 -15.259  -9.424   2.247
  550   2HZ   LYS  73          2HZ       LYS  73 -16.558 -10.483   2.536
  551   3HZ   LYS  73          3HZ       LYS  73 -16.807  -9.085   1.675
  552    H    ASN  74           H        ASN  74  -9.560 -12.950  -0.106
  553    HA   ASN  74           HA       ASN  74  -8.382 -14.549   2.026
  554   1HB   ASN  74          1HB       ASN  74  -8.756 -15.163  -0.910
  555   2HB   ASN  74          2HB       ASN  74  -7.779 -16.161   0.172
  556   1HD2  ASN  74          1HD2      ASN  74 -10.386 -16.591  -1.292
  557   2HD2  ASN  74          2HD2      ASN  74 -11.452 -17.178  -0.071
  558    HA   PRO  75           HA       PRO  75  -4.992 -11.797   1.202
  559   1HB   PRO  75          1HB       PRO  75  -3.480 -12.690   3.117
  560   2HB   PRO  75          2HB       PRO  75  -4.710 -11.410   3.213
  561   1HG   PRO  75          1HG       PRO  75  -4.800 -14.291   4.214
  562   2HG   PRO  75          2HG       PRO  75  -5.680 -12.915   4.876
  563   1HD   PRO  75          1HD       PRO  75  -6.697 -14.879   3.245
  564   2HD   PRO  75          2HD       PRO  75  -7.425 -13.278   3.493
  565    H    GLU  76           H        GLU  76  -4.946 -14.923   0.695
  566    HA   GLU  76           HA       GLU  76  -2.229 -15.467   0.225
  567   1HB   GLU  76          1HB       GLU  76  -4.158 -17.124   0.292
  568   2HB   GLU  76          2HB       GLU  76  -4.610 -16.565  -1.299
  569   1HG   GLU  76          1HG       GLU  76  -1.884 -17.716  -0.821
  570   2HG   GLU  76          2HG       GLU  76  -3.268 -18.780  -0.996
  571    H    ASP  77           H        ASP  77  -4.394 -13.421  -1.088
  572    HA   ASP  77           HA       ASP  77  -2.828 -12.952  -3.560
  573   1HB   ASP  77          1HB       ASP  77  -5.759 -12.646  -3.087
  574   2HB   ASP  77          2HB       ASP  77  -4.959 -11.727  -4.357
  575    H    LEU  78           H        LEU  78  -3.081 -11.858  -0.598
  576    HA   LEU  78           HA       LEU  78  -3.292  -9.068  -1.195
  577   1HB   LEU  78          1HB       LEU  78  -4.229 -10.087   0.837
  578   2HB   LEU  78          2HB       LEU  78  -2.598 -10.620   1.253
  579    HG   LEU  78           HG       LEU  78  -1.991  -8.280   1.132
  580   1HD1  LEU  78          1HD1      LEU  78  -3.798  -6.657   1.780
  581   2HD1  LEU  78          2HD1      LEU  78  -4.971  -7.923   1.426
  582   3HD1  LEU  78          3HD1      LEU  78  -3.946  -7.274   0.131
  583   1HD2  LEU  78          1HD2      LEU  78  -2.767  -7.843   3.476
  584   2HD2  LEU  78          2HD2      LEU  78  -1.900  -9.331   3.110
  585   3HD2  LEU  78          3HD2      LEU  78  -3.652  -9.377   3.330
  586    H    GLU  79           H        GLU  79  -1.603  -8.637  -2.389
  587    HA   GLU  79           HA       GLU  79   1.132  -9.023  -1.457
  588   1HB   GLU  79          1HB       GLU  79   0.543 -10.921  -2.922
  589   2HB   GLU  79          2HB       GLU  79  -0.155  -9.743  -4.035
  590   1HG   GLU  79          1HG       GLU  79   1.847 -10.521  -4.852
  591   2HG   GLU  79          2HG       GLU  79   1.951  -8.818  -4.503
  592    H    CYS  80           H        CYS  80   2.380  -7.465  -2.292
  593    HA   CYS  80           HA       CYS  80   1.019  -5.171  -3.442
  594   1HB   CYS  80          1HB       CYS  80   2.537  -4.552  -1.750
  595   2HB   CYS  80          2HB       CYS  80   3.851  -5.541  -2.347
  596    HG   CYS  80           HG       CYS  80   4.843  -3.811  -3.972
  597    H    ASN  81           H        ASN  81   0.484  -6.532  -5.197
  598    HA   ASN  81           HA       ASN  81   2.730  -7.166  -6.865
  599   1HB   ASN  81          1HB       ASN  81   1.244  -8.571  -8.206
  600   2HB   ASN  81          2HB       ASN  81   0.983  -8.959  -6.505
  601   1HD2  ASN  81          1HD2      ASN  81  -1.036  -8.501  -5.683
  602   2HD2  ASN  81          2HD2      ASN  81  -2.339  -7.959  -6.645
  603    H    GLU  82           H        GLU  82   1.997  -7.018  -9.209
  604    HA   GLU  82           HA       GLU  82   2.216  -4.602 -10.142
  605   1HB   GLU  82          1HB       GLU  82   2.391  -6.791 -11.175
  606   2HB   GLU  82          2HB       GLU  82   0.641  -6.826 -11.246
  607   1HG   GLU  82          1HG       GLU  82   0.672  -4.860 -12.683
  608   2HG   GLU  82          2HG       GLU  82   2.449  -4.913 -12.606
  609    H    ASN  83           H        ASN  83  -0.832  -6.421  -9.997
  610    HA   ASN  83           HA       ASN  83  -2.777  -4.617 -10.850
  611   1HB   ASN  83          1HB       ASN  83  -3.012  -7.111 -10.343
  612   2HB   ASN  83          2HB       ASN  83  -3.061  -6.708  -8.648
  613   1HD2  ASN  83          1HD2      ASN  83  -5.071  -8.042 -10.118
  614   2HD2  ASN  83          2HD2      ASN  83  -6.506  -7.083 -10.130
  615    H    VAL  84           H        VAL  84  -1.579  -5.440  -7.581
  616    HA   VAL  84           HA       VAL  84  -3.213  -3.582  -6.317
  617    HB   VAL  84           HB       VAL  84  -0.730  -5.025  -5.414
  618   1HG1  VAL  84          1HG1      VAL  84  -0.789  -2.936  -4.163
  619   2HG1  VAL  84          2HG1      VAL  84  -1.263  -4.300  -3.142
  620   3HG1  VAL  84          3HG1      VAL  84  -2.492  -3.198  -3.768
  621   1HG2  VAL  84          1HG2      VAL  84  -3.624  -5.206  -4.705
  622   2HG2  VAL  84          2HG2      VAL  84  -2.317  -6.204  -4.059
  623   3HG2  VAL  84          3HG2      VAL  84  -2.739  -6.297  -5.780
  624    H    LYS  85           H        LYS  85   0.111  -3.359  -7.349
  625    HA   LYS  85           HA       LYS  85   0.775  -0.787  -6.438
  626   1HB   LYS  85          1HB       LYS  85   1.637  -2.198  -8.945
  627   2HB   LYS  85          2HB       LYS  85   2.360  -0.707  -8.354
  628   1HG   LYS  85          1HG       LYS  85   3.104  -1.747  -6.407
  629   2HG   LYS  85          2HG       LYS  85   2.242  -3.251  -6.785
  630   1HD   LYS  85          1HD       LYS  85   3.659  -3.293  -8.891
  631   2HD   LYS  85          2HD       LYS  85   4.645  -2.039  -8.116
  632   1HE   LYS  85          1HE       LYS  85   4.856  -3.515  -6.158
  633   2HE   LYS  85          2HE       LYS  85   3.958  -4.720  -7.085
  634   1HZ   LYS  85          1HZ       LYS  85   6.593  -3.598  -7.891
  635   2HZ   LYS  85          2HZ       LYS  85   5.738  -4.818  -8.696
  636   3HZ   LYS  85          3HZ       LYS  85   6.367  -5.100  -7.164
  637    H    HIS  86           H        HIS  86  -0.556  -1.805  -9.422
  638    HA   HIS  86           HA       HIS  86  -0.858   0.537 -10.843
  639   1HB   HIS  86          1HB       HIS  86  -1.338  -1.729 -11.669
  640   2HB   HIS  86          2HB       HIS  86  -2.755  -1.814 -10.650
  641    HD1  HIS  86           1HD      HIS  86  -1.644  -0.984 -13.961
  642    HD2  HIS  86           2HD      HIS  86  -4.862   0.029 -11.567
  643    HE1  HIS  86           1HE      HIS  86  -3.402  -0.243 -15.538
  644    H    LYS  87           H        LYS  87  -3.157  -1.030  -8.734
  645    HA   LYS  87           HA       LYS  87  -5.175   0.989  -8.598
  646   1HB   LYS  87          1HB       LYS  87  -5.555  -1.434  -8.155
  647   2HB   LYS  87          2HB       LYS  87  -4.434  -1.340  -6.820
  648   1HG   LYS  87          1HG       LYS  87  -5.939  -0.106  -5.526
  649   2HG   LYS  87          2HG       LYS  87  -6.994   0.198  -6.915
  650   1HD   LYS  87          1HD       LYS  87  -7.967  -1.565  -5.542
  651   2HD   LYS  87          2HD       LYS  87  -7.444  -2.206  -7.097
  652   1HE   LYS  87          1HE       LYS  87  -6.817  -3.827  -5.450
  653   2HE   LYS  87          2HE       LYS  87  -5.334  -3.017  -5.926
  654   1HZ   LYS  87          1HZ       LYS  87  -5.578  -1.625  -3.890
  655   2HZ   LYS  87          2HZ       LYS  87  -5.390  -3.262  -3.534
  656   3HZ   LYS  87          3HZ       LYS  87  -6.915  -2.546  -3.466
  657    H    THR  88           H        THR  88  -2.389   0.489  -6.860
  658    HA   THR  88           HA       THR  88  -3.064   2.181  -4.684
  659    HB   THR  88           HB       THR  88  -0.596   0.891  -5.656
  660    HG1  THR  88           1HG      THR  88  -1.868  -0.542  -4.735
  661   1HG2  THR  88          1HG2      THR  88   0.454   1.625  -3.554
  662   2HG2  THR  88          2HG2      THR  88  -0.989   2.638  -3.237
  663   3HG2  THR  88          3HG2      THR  88   0.017   2.924  -4.676
  664    H    LYS  89           H        LYS  89  -0.648   2.506  -7.245
  665    HA   LYS  89           HA       LYS  89  -0.111   5.029  -6.425
  666   1HB   LYS  89          1HB       LYS  89   0.954   5.266  -8.860
  667   2HB   LYS  89          2HB       LYS  89   1.658   4.283  -7.587
  668   1HG   LYS  89          1HG       LYS  89   1.695   3.009  -9.596
  669   2HG   LYS  89          2HG       LYS  89   0.448   2.325  -8.546
  670   1HD   LYS  89          1HD       LYS  89  -0.584   2.349 -10.481
  671   2HD   LYS  89          2HD       LYS  89  -1.025   3.882  -9.774
  672   1HE   LYS  89          1HE       LYS  89  -0.435   4.357 -12.089
  673   2HE   LYS  89          2HE       LYS  89   0.778   5.020 -10.991
  674   1HZ   LYS  89          1HZ       LYS  89   1.778   3.919 -12.891
  675   2HZ   LYS  89          2HZ       LYS  89   1.056   2.460 -12.463
  676   3HZ   LYS  89          3HZ       LYS  89   2.214   3.150 -11.457
  677    H    GLU  90           H        GLU  90  -2.429   3.827  -8.767
  678    HA   GLU  90           HA       GLU  90  -3.238   6.385  -9.743
  679   1HB   GLU  90          1HB       GLU  90  -4.684   3.758  -9.709
  680   2HB   GLU  90          2HB       GLU  90  -5.375   5.201 -10.440
  681   1HG   GLU  90          1HG       GLU  90  -3.257   5.312 -11.859
  682   2HG   GLU  90          2HG       GLU  90  -2.912   3.695 -11.263
  683    H    TYR  91           H        TYR  91  -4.116   4.493  -6.931
  684    HA   TYR  91           HA       TYR  91  -6.415   6.005  -6.255
  685   1HB   TYR  91          1HB       TYR  91  -6.442   3.934  -5.186
  686   2HB   TYR  91          2HB       TYR  91  -4.709   3.942  -4.915
  687    HD1  TYR  91           1HD      TYR  91  -7.742   5.841  -3.843
  688    HD2  TYR  91           2HD      TYR  91  -3.983   4.191  -2.774
  689    HE1  TYR  91           1HE      TYR  91  -8.102   6.537  -1.513
  690    HE2  TYR  91           2HE      TYR  91  -4.316   4.875  -0.464
  691    HH   TYR  91           HH       TYR  91  -5.640   6.592   0.761
  692    H    ILE  92           H        ILE  92  -3.031   5.870  -5.244
  693    HA   ILE  92           HA       ILE  92  -2.858   7.934  -3.434
  694    HB   ILE  92           HB       ILE  92  -0.901   7.222  -5.617
  695   1HG1  ILE  92          1HG1      ILE  92  -1.698   5.559  -3.798
  696   2HG1  ILE  92          2HG1      ILE  92   0.026   5.594  -4.208
  697   1HG2  ILE  92          1HG2      ILE  92   0.836   8.330  -4.264
  698   2HG2  ILE  92          2HG2      ILE  92  -0.428   8.821  -3.118
  699   3HG2  ILE  92          3HG2      ILE  92  -0.466   9.433  -4.762
  700   1HD1  ILE  92          1HD1      ILE  92  -0.348   5.415  -1.857
  701   2HD1  ILE  92          2HD1      ILE  92  -1.439   6.811  -1.921
  702   3HD1  ILE  92          3HD1      ILE  92   0.303   7.017  -2.246
  703    H    LYS  93           H        LYS  93  -2.351   8.292  -6.915
  704    HA   LYS  93           HA       LYS  93  -2.037  11.047  -6.783
  705   1HB   LYS  93          1HB       LYS  93  -3.140   9.379  -9.038
  706   2HB   LYS  93          2HB       LYS  93  -2.767  11.093  -9.176
  707   1HG   LYS  93          1HG       LYS  93  -0.430  10.557  -8.505
  708   2HG   LYS  93          2HG       LYS  93  -0.860   8.851  -8.604
  709   1HD   LYS  93          1HD       LYS  93  -1.337   9.040 -10.940
  710   2HD   LYS  93          2HD       LYS  93  -1.156  10.796 -10.884
  711   1HE   LYS  93          1HE       LYS  93   1.009   8.763 -10.376
  712   2HE   LYS  93          2HE       LYS  93   0.836   9.757 -11.822
  713   1HZ   LYS  93          1HZ       LYS  93   1.144  11.742 -10.390
  714   2HZ   LYS  93          2HZ       LYS  93   2.472  10.717 -10.352
  715   3HZ   LYS  93          3HZ       LYS  93   1.420  10.746  -9.064
  716    H    LYS  94           H        LYS  94  -4.968   9.151  -7.224
  717    HA   LYS  94           HA       LYS  94  -6.522  11.463  -7.668
  718   1HB   LYS  94          1HB       LYS  94  -7.263   9.236  -8.459
  719   2HB   LYS  94          2HB       LYS  94  -7.391   8.683  -6.800
  720   1HG   LYS  94          1HG       LYS  94  -9.584   9.117  -7.702
  721   2HG   LYS  94          2HG       LYS  94  -9.228  10.283  -6.432
  722   1HD   LYS  94          1HD       LYS  94  -8.719  11.983  -8.075
  723   2HD   LYS  94          2HD       LYS  94  -8.906  10.816  -9.386
  724   1HE   LYS  94          1HE       LYS  94 -10.899  12.207  -9.206
  725   2HE   LYS  94          2HE       LYS  94 -11.270  10.538  -8.781
  726   1HZ   LYS  94          1HZ       LYS  94 -11.163  11.185  -6.423
  727   2HZ   LYS  94          2HZ       LYS  94 -12.317  12.048  -7.275
  728   3HZ   LYS  94          3HZ       LYS  94 -10.856  12.781  -6.885
  729    H    TYR  95           H        TYR  95  -5.657   9.569  -4.886
  730    HA   TYR  95           HA       TYR  95  -7.317  10.752  -3.003
  731   1HB   TYR  95          1HB       TYR  95  -6.193   8.729  -2.595
  732   2HB   TYR  95          2HB       TYR  95  -4.640   9.502  -2.937
  733    HD1  TYR  95           1HD      TYR  95  -3.403  10.308  -1.149
  734    HD2  TYR  95           2HD      TYR  95  -7.559   9.669  -0.597
  735    HE1  TYR  95           1HE      TYR  95  -3.186  10.879   1.201
  736    HE2  TYR  95           2HE      TYR  95  -7.305  10.220   1.796
  737    HH   TYR  95           HH       TYR  95  -5.972  11.236   3.170
  738    H    MET  96           H        MET  96  -3.987  11.523  -3.829
  739    HA   MET  96           HA       MET  96  -3.861  13.637  -2.013
  740   1HB   MET  96          1HB       MET  96  -2.196  13.291  -4.451
  741   2HB   MET  96          2HB       MET  96  -1.811  14.285  -3.045
  742   1HG   MET  96          1HG       MET  96  -2.218  11.928  -1.808
  743   2HG   MET  96          2HG       MET  96  -1.672  11.359  -3.394
  744   1HE   MET  96          1HE       MET  96   0.743  14.043  -0.625
  745   2HE   MET  96          2HE       MET  96  -0.964  13.590  -0.384
  746   3HE   MET  96          3HE       MET  96  -0.480  14.603  -1.760
  747    H    GLN  97           H        GLN  97  -5.192  13.474  -5.067
  748    HA   GLN  97           HA       GLN  97  -5.103  16.245  -5.741
  749   1HB   GLN  97          1HB       GLN  97  -7.368  14.429  -6.560
  750   2HB   GLN  97          2HB       GLN  97  -6.887  15.926  -7.338
  751   1HG   GLN  97          1HG       GLN  97  -5.504  13.276  -7.335
  752   2HG   GLN  97          2HG       GLN  97  -6.112  14.175  -8.713
  753   1HE2  GLN  97          1HE2      GLN  97  -3.594  13.676  -6.506
  754   2HE2  GLN  97          2HE2      GLN  97  -2.394  14.698  -7.166
  755    H    LYS  98           H        LYS  98  -6.926  14.630  -3.365
  756    HA   LYS  98           HA       LYS  98  -9.027  16.578  -3.249
  757   1HB   LYS  98          1HB       LYS  98  -9.906  15.354  -1.414
  758   2HB   LYS  98          2HB       LYS  98  -9.337  14.220  -2.619
  759   1HG   LYS  98          1HG       LYS  98  -8.458  13.166  -0.774
  760   2HG   LYS  98          2HG       LYS  98  -7.215  14.246  -1.192
  761   1HD   LYS  98          1HD       LYS  98  -7.556  14.320   1.205
  762   2HD   LYS  98          2HD       LYS  98  -7.761  15.888   0.445
  763   1HE   LYS  98          1HE       LYS  98  -9.995  14.067   1.445
  764   2HE   LYS  98          2HE       LYS  98  -9.339  15.492   2.232
  765   1HZ   LYS  98          1HZ       LYS  98 -10.197  16.846   0.331
  766   2HZ   LYS  98          2HZ       LYS  98 -11.317  16.114   1.294
  767   3HZ   LYS  98          3HZ       LYS  98 -11.043  15.469  -0.210
  768    H    PHE  99           H        PHE  99  -5.877  16.313  -1.935
  769    HA   PHE  99           HA       PHE  99  -6.361  17.986   0.344
  770   1HB   PHE  99          1HB       PHE  99  -3.758  17.087  -0.897
  771   2HB   PHE  99          2HB       PHE  99  -3.868  18.115   0.529
  772    HD1  PHE  99           1HD      PHE  99  -5.614  17.096   2.339
  773    HD2  PHE  99           2HD      PHE  99  -3.295  14.876  -0.462
  774    HE1  PHE  99           1HE      PHE  99  -5.725  15.127   3.814
  775    HE2  PHE  99           2HE      PHE  99  -3.415  12.885   1.055
  776    HZ   PHE  99           HZ       PHE  99  -4.698  13.030   3.125
  777    H    GLY 100           H        GLY 100  -5.256  18.540  -2.924
  778   1HA   GLY 100          1HA       GLY 100  -5.699  20.627  -3.946
  779   2HA   GLY 100          2HA       GLY 100  -5.493  21.373  -2.363
  780    H    ALA 101           H        ALA 101  -3.855  22.536  -2.447
  781    HA   ALA 101           HA       ALA 101  -1.519  22.030  -4.049
  782   1HB   ALA 101          1HB       ALA 101  -2.277  24.295  -3.612
  783   2HB   ALA 101          2HB       ALA 101  -0.663  24.049  -2.914
  784   3HB   ALA 101          3HB       ALA 101  -2.089  24.037  -1.882
  785    H    VAL 102           H        VAL 102  -2.229  22.051  -0.552
  786    HA   VAL 102           HA       VAL 102   0.165  20.461  -0.220
  787    HB   VAL 102           HB       VAL 102  -0.160  21.291   2.219
  788   1HG1  VAL 102          1HG1      VAL 102   1.116  22.944   0.025
  789   2HG1  VAL 102          2HG1      VAL 102   1.873  21.644   0.974
  790   3HG1  VAL 102          3HG1      VAL 102   1.432  23.160   1.749
  791   1HG2  VAL 102          1HG2      VAL 102  -2.142  22.595   1.879
  792   2HG2  VAL 102          2HG2      VAL 102  -1.335  23.566   0.648
  793   3HG2  VAL 102          3HG2      VAL 102  -0.818  23.670   2.330
  794    H    TYR 103           H        TYR 103   0.216  18.928   1.337
  795    HA   TYR 103           HA       TYR 103  -2.162  17.422   1.480
  796   1HB   TYR 103          1HB       TYR 103  -0.284  16.106   1.013
  797   2HB   TYR 103          2HB       TYR 103   0.724  16.998   2.135
  798    HD1  TYR 103           1HD      TYR 103  -2.524  15.340   2.801
  799    HD2  TYR 103           2HD      TYR 103   1.631  15.334   3.425
  800    HE1  TYR 103           1HE      TYR 103  -2.819  13.595   4.433
  801    HE2  TYR 103           2HE      TYR 103   1.379  13.527   5.096
  802    HH   TYR 103           HH       TYR 103  -0.296  12.748   6.613
  803    H    LYS 104           H        LYS 104  -3.593  17.806   2.926
  804    HA   LYS 104           HA       LYS 104  -2.773  18.536   5.599
  805   1HB   LYS 104          1HB       LYS 104  -4.918  19.826   5.668
  806   2HB   LYS 104          2HB       LYS 104  -3.630  20.457   4.635
  807   1HG   LYS 104          1HG       LYS 104  -4.793  19.506   2.687
  808   2HG   LYS 104          2HG       LYS 104  -6.090  18.952   3.750
  809   1HD   LYS 104          1HD       LYS 104  -6.812  21.013   2.831
  810   2HD   LYS 104          2HD       LYS 104  -6.312  21.317   4.504
  811   1HE   LYS 104          1HE       LYS 104  -5.413  23.099   3.159
  812   2HE   LYS 104          2HE       LYS 104  -4.079  22.048   3.616
  813   1HZ   LYS 104          1HZ       LYS 104  -4.137  21.034   1.445
  814   2HZ   LYS 104          2HZ       LYS 104  -4.066  22.730   1.290
  815   3HZ   LYS 104          3HZ       LYS 104  -5.498  21.934   1.045
  816    HA   PRO 105           HA       PRO 105  -4.880  14.453   5.824
  817   1HB   PRO 105          1HB       PRO 105  -3.755  13.817   8.236
  818   2HB   PRO 105          2HB       PRO 105  -2.989  13.516   6.672
  819   1HG   PRO 105          1HG       PRO 105  -2.611  15.749   8.579
  820   2HG   PRO 105          2HG       PRO 105  -1.378  14.843   7.636
  821   1HD   PRO 105          1HD       PRO 105  -2.233  17.303   7.025
  822   2HD   PRO 105          2HD       PRO 105  -1.777  16.167   5.748
  823    H    LYS 106           H        LYS 106  -4.656  16.831   8.413
  824    HA   LYS 106           HA       LYS 106  -6.922  15.974   9.828
  825   1HB   LYS 106          1HB       LYS 106  -5.612  18.677   9.687
  826   2HB   LYS 106          2HB       LYS 106  -7.050  18.390  10.637
  827   1HG   LYS 106          1HG       LYS 106  -5.169  18.272  12.087
  828   2HG   LYS 106          2HG       LYS 106  -5.811  16.648  11.906
  829   1HD   LYS 106          1HD       LYS 106  -4.000  16.140  10.323
  830   2HD   LYS 106          2HD       LYS 106  -3.373  17.783  10.525
  831   1HE   LYS 106          1HE       LYS 106  -3.151  17.348  12.948
  832   2HE   LYS 106          2HE       LYS 106  -3.647  15.682  12.670
  833   1HZ   LYS 106          1HZ       LYS 106  -1.676  15.389  11.287
  834   2HZ   LYS 106          2HZ       LYS 106  -1.248  15.957  12.836
  835   3HZ   LYS 106          3HZ       LYS 106  -1.258  17.000  11.543
  836    H    GLU 107           H        GLU 107  -6.879  17.086   6.768
  837    HA   GLU 107           HA       GLU 107  -9.734  17.658   6.893
  838   1HB   GLU 107          1HB       GLU 107  -7.628  18.985   5.190
  839   2HB   GLU 107          2HB       GLU 107  -9.358  19.178   4.927
  840   1HG   GLU 107          1HG       GLU 107  -9.594  20.132   7.162
  841   2HG   GLU 107          2HG       GLU 107  -7.878  19.902   7.448
  842    H    ASP 108           H        ASP 108  -8.047  15.242   6.475
  843    HA   ASP 108           HA       ASP 108  -8.312  14.487   3.752
  844   1HB   ASP 108          1HB       ASP 108  -6.451  13.596   4.830
  845   2HB   ASP 108          2HB       ASP 108  -7.358  13.142   6.282
  846    H    THR 109           H        THR 109  -9.448  12.265   3.477
  847    HA   THR 109           HA       THR 109 -12.210  12.474   4.168
  848    HB   THR 109           HB       THR 109 -11.514  11.690   1.975
  849    HG1  THR 109           1HG      THR 109 -13.093  10.169   3.630
  850   1HG2  THR 109          1HG2      THR 109  -9.410  10.659   2.648
  851   2HG2  THR 109          2HG2      THR 109 -10.364   9.535   1.667
  852   3HG2  THR 109          3HG2      THR 109 -10.286   9.348   3.427
  Start of MODEL    2
    1    H    THR  10           H        THR  10  -3.461 -23.935   5.222
    2    HA   THR  10           HA       THR  10  -3.961 -22.153   7.327
    3    HB   THR  10           HB       THR  10  -1.420 -22.445   7.508
    4    HG1  THR  10           1HG      THR  10  -0.488 -23.316   5.830
    5   1HG2  THR  10          1HG2      THR  10  -1.638 -24.792   8.222
    6   2HG2  THR  10          2HG2      THR  10  -3.163 -24.918   7.348
    7   3HG2  THR  10          3HG2      THR  10  -3.036 -23.851   8.746
    8    H    SER  11           H        SER  11  -4.675 -20.789   4.996
    9    HA   SER  11           HA       SER  11  -2.637 -18.922   4.028
   10   1HB   SER  11          1HB       SER  11  -5.580 -18.685   4.070
   11   2HB   SER  11          2HB       SER  11  -4.439 -17.917   2.945
   12    HG   SER  11           HG       SER  11  -4.358 -19.717   1.776
   13    H    SER  12           H        SER  12  -4.432 -19.247   6.809
   14    HA   SER  12           HA       SER  12  -4.656 -16.595   7.512
   15   1HB   SER  12          1HB       SER  12  -4.712 -17.865   9.796
   16   2HB   SER  12          2HB       SER  12  -5.952 -18.172   8.550
   17    HG   SER  12           HG       SER  12  -4.658 -20.040   9.605
   18    H    GLU  13           H        GLU  13  -2.018 -19.155   8.200
   19    HA   GLU  13           HA       GLU  13  -0.490 -17.213   9.470
   20   1HB   GLU  13          1HB       GLU  13   1.101 -19.028   9.688
   21   2HB   GLU  13          2HB       GLU  13  -0.499 -19.512  10.225
   22   1HG   GLU  13          1HG       GLU  13  -0.861 -20.597   8.055
   23   2HG   GLU  13          2HG       GLU  13   0.760 -20.169   7.582
   24    H    LEU  14           H        LEU  14  -0.661 -18.663   6.314
   25    HA   LEU  14           HA       LEU  14   1.864 -18.022   5.249
   26   1HB   LEU  14          1HB       LEU  14   0.013 -19.436   4.267
   27   2HB   LEU  14          2HB       LEU  14  -0.763 -17.952   3.816
   28    HG   LEU  14           HG       LEU  14   1.135 -17.326   2.385
   29   1HD1  LEU  14          1HD1      LEU  14   2.835 -19.001   1.815
   30   2HD1  LEU  14          2HD1      LEU  14   2.208 -20.056   3.082
   31   3HD1  LEU  14          3HD1      LEU  14   2.928 -18.502   3.501
   32   1HD2  LEU  14          1HD2      LEU  14  -0.780 -18.489   1.419
   33   2HD2  LEU  14          2HD2      LEU  14  -0.026 -20.042   1.779
   34   3HD2  LEU  14          3HD2      LEU  14   0.714 -18.955   0.605
   35    H    ALA  15           H        ALA  15  -0.909 -16.403   5.765
   36    HA   ALA  15           HA       ALA  15  -0.176 -14.069   4.247
   37   1HB   ALA  15          1HB       ALA  15  -2.464 -14.643   4.131
   38   2HB   ALA  15          2HB       ALA  15  -2.266 -13.064   4.892
   39   3HB   ALA  15          3HB       ALA  15  -2.619 -14.487   5.879
   40    H    LYS  16           H        LYS  16   0.146 -15.118   7.486
   41    HA   LYS  16           HA       LYS  16   0.272 -12.581   8.686
   42   1HB   LYS  16          1HB       LYS  16   1.739 -15.125   9.420
   43   2HB   LYS  16          2HB       LYS  16   1.763 -13.672  10.411
   44   1HG   LYS  16          1HG       LYS  16  -0.599 -13.825  10.776
   45   2HG   LYS  16          2HG       LYS  16  -0.727 -15.188   9.669
   46   1HD   LYS  16          1HD       LYS  16   0.745 -16.497  11.161
   47   2HD   LYS  16          2HD       LYS  16   0.797 -15.127  12.275
   48   1HE   LYS  16          1HE       LYS  16  -1.588 -15.272  12.618
   49   2HE   LYS  16          2HE       LYS  16  -1.711 -16.553  11.413
   50   1HZ   LYS  16          1HZ       LYS  16  -0.346 -17.957  12.850
   51   2HZ   LYS  16          2HZ       LYS  16  -1.727 -17.450  13.652
   52   3HZ   LYS  16          3HZ       LYS  16  -0.253 -16.735  13.996
   53    H    LYS  17           H        LYS  17   2.481 -14.545   6.934
   54    HA   LYS  17           HA       LYS  17   4.516 -12.558   7.076
   55   1HB   LYS  17          1HB       LYS  17   4.391 -15.086   5.439
   56   2HB   LYS  17          2HB       LYS  17   5.770 -13.995   5.493
   57   1HG   LYS  17          1HG       LYS  17   4.670 -15.714   7.695
   58   2HG   LYS  17          2HG       LYS  17   6.293 -15.732   6.998
   59   1HD   LYS  17          1HD       LYS  17   6.537 -13.348   7.877
   60   2HD   LYS  17          2HD       LYS  17   5.027 -13.644   8.739
   61   1HE   LYS  17          1HE       LYS  17   7.585 -15.212   9.083
   62   2HE   LYS  17          2HE       LYS  17   6.981 -13.977  10.172
   63   1HZ   LYS  17          1HZ       LYS  17   5.047 -15.389  10.623
   64   2HZ   LYS  17          2HZ       LYS  17   6.485 -16.184  10.975
   65   3HZ   LYS  17          3HZ       LYS  17   5.648 -16.564   9.577
   66    H    SER  18           H        SER  18   2.083 -13.590   4.688
   67    HA   SER  18           HA       SER  18   3.218 -12.018   2.695
   68   1HB   SER  18          1HB       SER  18   1.578 -13.913   2.253
   69   2HB   SER  18          2HB       SER  18   0.291 -12.820   2.761
   70    HG   SER  18           HG       SER  18   0.494 -11.673   0.912
   71    H    LYS  19           H        LYS  19   0.865 -11.184   5.202
   72    HA   LYS  19           HA       LYS  19   0.174  -8.663   4.027
   73   1HB   LYS  19          1HB       LYS  19   0.005  -9.356   6.977
   74   2HB   LYS  19          2HB       LYS  19  -0.810  -8.038   6.158
   75   1HG   LYS  19          1HG       LYS  19  -1.917 -10.029   4.795
   76   2HG   LYS  19          2HG       LYS  19  -1.465 -10.941   6.223
   77   1HD   LYS  19          1HD       LYS  19  -3.220  -8.485   6.140
   78   2HD   LYS  19          2HD       LYS  19  -3.749 -10.137   6.410
   79   1HE   LYS  19          1HE       LYS  19  -1.896  -8.583   8.198
   80   2HE   LYS  19          2HE       LYS  19  -3.630  -8.754   8.446
   81   1HZ   LYS  19          1HZ       LYS  19  -2.345 -10.296   9.810
   82   2HZ   LYS  19          2HZ       LYS  19  -1.694 -11.044   8.451
   83   3HZ   LYS  19          3HZ       LYS  19  -3.334 -11.140   8.759
   84    H    GLU  20           H        GLU  20   2.678  -9.662   6.312
   85    HA   GLU  20           HA       GLU  20   3.427  -6.937   6.635
   86   1HB   GLU  20          1HB       GLU  20   5.379  -7.698   7.850
   87   2HB   GLU  20          2HB       GLU  20   3.940  -8.515   8.417
   88   1HG   GLU  20          1HG       GLU  20   4.556 -10.520   7.342
   89   2HG   GLU  20          2HG       GLU  20   5.874  -9.726   6.476
   90    H    VAL  21           H        VAL  21   4.559  -9.555   4.536
   91    HA   VAL  21           HA       VAL  21   6.678  -8.018   3.432
   92    HB   VAL  21           HB       VAL  21   5.133 -10.338   2.212
   93   1HG1  VAL  21          1HG1      VAL  21   7.834  -9.186   1.492
   94   2HG1  VAL  21          2HG1      VAL  21   6.364  -9.014   0.541
   95   3HG1  VAL  21          3HG1      VAL  21   7.098 -10.607   0.752
   96   1HG2  VAL  21          1HG2      VAL  21   7.736 -10.319   3.729
   97   2HG2  VAL  21          2HG2      VAL  21   7.043 -11.719   2.909
   98   3HG2  VAL  21          3HG2      VAL  21   6.206 -10.998   4.286
   99    H    PHE  22           H        PHE  22   3.312  -8.542   2.373
  100    HA   PHE  22           HA       PHE  22   3.379  -6.876   0.124
  101   1HB   PHE  22          1HB       PHE  22   1.437  -8.142   0.276
  102   2HB   PHE  22          2HB       PHE  22   1.268  -7.852   2.001
  103    HD1  PHE  22           1HD      PHE  22  -0.412  -6.412   2.693
  104    HD2  PHE  22           2HD      PHE  22   1.124  -5.976  -1.236
  105    HE1  PHE  22           1HE      PHE  22  -2.021  -4.643   2.260
  106    HE2  PHE  22           2HE      PHE  22  -0.505  -4.193  -1.664
  107    HZ   PHE  22           HZ       PHE  22  -2.096  -3.536   0.087
  108    H    ARG  23           H        ARG  23   2.426  -6.125   3.431
  109    HA   ARG  23           HA       ARG  23   2.051  -3.401   2.823
  110   1HB   ARG  23          1HB       ARG  23   1.877  -2.873   5.171
  111   2HB   ARG  23          2HB       ARG  23   1.149  -4.446   4.864
  112   1HG   ARG  23          1HG       ARG  23   2.341  -5.305   6.470
  113   2HG   ARG  23          2HG       ARG  23   3.824  -4.927   5.580
  114   1HD   ARG  23          1HD       ARG  23   3.930  -4.006   7.810
  115   2HD   ARG  23          2HD       ARG  23   3.820  -2.695   6.634
  116    HE   ARG  23           HE       ARG  23   1.300  -2.880   7.257
  117   1HH1  ARG  23          1HH1      ARG  23   4.037  -3.194   9.498
  118   2HH1  ARG  23          2HH1      ARG  23   3.181  -2.558  10.820
  119   1HH2  ARG  23          1HH2      ARG  23   0.147  -1.984   9.137
  120   2HH2  ARG  23          2HH2      ARG  23   0.991  -1.866  10.621
  121    H    LYS  24           H        LYS  24   4.993  -5.120   3.598
  122    HA   LYS  24           HA       LYS  24   6.551  -2.818   4.119
  123   1HB   LYS  24          1HB       LYS  24   7.285  -5.093   4.756
  124   2HB   LYS  24          2HB       LYS  24   7.386  -5.534   3.064
  125   1HG   LYS  24          1HG       LYS  24   9.597  -5.140   4.018
  126   2HG   LYS  24          2HG       LYS  24   9.235  -3.969   2.751
  127   1HD   LYS  24          1HD       LYS  24   8.817  -2.251   4.341
  128   2HD   LYS  24          2HD       LYS  24   8.810  -3.403   5.677
  129   1HE   LYS  24          1HE       LYS  24  10.891  -2.118   5.621
  130   2HE   LYS  24          2HE       LYS  24  11.185  -3.829   5.340
  131   1HZ   LYS  24          1HZ       LYS  24  12.482  -2.509   3.899
  132   2HZ   LYS  24          2HZ       LYS  24  11.195  -1.667   3.269
  133   3HZ   LYS  24          3HZ       LYS  24  11.392  -3.332   2.942
  134    H    GLU  25           H        GLU  25   6.038  -4.763   1.110
  135    HA   GLU  25           HA       GLU  25   7.688  -2.979  -0.348
  136   1HB   GLU  25          1HB       GLU  25   6.381  -4.277  -2.250
  137   2HB   GLU  25          2HB       GLU  25   7.826  -4.972  -1.472
  138   1HG   GLU  25          1HG       GLU  25   6.161  -6.183  -0.044
  139   2HG   GLU  25          2HG       GLU  25   4.904  -5.528  -1.084
  140    H    MET  26           H        MET  26   4.297  -3.143   0.247
  141    HA   MET  26           HA       MET  26   3.750  -1.197  -1.742
  142   1HB   MET  26          1HB       MET  26   2.110  -2.799  -0.974
  143   2HB   MET  26          2HB       MET  26   2.151  -2.031   0.607
  144   1HG   MET  26          1HG       MET  26   0.219  -1.356  -0.997
  145   2HG   MET  26          2HG       MET  26   1.059  -0.114  -0.080
  146   1HE   MET  26          1HE       MET  26   0.114  -1.368  -3.665
  147   2HE   MET  26          2HE       MET  26   1.790  -1.973  -3.728
  148   3HE   MET  26          3HE       MET  26   1.289  -0.538  -4.661
  149    H    SER  27           H        SER  27   4.467  -1.077   1.632
  150    HA   SER  27           HA       SER  27   3.965   1.670   2.006
  151   1HB   SER  27          1HB       SER  27   6.065   0.004   3.440
  152   2HB   SER  27          2HB       SER  27   5.607   1.639   3.908
  153    HG   SER  27           HG       SER  27   3.974  -0.642   3.801
  154    H    GLN  28           H        GLN  28   6.707  -0.162   0.825
  155    HA   GLN  28           HA       GLN  28   8.374   2.123   0.530
  156   1HB   GLN  28          1HB       GLN  28   8.571  -0.537  -0.899
  157   2HB   GLN  28          2HB       GLN  28   9.825   0.691  -0.841
  158   1HG   GLN  28          1HG       GLN  28   8.762  -0.678   1.613
  159   2HG   GLN  28          2HG       GLN  28  10.089  -1.310   0.665
  160   1HE2  GLN  28          1HE2      GLN  28   9.805   2.179   1.179
  161   2HE2  GLN  28          2HE2      GLN  28  11.086   2.267   2.305
  162    H    PHE  29           H        PHE  29   6.355   0.332  -1.692
  163    HA   PHE  29           HA       PHE  29   6.845   1.809  -3.978
  164   1HB   PHE  29          1HB       PHE  29   5.645  -0.336  -3.984
  165   2HB   PHE  29          2HB       PHE  29   4.315   0.397  -3.109
  166    HD1  PHE  29           1HD      PHE  29   6.049   0.194  -6.324
  167    HD2  PHE  29           2HD      PHE  29   2.683   1.685  -4.218
  168    HE1  PHE  29           1HE      PHE  29   4.931   0.693  -8.454
  169    HE2  PHE  29           2HE      PHE  29   1.566   2.189  -6.344
  170    HZ   PHE  29           HZ       PHE  29   2.661   1.691  -8.431
  171    H    ILE  30           H        ILE  30   4.330   2.253  -1.525
  172    HA   ILE  30           HA       ILE  30   3.228   4.577  -2.614
  173    HB   ILE  30           HB       ILE  30   3.174   3.492   0.201
  174   1HG1  ILE  30          1HG1      ILE  30   1.009   3.735  -1.885
  175   2HG1  ILE  30          2HG1      ILE  30   2.019   2.313  -1.685
  176   1HG2  ILE  30          1HG2      ILE  30   1.453   5.167   0.735
  177   2HG2  ILE  30          2HG2      ILE  30   1.657   5.879  -0.875
  178   3HG2  ILE  30          3HG2      ILE  30   2.973   5.955   0.278
  179   1HD1  ILE  30          1HD1      ILE  30  -0.147   2.025  -0.612
  180   2HD1  ILE  30          2HD1      ILE  30   0.152   3.427   0.407
  181   3HD1  ILE  30          3HD1      ILE  30   1.156   2.000   0.551
  182    H    VAL  31           H        VAL  31   5.726   4.157  -0.089
  183    HA   VAL  31           HA       VAL  31   6.252   6.813   0.354
  184    HB   VAL  31           HB       VAL  31   8.041   4.383   0.343
  185   1HG1  VAL  31          1HG1      VAL  31   9.894   5.678   1.282
  186   2HG1  VAL  31          2HG1      VAL  31   8.958   7.157   1.150
  187   3HG1  VAL  31          3HG1      VAL  31   9.488   6.322  -0.314
  188   1HG2  VAL  31          1HG2      VAL  31   8.088   4.801   2.765
  189   2HG2  VAL  31          2HG2      VAL  31   6.430   4.693   2.156
  190   3HG2  VAL  31          3HG2      VAL  31   7.124   6.259   2.521
  191    H    GLN  32           H        GLN  32   7.565   4.780  -2.228
  192    HA   GLN  32           HA       GLN  32   9.171   6.539  -3.483
  193   1HB   GLN  32          1HB       GLN  32   9.064   4.194  -3.921
  194   2HB   GLN  32          2HB       GLN  32   7.442   4.334  -4.547
  195   1HG   GLN  32          1HG       GLN  32   8.286   5.624  -6.417
  196   2HG   GLN  32          2HG       GLN  32   9.932   5.424  -5.792
  197   1HE2  GLN  32          1HE2      GLN  32  10.855   3.384  -5.801
  198   2HE2  GLN  32          2HE2      GLN  32  10.234   2.074  -6.734
  199    H    CYS  33           H        CYS  33   5.761   5.830  -3.915
  200    HA   CYS  33           HA       CYS  33   5.150   7.526  -6.054
  201   1HB   CYS  33          1HB       CYS  33   3.489   6.344  -3.885
  202   2HB   CYS  33          2HB       CYS  33   2.788   7.199  -5.271
  203    HG   CYS  33           HG       CYS  33   4.400   4.234  -5.111
  204    H    LEU  34           H        LEU  34   5.035   8.004  -2.596
  205    HA   LEU  34           HA       LEU  34   3.879  10.613  -2.819
  206   1HB   LEU  34          1HB       LEU  34   5.047   9.208  -0.450
  207   2HB   LEU  34          2HB       LEU  34   4.365  10.815  -0.378
  208    HG   LEU  34           HG       LEU  34   2.899   8.264  -1.020
  209   1HD1  LEU  34          1HD1      LEU  34   3.480   8.545   1.312
  210   2HD1  LEU  34          2HD1      LEU  34   1.745   8.764   1.079
  211   3HD1  LEU  34          3HD1      LEU  34   2.789  10.163   1.312
  212   1HD2  LEU  34          1HD2      LEU  34   0.872   9.675  -1.005
  213   2HD2  LEU  34          2HD2      LEU  34   1.946  10.081  -2.335
  214   3HD2  LEU  34          3HD2      LEU  34   1.887  11.115  -0.906
  215    H    ASN  35           H        ASN  35   7.144   9.430  -2.650
  216    HA   ASN  35           HA       ASN  35   8.620  11.409  -1.877
  217   1HB   ASN  35          1HB       ASN  35   9.022   9.467  -3.933
  218   2HB   ASN  35          2HB       ASN  35  10.019  10.928  -4.160
  219   1HD2  ASN  35          1HD2      ASN  35   8.914   8.652  -1.828
  220   2HD2  ASN  35          2HD2      ASN  35  10.230   8.884  -0.779
  221    HA   PRO  36           HA       PRO  36   8.270  14.247  -5.832
  222   1HB   PRO  36          1HB       PRO  36   6.015  13.990  -7.347
  223   2HB   PRO  36          2HB       PRO  36   7.518  13.139  -7.710
  224   1HG   PRO  36          1HG       PRO  36   5.094  12.140  -6.285
  225   2HG   PRO  36          2HG       PRO  36   6.063  11.343  -7.536
  226   1HD   PRO  36          1HD       PRO  36   6.324  10.771  -4.934
  227   2HD   PRO  36          2HD       PRO  36   7.719  10.727  -6.017
  228    H    TYR  37           H        TYR  37   5.727  13.345  -3.740
  229    HA   TYR  37           HA       TYR  37   4.287  15.823  -4.071
  230   1HB   TYR  37          1HB       TYR  37   3.850  13.506  -2.195
  231   2HB   TYR  37          2HB       TYR  37   2.832  14.941  -2.248
  232    HD1  TYR  37           1HD      TYR  37   3.945  12.011  -4.160
  233    HD2  TYR  37           2HD      TYR  37   1.183  15.202  -3.911
  234    HE1  TYR  37           1HE      TYR  37   2.625  10.959  -5.899
  235    HE2  TYR  37           2HE      TYR  37  -0.174  14.202  -5.666
  236    HH   TYR  37           HH       TYR  37   0.064  12.595  -7.494
  237    H    ARG  38           H        ARG  38   6.696  14.515  -2.020
  238    HA   ARG  38           HA       ARG  38   6.266  16.610  -0.045
  239   1HB   ARG  38          1HB       ARG  38   8.107  15.624   1.187
  240   2HB   ARG  38          2HB       ARG  38   6.919  14.409   0.744
  241   1HG   ARG  38          1HG       ARG  38   8.292  13.651  -1.045
  242   2HG   ARG  38          2HG       ARG  38   9.467  14.915  -0.729
  243   1HD   ARG  38          1HD       ARG  38   9.774  14.034   1.552
  244   2HD   ARG  38          2HD       ARG  38   8.591  12.774   1.178
  245    HE   ARG  38           HE       ARG  38  10.606  12.529  -0.675
  246   1HH1  ARG  38          1HH1      ARG  38  10.480  12.539   2.843
  247   2HH1  ARG  38          2HH1      ARG  38  11.603  11.296   3.069
  248   1HH2  ARG  38          1HH2      ARG  38  12.174  10.793  -0.414
  249   2HH2  ARG  38          2HH2      ARG  38  12.633  10.288   1.147
  250    H    LYS  39           H        LYS  39   7.553  16.536  -2.923
  251    HA   LYS  39           HA       LYS  39   9.975  18.044  -2.624
  252   1HB   LYS  39          1HB       LYS  39   8.090  17.762  -4.976
  253   2HB   LYS  39          2HB       LYS  39   9.684  18.492  -5.038
  254   1HG   LYS  39          1HG       LYS  39   9.095  15.635  -4.354
  255   2HG   LYS  39          2HG       LYS  39   9.675  16.225  -5.916
  256   1HD   LYS  39          1HD       LYS  39  11.708  17.019  -4.884
  257   2HD   LYS  39          2HD       LYS  39  11.106  16.545  -3.294
  258   1HE   LYS  39          1HE       LYS  39  11.013  14.284  -3.946
  259   2HE   LYS  39          2HE       LYS  39  11.549  14.664  -5.583
  260   1HZ   LYS  39          1HZ       LYS  39  13.414  13.876  -4.262
  261   2HZ   LYS  39          2HZ       LYS  39  13.126  15.055  -3.090
  262   3HZ   LYS  39          3HZ       LYS  39  13.649  15.512  -4.614
  263    HA   PRO  40           HA       PRO  40   8.005  21.877  -1.642
  264   1HB   PRO  40          1HB       PRO  40   9.880  23.588  -2.658
  265   2HB   PRO  40          2HB       PRO  40   9.986  22.806  -1.081
  266   1HG   PRO  40          1HG       PRO  40  11.279  22.044  -3.664
  267   2HG   PRO  40          2HG       PRO  40  11.950  22.002  -2.024
  268   1HD   PRO  40          1HD       PRO  40  11.097  19.781  -3.269
  269   2HD   PRO  40          2HD       PRO  40  10.905  20.004  -1.516
  270    H    ASP  41           H        ASP  41   8.757  20.953  -4.887
  271    HA   ASP  41           HA       ASP  41   7.361  23.288  -5.940
  272   1HB   ASP  41          1HB       ASP  41   9.592  22.619  -6.909
  273   2HB   ASP  41          2HB       ASP  41   8.831  21.141  -7.487
  274    H    CYS  42           H        CYS  42   6.502  20.572  -4.680
  275    HA   CYS  42           HA       CYS  42   4.791  19.396  -6.636
  276   1HB   CYS  42          1HB       CYS  42   5.420  18.181  -4.538
  277   2HB   CYS  42          2HB       CYS  42   4.455  19.337  -3.634
  278    HG   CYS  42           HG       CYS  42   2.594  17.520  -3.597
  279    H    LYS  43           H        LYS  43   2.776  19.871  -7.185
  280    HA   LYS  43           HA       LYS  43   1.753  22.433  -6.215
  281   1HB   LYS  43          1HB       LYS  43   1.304  20.969  -8.790
  282   2HB   LYS  43          2HB       LYS  43   0.604  22.540  -8.389
  283   1HG   LYS  43          1HG       LYS  43   2.776  23.541  -8.243
  284   2HG   LYS  43          2HG       LYS  43   3.559  21.982  -8.461
  285   1HD   LYS  43          1HD       LYS  43   2.606  21.874 -10.725
  286   2HD   LYS  43          2HD       LYS  43   1.894  23.475 -10.471
  287   1HE   LYS  43          1HE       LYS  43   4.040  23.604 -11.693
  288   2HE   LYS  43          2HE       LYS  43   4.096  24.442 -10.144
  289   1HZ   LYS  43          1HZ       LYS  43   5.162  21.722 -10.689
  290   2HZ   LYS  43          2HZ       LYS  43   5.243  22.499  -9.197
  291   3HZ   LYS  43          3HZ       LYS  43   6.094  23.104 -10.497
  292    H    VAL  44           H        VAL  44   1.031  19.092  -6.511
  293    HA   VAL  44           HA       VAL  44  -1.510  19.698  -5.250
  294    HB   VAL  44           HB       VAL  44  -2.040  19.130  -7.557
  295   1HG1  VAL  44          1HG1      VAL  44  -0.720  16.487  -7.082
  296   2HG1  VAL  44          2HG1      VAL  44  -0.187  17.759  -8.183
  297   3HG1  VAL  44          3HG1      VAL  44  -1.701  16.904  -8.487
  298   1HG2  VAL  44          1HG2      VAL  44  -3.661  18.551  -5.871
  299   2HG2  VAL  44          2HG2      VAL  44  -2.876  16.994  -5.616
  300   3HG2  VAL  44          3HG2      VAL  44  -3.670  17.338  -7.152
  301    H    GLY  45           H        GLY  45  -1.629  18.955  -3.384
  302   1HA   GLY  45          1HA       GLY  45  -1.483  17.567  -1.562
  303   2HA   GLY  45          2HA       GLY  45  -1.065  16.252  -2.655
  304    H    ARG  46           H        ARG  46   0.694  19.413  -1.897
  305    HA   ARG  46           HA       ARG  46   3.124  18.025  -1.882
  306   1HB   ARG  46          1HB       ARG  46   2.859  20.367  -2.635
  307   2HB   ARG  46          2HB       ARG  46   2.420  20.822  -0.998
  308   1HG   ARG  46          1HG       ARG  46   4.591  20.348  -0.176
  309   2HG   ARG  46          2HG       ARG  46   5.078  19.582  -1.685
  310   1HD   ARG  46          1HD       ARG  46   6.017  21.794  -1.580
  311   2HD   ARG  46          2HD       ARG  46   4.777  21.754  -2.830
  312    HE   ARG  46           HE       ARG  46   4.211  22.747  -0.145
  313   1HH1  ARG  46          1HH1      ARG  46   4.293  23.330  -3.639
  314   2HH1  ARG  46          2HH1      ARG  46   3.538  24.843  -3.556
  315   1HH2  ARG  46          1HH2      ARG  46   3.155  24.808  -0.016
  316   2HH2  ARG  46          2HH2      ARG  46   2.830  25.697  -1.430
  317    H    ILE  47           H        ILE  47   3.910  16.939  -0.334
  318    HA   ILE  47           HA       ILE  47   2.727  16.941   2.273
  319    HB   ILE  47           HB       ILE  47   5.165  15.348   1.376
  320   1HG1  ILE  47          1HG1      ILE  47   2.220  14.607   1.491
  321   2HG1  ILE  47          2HG1      ILE  47   3.157  14.904   0.028
  322   1HG2  ILE  47          1HG2      ILE  47   4.631  13.949   3.251
  323   2HG2  ILE  47          2HG2      ILE  47   3.473  15.145   3.831
  324   3HG2  ILE  47          3HG2      ILE  47   5.173  15.555   3.690
  325   1HD1  ILE  47          1HD1      ILE  47   3.717  12.727   2.003
  326   2HD1  ILE  47          2HD1      ILE  47   4.507  12.984   0.438
  327   3HD1  ILE  47          3HD1      ILE  47   2.804  12.529   0.508
  328    H    THR  48           H        THR  48   3.163  18.171   3.768
  329    HA   THR  48           HA       THR  48   5.047  20.156   3.879
  330    HB   THR  48           HB       THR  48   4.274  20.106   6.321
  331    HG1  THR  48           1HG      THR  48   2.963  18.432   6.834
  332   1HG2  THR  48          1HG2      THR  48   3.367  21.536   4.561
  333   2HG2  THR  48          2HG2      THR  48   2.085  20.923   5.642
  334   3HG2  THR  48          3HG2      THR  48   2.363  20.168   4.057
  335    H    THR  49           H        THR  49   4.834  17.265   5.874
  336    HA   THR  49           HA       THR  49   7.633  17.770   6.686
  337    HB   THR  49           HB       THR  49   5.641  16.495   8.524
  338    HG1  THR  49           1HG      THR  49   4.538  18.256   8.415
  339   1HG2  THR  49          1HG2      THR  49   8.008  16.558   9.173
  340   2HG2  THR  49          2HG2      THR  49   7.043  17.577  10.241
  341   3HG2  THR  49          3HG2      THR  49   8.024  18.311   8.976
  342    H    THR  50           H        THR  50   8.839  15.939   7.161
  343    HA   THR  50           HA       THR  50   8.499  13.583   5.750
  344    HB   THR  50           HB       THR  50  10.536  14.441   6.585
  345    HG1  THR  50           1HG      THR  50  11.401  12.406   7.446
  346   1HG2  THR  50          1HG2      THR  50   9.622  13.635   9.328
  347   2HG2  THR  50          2HG2      THR  50   9.839  15.270   8.731
  348   3HG2  THR  50          3HG2      THR  50  11.253  14.215   8.941
  349    H    GLU  51           H        GLU  51   7.682  14.410   9.070
  350    HA   GLU  51           HA       GLU  51   6.668  11.902   9.845
  351   1HB   GLU  51          1HB       GLU  51   5.939  14.654  10.832
  352   2HB   GLU  51          2HB       GLU  51   5.475  13.154  11.621
  353   1HG   GLU  51          1HG       GLU  51   8.269  14.197  11.223
  354   2HG   GLU  51          2HG       GLU  51   7.380  14.101  12.743
  355    H    ASP  52           H        ASP  52   5.127  14.560   8.036
  356    HA   ASP  52           HA       ASP  52   2.519  13.435   8.120
  357   1HB   ASP  52          1HB       ASP  52   3.953  15.561   6.584
  358   2HB   ASP  52          2HB       ASP  52   2.338  15.063   6.139
  359    H    PHE  53           H        PHE  53   5.291  13.406   5.991
  360    HA   PHE  53           HA       PHE  53   4.172  12.039   3.865
  361   1HB   PHE  53          1HB       PHE  53   6.380  13.152   3.739
  362   2HB   PHE  53          2HB       PHE  53   6.981  12.105   5.006
  363    HD1  PHE  53           1HD      PHE  53   6.120  12.373   1.501
  364    HD2  PHE  53           2HD      PHE  53   7.642   9.850   4.539
  365    HE1  PHE  53           1HE      PHE  53   6.949  10.828  -0.207
  366    HE2  PHE  53           2HE      PHE  53   8.463   8.292   2.858
  367    HZ   PHE  53           HZ       PHE  53   8.122   8.797   0.444
  368    H    LYS  54           H        LYS  54   5.918  10.919   6.645
  369    HA   LYS  54           HA       LYS  54   5.787   8.103   6.284
  370   1HB   LYS  54          1HB       LYS  54   6.101   9.834   8.724
  371   2HB   LYS  54          2HB       LYS  54   6.168   8.078   8.786
  372   1HG   LYS  54          1HG       LYS  54   8.130   7.986   7.504
  373   2HG   LYS  54          2HG       LYS  54   7.931   9.638   6.931
  374   1HD   LYS  54          1HD       LYS  54   9.722   9.463   8.584
  375   2HD   LYS  54          2HD       LYS  54   8.407  10.490   9.146
  376   1HE   LYS  54          1HE       LYS  54   7.555   8.620  10.503
  377   2HE   LYS  54          2HE       LYS  54   8.905   7.624   9.959
  378   1HZ   LYS  54          1HZ       LYS  54   9.245   8.678  12.154
  379   2HZ   LYS  54          2HZ       LYS  54   9.214  10.196  11.405
  380   3HZ   LYS  54          3HZ       LYS  54  10.434   9.101  11.034
  381    H    HIS  55           H        HIS  55   3.567  10.344   7.953
  382    HA   HIS  55           HA       HIS  55   1.817   8.317   8.989
  383   1HB   HIS  55          1HB       HIS  55   1.932  10.714   9.820
  384   2HB   HIS  55          2HB       HIS  55   1.294  11.200   8.284
  385    HD1  HIS  55           1HD      HIS  55   0.131   9.276  11.358
  386    HD2  HIS  55           2HD      HIS  55  -1.472  11.178   8.006
  387    HE1  HIS  55           1HE      HIS  55  -2.326   9.325  11.729
  388    H    LEU  56           H        LEU  56   1.753  10.320   6.114
  389    HA   LEU  56           HA       LEU  56  -0.710   9.212   5.201
  390   1HB   LEU  56          1HB       LEU  56   0.890  11.333   4.466
  391   2HB   LEU  56          2HB       LEU  56   1.069  10.200   3.152
  392    HG   LEU  56           HG       LEU  56  -1.129  11.881   4.016
  393   1HD1  LEU  56          1HD1      LEU  56   0.144  12.412   2.124
  394   2HD1  LEU  56          2HD1      LEU  56  -1.534  12.161   1.704
  395   3HD1  LEU  56          3HD1      LEU  56  -0.333  10.917   1.320
  396   1HD2  LEU  56          1HD2      LEU  56  -2.266   9.765   4.408
  397   2HD2  LEU  56          2HD2      LEU  56  -1.798   9.191   2.805
  398   3HD2  LEU  56          3HD2      LEU  56  -2.894  10.554   2.994
  399    H    ALA  57           H        ALA  57   2.711   8.457   4.377
  400    HA   ALA  57           HA       ALA  57   2.079   6.590   2.424
  401   1HB   ALA  57          1HB       ALA  57   4.438   6.505   4.317
  402   2HB   ALA  57          2HB       ALA  57   4.379   7.458   2.839
  403   3HB   ALA  57          3HB       ALA  57   4.328   5.697   2.755
  404    H    ARG  58           H        ARG  58   2.357   6.239   5.858
  405    HA   ARG  58           HA       ARG  58   2.003   3.390   5.754
  406   1HB   ARG  58          1HB       ARG  58   1.728   3.406   8.210
  407   2HB   ARG  58          2HB       ARG  58   3.123   4.351   7.715
  408   1HG   ARG  58          1HG       ARG  58   1.871   6.387   8.057
  409   2HG   ARG  58          2HG       ARG  58   0.456   5.443   8.517
  410   1HD   ARG  58          1HD       ARG  58   3.115   5.373   9.930
  411   2HD   ARG  58          2HD       ARG  58   1.726   6.327  10.455
  412    HE   ARG  58           HE       ARG  58   1.153   3.546  10.113
  413   1HH1  ARG  58          1HH1      ARG  58   2.464   5.906  12.409
  414   2HH1  ARG  58          2HH1      ARG  58   1.983   5.034  13.785
  415   1HH2  ARG  58          1HH2      ARG  58   0.530   2.354  12.008
  416   2HH2  ARG  58          2HH2      ARG  58   0.846   2.973  13.561
  417    H    LYS  59           H        LYS  59  -0.202   6.079   6.329
  418    HA   LYS  59           HA       LYS  59  -2.526   4.662   6.878
  419   1HB   LYS  59          1HB       LYS  59  -2.472   7.061   7.154
  420   2HB   LYS  59          2HB       LYS  59  -2.140   7.294   5.438
  421   1HG   LYS  59          1HG       LYS  59  -4.342   6.149   4.992
  422   2HG   LYS  59          2HG       LYS  59  -4.661   6.302   6.713
  423   1HD   LYS  59          1HD       LYS  59  -4.680   8.676   6.575
  424   2HD   LYS  59          2HD       LYS  59  -4.034   8.645   4.925
  425   1HE   LYS  59          1HE       LYS  59  -6.016   7.409   4.196
  426   2HE   LYS  59          2HE       LYS  59  -6.673   7.533   5.819
  427   1HZ   LYS  59          1HZ       LYS  59  -6.920   9.876   5.560
  428   2HZ   LYS  59          2HZ       LYS  59  -7.541   9.134   4.204
  429   3HZ   LYS  59          3HZ       LYS  59  -6.042   9.888   4.117
  430    H    LEU  60           H        LEU  60  -1.214   5.760   3.770
  431    HA   LEU  60           HA       LEU  60  -3.356   4.946   2.279
  432   1HB   LEU  60          1HB       LEU  60  -0.515   5.392   1.469
  433   2HB   LEU  60          2HB       LEU  60  -1.832   5.266   0.292
  434    HG   LEU  60           HG       LEU  60  -1.929   7.166   2.548
  435   1HD1  LEU  60          1HD1      LEU  60   0.064   7.787   1.420
  436   2HD1  LEU  60          2HD1      LEU  60  -1.168   8.934   0.868
  437   3HD1  LEU  60          3HD1      LEU  60  -0.658   7.603  -0.162
  438   1HD2  LEU  60          1HD2      LEU  60  -3.988   6.707   1.460
  439   2HD2  LEU  60          2HD2      LEU  60  -3.283   7.052  -0.122
  440   3HD2  LEU  60          3HD2      LEU  60  -3.497   8.356   1.055
  441    H    THR  61           H        THR  61  -0.292   3.446   3.009
  442    HA   THR  61           HA       THR  61  -0.440   1.046   1.572
  443    HB   THR  61           HB       THR  61   0.624   1.403   4.391
  444    HG1  THR  61           1HG      THR  61   1.694   2.833   2.994
  445   1HG2  THR  61          1HG2      THR  61   0.347  -0.954   3.732
  446   2HG2  THR  61          2HG2      THR  61   2.050  -0.519   3.856
  447   3HG2  THR  61          3HG2      THR  61   1.289  -0.654   2.270
  448    H    HIS  62           H        HIS  62  -1.758   2.009   4.618
  449    HA   HIS  62           HA       HIS  62  -2.843  -0.561   5.226
  450   1HB   HIS  62          1HB       HIS  62  -2.157   1.135   6.941
  451   2HB   HIS  62          2HB       HIS  62  -3.498   2.135   6.420
  452    HD1  HIS  62           1HD      HIS  62  -2.662  -0.860   8.480
  453    HD2  HIS  62           2HD      HIS  62  -6.022   1.349   7.418
  454    HE1  HIS  62           1HE      HIS  62  -4.456  -1.624  10.019
  455    H    GLY  63           H        GLY  63  -4.124   2.272   3.550
  456   1HA   GLY  63          1HA       GLY  63  -6.819   1.353   3.684
  457   2HA   GLY  63          2HA       GLY  63  -6.253   2.682   2.710
  458    H    VAL  64           H        VAL  64  -4.228   1.148   1.258
  459    HA   VAL  64           HA       VAL  64  -5.862  -0.011  -0.850
  460    HB   VAL  64           HB       VAL  64  -2.869  -0.334  -0.316
  461   1HG1  VAL  64          1HG1      VAL  64  -4.405  -0.956  -2.873
  462   2HG1  VAL  64          2HG1      VAL  64  -3.721  -2.151  -1.797
  463   3HG1  VAL  64          3HG1      VAL  64  -2.670  -1.083  -2.689
  464   1HG2  VAL  64          1HG2      VAL  64  -3.447   1.993  -0.724
  465   2HG2  VAL  64          2HG2      VAL  64  -4.309   1.534  -2.195
  466   3HG2  VAL  64          3HG2      VAL  64  -2.562   1.331  -2.102
  467    H    MET  65           H        MET  65  -4.148  -1.077   1.732
  468    HA   MET  65           HA       MET  65  -4.144  -3.896   1.362
  469   1HB   MET  65          1HB       MET  65  -2.636  -2.884   2.980
  470   2HB   MET  65          2HB       MET  65  -3.986  -2.255   3.882
  471   1HG   MET  65          1HG       MET  65  -4.656  -4.417   4.540
  472   2HG   MET  65          2HG       MET  65  -3.337  -5.152   3.632
  473   1HE   MET  65          1HE       MET  65  -4.064  -5.249   6.732
  474   2HE   MET  65          2HE       MET  65  -2.450  -5.336   7.475
  475   3HE   MET  65          3HE       MET  65  -2.822  -6.293   6.013
  476    H    ASN  66           H        ASN  66  -6.250  -1.812   3.268
  477    HA   ASN  66           HA       ASN  66  -8.037  -3.857   4.088
  478   1HB   ASN  66          1HB       ASN  66  -7.850  -0.945   4.261
  479   2HB   ASN  66          2HB       ASN  66  -9.489  -1.541   4.355
  480   1HD2  ASN  66          1HD2      ASN  66  -6.400  -1.303   5.786
  481   2HD2  ASN  66          2HD2      ASN  66  -6.824  -1.946   7.343
  482    H    LYS  67           H        LYS  67  -8.136  -1.616   1.410
  483    HA   LYS  67           HA       LYS  67 -10.724  -2.347   0.611
  484   1HB   LYS  67          1HB       LYS  67  -8.472  -1.128  -0.989
  485   2HB   LYS  67          2HB       LYS  67 -10.113  -1.326  -1.591
  486   1HG   LYS  67          1HG       LYS  67 -10.964   0.134   0.157
  487   2HG   LYS  67          2HG       LYS  67  -9.346   0.282   0.840
  488   1HD   LYS  67          1HD       LYS  67  -8.576   1.342  -1.233
  489   2HD   LYS  67          2HD       LYS  67 -10.201   1.195  -1.908
  490   1HE   LYS  67          1HE       LYS  67  -9.469   2.765   0.570
  491   2HE   LYS  67          2HE       LYS  67  -9.743   3.456  -1.026
  492   1HZ   LYS  67          1HZ       LYS  67 -12.019   2.582  -0.928
  493   2HZ   LYS  67          2HZ       LYS  67 -11.701   3.694   0.282
  494   3HZ   LYS  67          3HZ       LYS  67 -11.772   2.057   0.661
  495    H    GLU  68           H        GLU  68  -7.521  -3.654  -0.362
  496    HA   GLU  68           HA       GLU  68  -8.903  -5.361  -2.109
  497   1HB   GLU  68          1HB       GLU  68  -6.739  -6.377  -2.543
  498   2HB   GLU  68          2HB       GLU  68  -6.833  -4.617  -2.734
  499   1HG   GLU  68          1HG       GLU  68  -5.663  -4.313  -0.653
  500   2HG   GLU  68          2HG       GLU  68  -5.473  -6.059  -0.464
  501    H    LEU  69           H        LEU  69  -7.527  -5.776   1.120
  502    HA   LEU  69           HA       LEU  69  -8.222  -8.436   1.315
  503   1HB   LEU  69          1HB       LEU  69  -8.123  -6.264   3.378
  504   2HB   LEU  69          2HB       LEU  69  -8.590  -7.895   3.802
  505    HG   LEU  69           HG       LEU  69  -5.954  -7.133   2.568
  506   1HD1  LEU  69          1HD1      LEU  69  -6.178  -6.230   4.816
  507   2HD1  LEU  69          2HD1      LEU  69  -5.023  -7.555   4.776
  508   3HD1  LEU  69          3HD1      LEU  69  -6.646  -7.821   5.425
  509   1HD2  LEU  69          1HD2      LEU  69  -6.567  -9.397   2.018
  510   2HD2  LEU  69          2HD2      LEU  69  -7.033  -9.710   3.686
  511   3HD2  LEU  69          3HD2      LEU  69  -5.343  -9.438   3.290
  512    H    LYS  70           H        LYS  70 -10.419  -5.652   1.282
  513    HA   LYS  70           HA       LYS  70 -12.475  -7.376   2.270
  514   1HB   LYS  70          1HB       LYS  70 -13.920  -5.511   2.326
  515   2HB   LYS  70          2HB       LYS  70 -12.347  -4.974   2.890
  516   1HG   LYS  70          1HG       LYS  70 -11.921  -4.017   0.680
  517   2HG   LYS  70          2HG       LYS  70 -13.547  -4.480   0.213
  518   1HD   LYS  70          1HD       LYS  70 -12.868  -2.598   2.448
  519   2HD   LYS  70          2HD       LYS  70 -13.345  -2.161   0.795
  520   1HE   LYS  70          1HE       LYS  70 -15.294  -1.885   2.162
  521   2HE   LYS  70          2HE       LYS  70 -15.534  -3.347   1.221
  522   1HZ   LYS  70          1HZ       LYS  70 -15.018  -4.663   3.219
  523   2HZ   LYS  70          2HZ       LYS  70 -16.219  -3.545   3.576
  524   3HZ   LYS  70          3HZ       LYS  70 -14.641  -3.245   4.050
  525    H    TYR  71           H        TYR  71 -11.224  -6.381  -0.785
  526    HA   TYR  71           HA       TYR  71 -13.558  -7.483  -2.195
  527   1HB   TYR  71          1HB       TYR  71 -11.074  -6.075  -3.168
  528   2HB   TYR  71          2HB       TYR  71 -12.249  -6.802  -4.260
  529    HD1  TYR  71           1HD      TYR  71 -12.323  -4.349  -5.124
  530    HD2  TYR  71           2HD      TYR  71 -13.763  -5.527  -1.317
  531    HE1  TYR  71           1HE      TYR  71 -13.733  -2.331  -5.012
  532    HE2  TYR  71           2HE      TYR  71 -15.109  -3.626  -1.149
  533    HH   TYR  71           HH       TYR  71 -15.321  -1.392  -2.100
  534    H    CYS  72           H        CYS  72 -10.321  -8.411  -1.486
  535    HA   CYS  72           HA       CYS  72 -10.410 -10.730  -3.226
  536   1HB   CYS  72          1HB       CYS  72  -8.396  -9.609  -1.301
  537   2HB   CYS  72          2HB       CYS  72  -8.098 -11.130  -2.123
  538    HG   CYS  72           HG       CYS  72  -7.061 -10.012  -4.214
  539    H    LYS  73           H        LYS  73 -10.618  -9.885   0.142
  540    HA   LYS  73           HA       LYS  73 -11.278 -10.840   1.977
  541   1HB   LYS  73          1HB       LYS  73 -12.435 -13.042   0.261
  542   2HB   LYS  73          2HB       LYS  73 -12.708 -12.893   1.987
  543   1HG   LYS  73          1HG       LYS  73 -14.624 -11.890   1.229
  544   2HG   LYS  73          2HG       LYS  73 -13.555 -10.485   1.253
  545   1HD   LYS  73          1HD       LYS  73 -13.073 -10.839  -1.142
  546   2HD   LYS  73          2HD       LYS  73 -14.208 -12.187  -1.153
  547   1HE   LYS  73          1HE       LYS  73 -14.859  -9.295  -0.567
  548   2HE   LYS  73          2HE       LYS  73 -15.252 -10.172  -2.039
  549   1HZ   LYS  73          1HZ       LYS  73 -17.155 -10.021  -0.618
  550   2HZ   LYS  73          2HZ       LYS  73 -16.330 -10.700   0.675
  551   3HZ   LYS  73          3HZ       LYS  73 -16.675 -11.634  -0.695
  552    H    ASN  74           H        ASN  74  -9.657 -13.129  -0.095
  553    HA   ASN  74           HA       ASN  74  -8.376 -14.197   2.293
  554   1HB   ASN  74          1HB       ASN  74  -7.462 -16.015   0.854
  555   2HB   ASN  74          2HB       ASN  74  -9.215 -15.990   0.876
  556   1HD2  ASN  74          1HD2      ASN  74 -10.307 -15.493  -0.987
  557   2HD2  ASN  74          2HD2      ASN  74  -9.548 -15.428  -2.531
  558    HA   PRO  75           HA       PRO  75  -4.895 -11.656   1.341
  559   1HB   PRO  75          1HB       PRO  75  -3.259 -12.695   3.049
  560   2HB   PRO  75          2HB       PRO  75  -4.441 -11.402   3.349
  561   1HG   PRO  75          1HG       PRO  75  -4.540 -14.376   4.072
  562   2HG   PRO  75          2HG       PRO  75  -5.237 -13.037   5.004
  563   1HD   PRO  75          1HD       PRO  75  -6.629 -14.730   3.377
  564   2HD   PRO  75          2HD       PRO  75  -7.158 -13.080   3.775
  565    H    GLU  76           H        GLU  76  -5.060 -14.864   0.882
  566    HA   GLU  76           HA       GLU  76  -2.391 -15.409   0.155
  567   1HB   GLU  76          1HB       GLU  76  -4.214 -17.117   0.638
  568   2HB   GLU  76          2HB       GLU  76  -4.867 -16.747  -0.950
  569   1HG   GLU  76          1HG       GLU  76  -2.844 -17.536  -2.005
  570   2HG   GLU  76          2HG       GLU  76  -2.100 -17.804  -0.431
  571    H    ASP  77           H        ASP  77  -4.541 -13.339  -1.007
  572    HA   ASP  77           HA       ASP  77  -3.224 -13.172  -3.668
  573   1HB   ASP  77          1HB       ASP  77  -5.641 -13.826  -3.890
  574   2HB   ASP  77          2HB       ASP  77  -6.064 -12.356  -3.018
  575    H    LEU  78           H        LEU  78  -3.248 -11.912  -0.724
  576    HA   LEU  78           HA       LEU  78  -3.315  -9.130  -1.386
  577   1HB   LEU  78          1HB       LEU  78  -4.185  -9.988   0.728
  578   2HB   LEU  78          2HB       LEU  78  -2.601 -10.714   1.036
  579    HG   LEU  78           HG       LEU  78  -1.725  -8.480   0.913
  580   1HD1  LEU  78          1HD1      LEU  78  -3.313  -6.638   1.624
  581   2HD1  LEU  78          2HD1      LEU  78  -4.628  -7.756   1.248
  582   3HD1  LEU  78          3HD1      LEU  78  -3.533  -7.215  -0.032
  583   1HD2  LEU  78          1HD2      LEU  78  -2.327  -7.937   3.271
  584   2HD2  LEU  78          2HD2      LEU  78  -1.731  -9.553   2.913
  585   3HD2  LEU  78          3HD2      LEU  78  -3.452  -9.303   3.196
  586    H    GLU  79           H        GLU  79  -1.670  -8.808  -2.689
  587    HA   GLU  79           HA       GLU  79   1.112  -9.333  -1.907
  588   1HB   GLU  79          1HB       GLU  79   0.229 -11.105  -3.448
  589   2HB   GLU  79          2HB       GLU  79  -0.331  -9.768  -4.454
  590   1HG   GLU  79          1HG       GLU  79   1.570 -10.755  -5.351
  591   2HG   GLU  79          2HG       GLU  79   1.864  -9.081  -4.917
  592    H    CYS  80           H        CYS  80   2.394  -7.705  -2.626
  593    HA   CYS  80           HA       CYS  80   1.034  -5.333  -3.602
  594   1HB   CYS  80          1HB       CYS  80   2.702  -4.933  -1.861
  595   2HB   CYS  80          2HB       CYS  80   3.958  -5.747  -2.735
  596    HG   CYS  80           HG       CYS  80   4.525  -3.842  -4.400
  597    H    ASN  81           H        ASN  81   0.452  -6.557  -5.431
  598    HA   ASN  81           HA       ASN  81   2.677  -7.175  -7.081
  599   1HB   ASN  81          1HB       ASN  81   1.210  -8.502  -8.531
  600   2HB   ASN  81          2HB       ASN  81   0.892  -8.924  -6.849
  601   1HD2  ASN  81          1HD2      ASN  81  -1.120  -8.466  -6.093
  602   2HD2  ASN  81          2HD2      ASN  81  -2.416  -7.922  -7.059
  603    H    GLU  82           H        GLU  82   1.921  -6.895  -9.544
  604    HA   GLU  82           HA       GLU  82   2.081  -4.407 -10.331
  605   1HB   GLU  82          1HB       GLU  82   1.083  -6.863 -11.333
  606   2HB   GLU  82          2HB       GLU  82   0.750  -5.484 -12.387
  607   1HG   GLU  82          1HG       GLU  82   2.913  -6.523 -13.045
  608   2HG   GLU  82          2HG       GLU  82   3.086  -4.896 -12.358
  609    H    ASN  83           H        ASN  83  -0.916  -6.239 -10.297
  610    HA   ASN  83           HA       ASN  83  -2.849  -4.380 -11.024
  611   1HB   ASN  83          1HB       ASN  83  -2.984  -6.665  -9.027
  612   2HB   ASN  83          2HB       ASN  83  -4.409  -5.838  -9.668
  613   1HD2  ASN  83          1HD2      ASN  83  -1.936  -8.167 -10.223
  614   2HD2  ASN  83          2HD2      ASN  83  -2.522  -8.754 -11.735
  615    H    VAL  84           H        VAL  84  -1.609  -5.373  -7.805
  616    HA   VAL  84           HA       VAL  84  -3.172  -3.562  -6.467
  617    HB   VAL  84           HB       VAL  84  -0.656  -5.002  -5.673
  618   1HG1  VAL  84          1HG1      VAL  84  -1.128  -4.353  -3.382
  619   2HG1  VAL  84          2HG1      VAL  84  -2.370  -3.217  -3.934
  620   3HG1  VAL  84          3HG1      VAL  84  -0.668  -2.966  -4.364
  621   1HG2  VAL  84          1HG2      VAL  84  -2.192  -6.220  -4.309
  622   2HG2  VAL  84          2HG2      VAL  84  -2.678  -6.260  -6.016
  623   3HG2  VAL  84          3HG2      VAL  84  -3.514  -5.198  -4.864
  624    H    LYS  85           H        LYS  85   0.132  -3.296  -7.608
  625    HA   LYS  85           HA       LYS  85   0.825  -0.745  -6.638
  626   1HB   LYS  85          1HB       LYS  85   1.560  -2.034  -9.261
  627   2HB   LYS  85          2HB       LYS  85   2.332  -0.603  -8.593
  628   1HG   LYS  85          1HG       LYS  85   3.179  -1.818  -6.764
  629   2HG   LYS  85          2HG       LYS  85   2.243  -3.252  -7.205
  630   1HD   LYS  85          1HD       LYS  85   3.524  -3.220  -9.389
  631   2HD   LYS  85          2HD       LYS  85   4.571  -2.014  -8.626
  632   1HE   LYS  85          1HE       LYS  85   5.048  -3.525  -6.832
  633   2HE   LYS  85          2HE       LYS  85   3.911  -4.679  -7.539
  634   1HZ   LYS  85          1HZ       LYS  85   5.351  -4.897  -9.471
  635   2HZ   LYS  85          2HZ       LYS  85   6.233  -5.271  -8.098
  636   3HZ   LYS  85          3HZ       LYS  85   6.448  -3.781  -8.851
  637    H    HIS  86           H        HIS  86  -0.729  -1.711  -9.531
  638    HA   HIS  86           HA       HIS  86  -1.034   0.746 -10.767
  639   1HB   HIS  86          1HB       HIS  86  -1.563  -1.180 -12.069
  640   2HB   HIS  86          2HB       HIS  86  -2.772  -1.715 -10.914
  641    HD1  HIS  86           1HD      HIS  86  -4.977  -1.577 -12.005
  642    HD2  HIS  86           2HD      HIS  86  -2.613   1.695 -12.975
  643    HE1  HIS  86           1HE      HIS  86  -6.402  -0.150 -13.451
  644    H    LYS  87           H        LYS  87  -3.296  -0.972  -8.715
  645    HA   LYS  87           HA       LYS  87  -5.321   1.055  -8.446
  646   1HB   LYS  87          1HB       LYS  87  -5.586  -1.425  -7.949
  647   2HB   LYS  87          2HB       LYS  87  -4.560  -1.164  -6.544
  648   1HG   LYS  87          1HG       LYS  87  -6.161   0.374  -5.633
  649   2HG   LYS  87          2HG       LYS  87  -7.169   0.198  -7.065
  650   1HD   LYS  87          1HD       LYS  87  -8.178  -1.163  -5.417
  651   2HD   LYS  87          2HD       LYS  87  -7.323  -2.241  -6.515
  652   1HE   LYS  87          1HE       LYS  87  -6.046  -1.290  -3.979
  653   2HE   LYS  87          2HE       LYS  87  -7.164  -2.649  -3.922
  654   1HZ   LYS  87          1HZ       LYS  87  -4.576  -2.557  -5.448
  655   2HZ   LYS  87          2HZ       LYS  87  -5.664  -3.841  -5.440
  656   3HZ   LYS  87          3HZ       LYS  87  -4.883  -3.430  -4.031
  657    H    THR  88           H        THR  88  -2.408   0.564  -6.903
  658    HA   THR  88           HA       THR  88  -3.021   2.186  -4.672
  659    HB   THR  88           HB       THR  88  -0.589   0.946  -5.784
  660    HG1  THR  88           1HG      THR  88  -1.798  -0.515  -4.842
  661   1HG2  THR  88          1HG2      THR  88   0.041   2.970  -4.799
  662   2HG2  THR  88          2HG2      THR  88   0.556   1.641  -3.730
  663   3HG2  THR  88          3HG2      THR  88  -0.861   2.649  -3.310
  664    H    LYS  89           H        LYS  89  -0.712   2.589  -7.315
  665    HA   LYS  89           HA       LYS  89  -0.242   5.103  -6.473
  666   1HB   LYS  89          1HB       LYS  89   0.777   5.432  -8.905
  667   2HB   LYS  89          2HB       LYS  89   1.524   4.448  -7.664
  668   1HG   LYS  89          1HG       LYS  89   1.603   3.208  -9.679
  669   2HG   LYS  89          2HG       LYS  89   0.372   2.472  -8.646
  670   1HD   LYS  89          1HD       LYS  89  -0.372   2.476 -10.793
  671   2HD   LYS  89          2HD       LYS  89  -1.263   3.662  -9.854
  672   1HE   LYS  89          1HE       LYS  89   0.035   5.501 -10.838
  673   2HE   LYS  89          2HE       LYS  89   1.082   4.351 -11.664
  674   1HZ   LYS  89          1HZ       LYS  89  -0.388   5.250 -13.212
  675   2HZ   LYS  89          2HZ       LYS  89  -1.738   5.036 -12.290
  676   3HZ   LYS  89          3HZ       LYS  89  -0.948   3.687 -12.974
  677    H    GLU  90           H        GLU  90  -2.559   3.881  -8.741
  678    HA   GLU  90           HA       GLU  90  -3.549   6.353  -9.765
  679   1HB   GLU  90          1HB       GLU  90  -4.906   3.685  -9.415
  680   2HB   GLU  90          2HB       GLU  90  -5.733   5.070 -10.103
  681   1HG   GLU  90          1HG       GLU  90  -3.234   3.803 -11.205
  682   2HG   GLU  90          2HG       GLU  90  -4.869   3.540 -11.806
  683    H    TYR  91           H        TYR  91  -4.249   4.534  -6.786
  684    HA   TYR  91           HA       TYR  91  -6.514   6.070  -6.101
  685   1HB   TYR  91          1HB       TYR  91  -6.530   3.980  -5.058
  686   2HB   TYR  91          2HB       TYR  91  -4.810   4.027  -4.719
  687    HD1  TYR  91           1HD      TYR  91  -4.176   4.301  -2.558
  688    HD2  TYR  91           2HD      TYR  91  -7.941   5.872  -3.746
  689    HE1  TYR  91           1HE      TYR  91  -4.591   4.956  -0.264
  690    HE2  TYR  91           2HE      TYR  91  -8.396   6.540  -1.412
  691    HH   TYR  91           HH       TYR  91  -5.946   6.560   0.944
  692    H    ILE  92           H        ILE  92  -3.120   5.885  -5.141
  693    HA   ILE  92           HA       ILE  92  -2.921   7.947  -3.337
  694    HB   ILE  92           HB       ILE  92  -0.988   7.083  -5.481
  695   1HG1  ILE  92          1HG1      ILE  92  -1.867   5.627  -3.520
  696   2HG1  ILE  92          2HG1      ILE  92  -0.142   5.507  -3.957
  697   1HG2  ILE  92          1HG2      ILE  92  -0.452   9.328  -4.811
  698   2HG2  ILE  92          2HG2      ILE  92   0.793   8.222  -4.193
  699   3HG2  ILE  92          3HG2      ILE  92  -0.464   8.865  -3.115
  700   1HD1  ILE  92          1HD1      ILE  92  -0.471   5.544  -1.604
  701   2HD1  ILE  92          2HD1      ILE  92  -1.533   6.956  -1.770
  702   3HD1  ILE  92          3HD1      ILE  92   0.209   7.105  -2.104
  703    H    LYS  93           H        LYS  93  -2.440   8.294  -6.834
  704    HA   LYS  93           HA       LYS  93  -2.061  11.048  -6.685
  705   1HB   LYS  93          1HB       LYS  93  -3.207   9.412  -8.941
  706   2HB   LYS  93          2HB       LYS  93  -2.807  11.118  -9.069
  707   1HG   LYS  93          1HG       LYS  93  -0.456  10.515  -8.451
  708   2HG   LYS  93          2HG       LYS  93  -0.940   8.820  -8.591
  709   1HD   LYS  93          1HD       LYS  93  -1.520   9.120 -10.900
  710   2HD   LYS  93          2HD       LYS  93  -1.242  10.861 -10.793
  711   1HE   LYS  93          1HE       LYS  93   1.137  10.380 -10.278
  712   2HE   LYS  93          2HE       LYS  93   0.807   8.669 -10.534
  713   1HZ   LYS  93          1HZ       LYS  93   0.204   9.150 -12.821
  714   2HZ   LYS  93          2HZ       LYS  93   1.746   9.769 -12.503
  715   3HZ   LYS  93          3HZ       LYS  93   0.432  10.798 -12.562
  716    H    LYS  94           H        LYS  94  -5.005   9.182  -7.099
  717    HA   LYS  94           HA       LYS  94  -6.545  11.505  -7.569
  718   1HB   LYS  94          1HB       LYS  94  -7.206   9.214  -8.331
  719   2HB   LYS  94          2HB       LYS  94  -7.476   8.774  -6.656
  720   1HG   LYS  94          1HG       LYS  94  -9.265  10.417  -6.512
  721   2HG   LYS  94          2HG       LYS  94  -8.989  10.858  -8.200
  722   1HD   LYS  94          1HD       LYS  94  -9.503   8.584  -8.887
  723   2HD   LYS  94          2HD       LYS  94  -9.772   8.121  -7.208
  724   1HE   LYS  94          1HE       LYS  94 -11.562   9.831  -7.098
  725   2HE   LYS  94          2HE       LYS  94 -11.323  10.122  -8.820
  726   1HZ   LYS  94          1HZ       LYS  94 -12.134   7.565  -7.588
  727   2HZ   LYS  94          2HZ       LYS  94 -11.889   7.805  -9.238
  728   3HZ   LYS  94          3HZ       LYS  94 -13.141   8.612  -8.430
  729    H    TYR  95           H        TYR  95  -5.663   9.647  -4.775
  730    HA   TYR  95           HA       TYR  95  -7.330  10.860  -2.908
  731   1HB   TYR  95          1HB       TYR  95  -6.244   8.830  -2.470
  732   2HB   TYR  95          2HB       TYR  95  -4.672   9.563  -2.816
  733    HD1  TYR  95           1HD      TYR  95  -3.470  10.569  -1.025
  734    HD2  TYR  95           2HD      TYR  95  -7.569   9.632  -0.503
  735    HE1  TYR  95           1HE      TYR  95  -3.303  11.202   1.287
  736    HE2  TYR  95           2HE      TYR  95  -7.409  10.237   1.865
  737    HH   TYR  95           HH       TYR  95  -4.593  11.721   3.171
  738    H    MET  96           H        MET  96  -3.988  11.566  -3.772
  739    HA   MET  96           HA       MET  96  -3.710  13.726  -2.026
  740   1HB   MET  96          1HB       MET  96  -2.227  13.428  -4.637
  741   2HB   MET  96          2HB       MET  96  -1.775  14.330  -3.188
  742   1HG   MET  96          1HG       MET  96  -1.992  11.341  -3.338
  743   2HG   MET  96          2HG       MET  96  -0.491  12.262  -3.422
  744   1HE   MET  96          1HE       MET  96   0.342  13.785  -1.551
  745   2HE   MET  96          2HE       MET  96  -0.388  13.918   0.074
  746   3HE   MET  96          3HE       MET  96  -1.224  14.566  -1.353
  747    H    GLN  97           H        GLN  97  -5.136  13.520  -5.060
  748    HA   GLN  97           HA       GLN  97  -5.117  16.275  -5.750
  749   1HB   GLN  97          1HB       GLN  97  -7.355  14.398  -6.495
  750   2HB   GLN  97          2HB       GLN  97  -6.927  15.894  -7.299
  751   1HG   GLN  97          1HG       GLN  97  -5.503  13.269  -7.320
  752   2HG   GLN  97          2HG       GLN  97  -6.144  14.169  -8.683
  753   1HE2  GLN  97          1HE2      GLN  97  -3.589  13.632  -6.569
  754   2HE2  GLN  97          2HE2      GLN  97  -2.390  14.663  -7.225
  755    H    LYS  98           H        LYS  98  -6.909  14.607  -3.391
  756    HA   LYS  98           HA       LYS  98  -9.028  16.516  -3.318
  757   1HB   LYS  98          1HB       LYS  98 -10.011  15.304  -1.541
  758   2HB   LYS  98          2HB       LYS  98  -9.249  14.117  -2.564
  759   1HG   LYS  98          1HG       LYS  98  -7.997  13.318  -0.870
  760   2HG   LYS  98          2HG       LYS  98  -7.431  14.941  -0.468
  761   1HD   LYS  98          1HD       LYS  98 -10.084  13.720   0.356
  762   2HD   LYS  98          2HD       LYS  98  -8.645  13.854   1.369
  763   1HE   LYS  98          1HE       LYS  98  -8.780  16.154   1.523
  764   2HE   LYS  98          2HE       LYS  98  -9.792  16.328   0.105
  765   1HZ   LYS  98          1HZ       LYS  98 -10.742  15.131   2.684
  766   2HZ   LYS  98          2HZ       LYS  98 -11.675  15.578   1.338
  767   3HZ   LYS  98          3HZ       LYS  98 -10.870  16.724   2.230
  768    H    PHE  99           H        PHE  99  -5.904  16.395  -1.963
  769    HA   PHE  99           HA       PHE  99  -6.501  18.114   0.276
  770   1HB   PHE  99          1HB       PHE  99  -3.808  17.342  -0.870
  771   2HB   PHE  99          2HB       PHE  99  -4.040  18.374   0.539
  772    HD1  PHE  99           1HD      PHE  99  -3.308  15.140  -0.440
  773    HD2  PHE  99           2HD      PHE  99  -5.689  17.319   2.344
  774    HE1  PHE  99           1HE      PHE  99  -3.359  13.173   1.095
  775    HE2  PHE  99           2HE      PHE  99  -5.736  15.358   3.827
  776    HZ   PHE  99           HZ       PHE  99  -4.625  13.314   3.171
  777    H    GLY 100           H        GLY 100  -5.319  18.545  -2.958
  778   1HA   GLY 100          1HA       GLY 100  -5.772  20.539  -4.119
  779   2HA   GLY 100          2HA       GLY 100  -5.671  21.398  -2.581
  780    H    ALA 101           H        ALA 101  -3.969  22.526  -2.431
  781    HA   ALA 101           HA       ALA 101  -1.657  21.973  -4.071
  782   1HB   ALA 101          1HB       ALA 101  -2.476  24.263  -3.772
  783   2HB   ALA 101          2HB       ALA 101  -0.806  24.081  -3.215
  784   3HB   ALA 101          3HB       ALA 101  -2.130  24.148  -2.048
  785    H    VAL 102           H        VAL 102  -2.414  21.978  -0.608
  786    HA   VAL 102           HA       VAL 102   0.220  20.712  -0.209
  787    HB   VAL 102           HB       VAL 102  -1.113  22.123   2.037
  788   1HG1  VAL 102          1HG1      VAL 102   1.763  21.778   1.363
  789   2HG1  VAL 102          2HG1      VAL 102   0.814  20.888   2.555
  790   3HG1  VAL 102          3HG1      VAL 102   1.151  22.606   2.795
  791   1HG2  VAL 102          1HG2      VAL 102  -0.032  24.280   1.550
  792   2HG2  VAL 102          2HG2      VAL 102  -1.263  23.823   0.367
  793   3HG2  VAL 102          3HG2      VAL 102   0.452  23.650  -0.033
  794    H    TYR 103           H        TYR 103   0.334  19.237   1.445
  795    HA   TYR 103           HA       TYR 103  -2.020  17.667   1.581
  796   1HB   TYR 103          1HB       TYR 103  -0.099  16.361   1.137
  797   2HB   TYR 103          2HB       TYR 103   0.847  17.243   2.326
  798    HD1  TYR 103           1HD      TYR 103  -2.445  15.651   2.863
  799    HD2  TYR 103           2HD      TYR 103   1.687  15.497   3.586
  800    HE1  TYR 103           1HE      TYR 103  -2.830  13.913   4.487
  801    HE2  TYR 103           2HE      TYR 103   1.326  13.678   5.252
  802    HH   TYR 103           HH       TYR 103  -0.450  12.979   6.740
  803    H    LYS 104           H        LYS 104  -3.404  18.450   2.876
  804    HA   LYS 104           HA       LYS 104  -2.681  18.969   5.661
  805   1HB   LYS 104          1HB       LYS 104  -4.900  20.044   3.944
  806   2HB   LYS 104          2HB       LYS 104  -4.814  20.330   5.671
  807   1HG   LYS 104          1HG       LYS 104  -2.609  21.424   5.337
  808   2HG   LYS 104          2HG       LYS 104  -2.762  21.152   3.611
  809   1HD   LYS 104          1HD       LYS 104  -4.685  22.818   5.238
  810   2HD   LYS 104          2HD       LYS 104  -3.285  23.482   4.414
  811   1HE   LYS 104          1HE       LYS 104  -5.118  23.889   2.974
  812   2HE   LYS 104          2HE       LYS 104  -4.262  22.510   2.291
  813   1HZ   LYS 104          1HZ       LYS 104  -6.748  22.383   2.369
  814   2HZ   LYS 104          2HZ       LYS 104  -6.632  22.193   4.042
  815   3HZ   LYS 104          3HZ       LYS 104  -5.976  21.050   3.004
  816    HA   PRO 105           HA       PRO 105  -4.860  14.897   5.666
  817   1HB   PRO 105          1HB       PRO 105  -3.929  14.241   8.174
  818   2HB   PRO 105          2HB       PRO 105  -3.077  13.879   6.669
  819   1HG   PRO 105          1HG       PRO 105  -2.701  16.117   8.580
  820   2HG   PRO 105          2HG       PRO 105  -1.464  15.159   7.706
  821   1HD   PRO 105          1HD       PRO 105  -2.158  17.651   7.026
  822   2HD   PRO 105          2HD       PRO 105  -1.717  16.463   5.791
  823    H    LYS 106           H        LYS 106  -4.724  17.269   8.206
  824    HA   LYS 106           HA       LYS 106  -6.939  16.610   9.698
  825   1HB   LYS 106          1HB       LYS 106  -7.047  19.053  10.232
  826   2HB   LYS 106          2HB       LYS 106  -5.484  18.278  10.473
  827   1HG   LYS 106          1HG       LYS 106  -4.769  19.202   8.271
  828   2HG   LYS 106          2HG       LYS 106  -6.294  20.088   8.206
  829   1HD   LYS 106          1HD       LYS 106  -5.745  21.263  10.237
  830   2HD   LYS 106          2HD       LYS 106  -4.289  20.276  10.415
  831   1HE   LYS 106          1HE       LYS 106  -3.391  21.213   8.360
  832   2HE   LYS 106          2HE       LYS 106  -4.835  22.200   8.164
  833   1HZ   LYS 106          1HZ       LYS 106  -2.901  22.368  10.410
  834   2HZ   LYS 106          2HZ       LYS 106  -4.293  23.326  10.230
  835   3HZ   LYS 106          3HZ       LYS 106  -3.034  23.453   9.124
  836    H    GLU 107           H        GLU 107  -6.941  17.475   6.512
  837    HA   GLU 107           HA       GLU 107  -9.831  17.964   6.503
  838   1HB   GLU 107          1HB       GLU 107  -7.702  19.246   4.782
  839   2HB   GLU 107          2HB       GLU 107  -9.433  19.421   4.523
  840   1HG   GLU 107          1HG       GLU 107  -9.698  20.550   6.598
  841   2HG   GLU 107          2HG       GLU 107  -8.026  20.227   7.048
  842    H    ASP 108           H        ASP 108  -8.245  15.454   6.260
  843    HA   ASP 108           HA       ASP 108  -8.205  14.841   3.478
  844   1HB   ASP 108          1HB       ASP 108  -7.093  12.861   4.031
  845   2HB   ASP 108          2HB       ASP 108  -6.619  13.914   5.346
  846    H    THR 109           H        THR 109  -9.197  12.204   3.510
  847    HA   THR 109           HA       THR 109 -12.026  12.842   3.285
  848    HB   THR 109           HB       THR 109 -10.905  11.851   1.359
  849    HG1  THR 109           1HG      THR 109 -12.823  10.215   2.641
  850   1HG2  THR 109          1HG2      THR 109  -9.222  10.642   2.607
  851   2HG2  THR 109          2HG2      THR 109 -10.008   9.577   1.429
  852   3HG2  THR 109          3HG2      THR 109 -10.426   9.481   3.150
  Start of MODEL    3
    1    H    THR  10           H        THR  10  -2.056 -21.939   2.112
    2    HA   THR  10           HA       THR  10  -2.315 -22.996   4.829
    3    HB   THR  10           HB       THR  10   0.139 -22.309   5.161
    4    HG1  THR  10           1HG      THR  10   0.128 -22.490   2.323
    5   1HG2  THR  10          1HG2      THR  10   1.085 -24.426   4.374
    6   2HG2  THR  10          2HG2      THR  10  -0.308 -24.660   3.318
    7   3HG2  THR  10          3HG2      THR  10  -0.518 -24.687   5.068
    8    H    SER  11           H        SER  11  -3.618 -21.039   3.329
    9    HA   SER  11           HA       SER  11  -2.241 -18.536   3.233
   10   1HB   SER  11          1HB       SER  11  -5.053 -19.213   2.746
   11   2HB   SER  11          2HB       SER  11  -4.082 -17.906   2.007
   12    HG   SER  11           HG       SER  11  -3.982 -19.568   0.444
   13    H    SER  12           H        SER  12  -4.050 -20.030   5.559
   14    HA   SER  12           HA       SER  12  -5.135 -17.740   6.715
   15   1HB   SER  12          1HB       SER  12  -5.246 -19.405   8.628
   16   2HB   SER  12          2HB       SER  12  -5.999 -19.855   7.077
   17    HG   SER  12           HG       SER  12  -4.681 -21.601   7.900
   18    H    GLU  13           H        GLU  13  -2.193 -19.779   7.346
   19    HA   GLU  13           HA       GLU  13  -1.165 -17.924   9.196
   20   1HB   GLU  13          1HB       GLU  13   0.583 -19.616   9.403
   21   2HB   GLU  13          2HB       GLU  13  -1.030 -20.281   9.615
   22   1HG   GLU  13          1HG       GLU  13  -0.576 -21.810   8.081
   23   2HG   GLU  13          2HG       GLU  13  -0.385 -20.529   6.893
   24    H    LEU  14           H        LEU  14  -0.706 -18.782   5.865
   25    HA   LEU  14           HA       LEU  14   1.808 -17.806   5.202
   26   1HB   LEU  14          1HB       LEU  14  -0.048 -19.049   3.884
   27   2HB   LEU  14          2HB       LEU  14  -0.622 -17.451   3.519
   28    HG   LEU  14           HG       LEU  14   2.151 -18.374   2.720
   29   1HD1  LEU  14          1HD1      LEU  14   0.491 -19.809   1.677
   30   2HD1  LEU  14          2HD1      LEU  14   1.223 -18.729   0.490
   31   3HD1  LEU  14          3HD1      LEU  14  -0.393 -18.391   1.110
   32   1HD2  LEU  14          1HD2      LEU  14   1.823 -15.928   2.771
   33   2HD2  LEU  14          2HD2      LEU  14   0.413 -16.103   1.727
   34   3HD2  LEU  14          3HD2      LEU  14   2.013 -16.522   1.120
   35    H    ALA  15           H        ALA  15  -1.118 -16.392   5.859
   36    HA   ALA  15           HA       ALA  15  -0.722 -13.896   4.552
   37   1HB   ALA  15          1HB       ALA  15  -2.868 -14.770   4.700
   38   2HB   ALA  15          2HB       ALA  15  -2.756 -13.199   5.501
   39   3HB   ALA  15          3HB       ALA  15  -2.839 -14.692   6.475
   40    H    LYS  16           H        LYS  16  -0.018 -15.140   7.683
   41    HA   LYS  16           HA       LYS  16   0.063 -12.675   9.004
   42   1HB   LYS  16          1HB       LYS  16   0.167 -14.891  10.177
   43   2HB   LYS  16          2HB       LYS  16   1.794 -15.108   9.557
   44   1HG   LYS  16          1HG       LYS  16   2.565 -13.187  10.827
   45   2HG   LYS  16          2HG       LYS  16   0.925 -12.900  11.409
   46   1HD   LYS  16          1HD       LYS  16   0.960 -15.155  12.459
   47   2HD   LYS  16          2HD       LYS  16   2.633 -15.323  11.945
   48   1HE   LYS  16          1HE       LYS  16   2.501 -14.623  14.279
   49   2HE   LYS  16          2HE       LYS  16   3.262 -13.387  13.280
   50   1HZ   LYS  16          1HZ       LYS  16   1.199 -12.138  13.287
   51   2HZ   LYS  16          2HZ       LYS  16   1.655 -12.476  14.870
   52   3HZ   LYS  16          3HZ       LYS  16   0.419 -13.351  14.162
   53    H    LYS  17           H        LYS  17   2.202 -14.481   6.957
   54    HA   LYS  17           HA       LYS  17   4.373 -12.573   7.168
   55   1HB   LYS  17          1HB       LYS  17   4.084 -14.805   5.135
   56   2HB   LYS  17          2HB       LYS  17   5.525 -13.890   5.484
   57   1HG   LYS  17          1HG       LYS  17   5.909 -15.991   6.415
   58   2HG   LYS  17          2HG       LYS  17   5.449 -14.994   7.793
   59   1HD   LYS  17          1HD       LYS  17   3.238 -15.910   7.794
   60   2HD   LYS  17          2HD       LYS  17   3.532 -16.760   6.277
   61   1HE   LYS  17          1HE       LYS  17   5.245 -18.110   7.377
   62   2HE   LYS  17          2HE       LYS  17   4.946 -17.259   8.888
   63   1HZ   LYS  17          1HZ       LYS  17   3.777 -19.293   8.944
   64   2HZ   LYS  17          2HZ       LYS  17   3.076 -19.082   7.450
   65   3HZ   LYS  17          3HZ       LYS  17   2.616 -18.091   8.744
   66    H    SER  18           H        SER  18   1.716 -13.323   4.865
   67    HA   SER  18           HA       SER  18   2.959 -11.796   2.926
   68   1HB   SER  18          1HB       SER  18   0.735 -11.758   1.779
   69   2HB   SER  18          2HB       SER  18   1.337 -13.397   2.166
   70    HG   SER  18           HG       SER  18  -0.914 -12.798   2.553
   71    H    LYS  19           H        LYS  19   0.445 -10.981   5.178
   72    HA   LYS  19           HA       LYS  19   0.012  -8.371   4.299
   73   1HB   LYS  19          1HB       LYS  19  -0.097  -9.125   7.228
   74   2HB   LYS  19          2HB       LYS  19  -0.943  -7.810   6.431
   75   1HG   LYS  19          1HG       LYS  19  -1.987  -9.844   5.045
   76   2HG   LYS  19          2HG       LYS  19  -1.575 -10.722   6.496
   77   1HD   LYS  19          1HD       LYS  19  -3.359  -8.290   6.307
   78   2HD   LYS  19          2HD       LYS  19  -3.860  -9.947   6.622
   79   1HE   LYS  19          1HE       LYS  19  -2.559  -9.900   8.710
   80   2HE   LYS  19          2HE       LYS  19  -2.139  -8.218   8.340
   81   1HZ   LYS  19          1HZ       LYS  19  -4.497  -7.650   8.431
   82   2HZ   LYS  19          2HZ       LYS  19  -3.978  -8.285   9.883
   83   3HZ   LYS  19          3HZ       LYS  19  -4.889  -9.241   8.838
   84    H    GLU  20           H        GLU  20   2.572  -9.458   6.496
   85    HA   GLU  20           HA       GLU  20   3.374  -6.734   6.841
   86   1HB   GLU  20          1HB       GLU  20   5.400  -7.625   7.983
   87   2HB   GLU  20          2HB       GLU  20   3.882  -8.142   8.685
   88   1HG   GLU  20          1HG       GLU  20   4.123 -10.314   7.635
   89   2HG   GLU  20          2HG       GLU  20   5.618  -9.785   6.864
   90    H    VAL  21           H        VAL  21   4.575  -9.404   4.849
   91    HA   VAL  21           HA       VAL  21   6.717  -7.894   3.733
   92    HB   VAL  21           HB       VAL  21   5.200 -10.254   2.562
   93   1HG1  VAL  21          1HG1      VAL  21   6.505  -8.985   0.879
   94   2HG1  VAL  21          2HG1      VAL  21   7.169 -10.596   1.144
   95   3HG1  VAL  21          3HG1      VAL  21   7.952  -9.191   1.867
   96   1HG2  VAL  21          1HG2      VAL  21   7.760 -10.193   4.159
   97   2HG2  VAL  21          2HG2      VAL  21   7.075 -11.621   3.383
   98   3HG2  VAL  21          3HG2      VAL  21   6.203 -10.829   4.694
   99    H    PHE  22           H        PHE  22   3.357  -8.324   2.780
  100    HA   PHE  22           HA       PHE  22   3.423  -6.879   0.354
  101   1HB   PHE  22          1HB       PHE  22   1.479  -8.124   0.552
  102   2HB   PHE  22          2HB       PHE  22   1.307  -7.778   2.265
  103    HD1  PHE  22           1HD      PHE  22   1.129  -6.080  -1.040
  104    HD2  PHE  22           2HD      PHE  22  -0.325  -6.269   2.934
  105    HE1  PHE  22           1HE      PHE  22  -0.485  -4.295  -1.534
  106    HE2  PHE  22           2HE      PHE  22  -1.934  -4.521   2.437
  107    HZ   PHE  22           HZ       PHE  22  -2.039  -3.524   0.213
  108    H    ARG  23           H        ARG  23   2.425  -5.978   3.586
  109    HA   ARG  23           HA       ARG  23   2.034  -3.294   2.878
  110   1HB   ARG  23          1HB       ARG  23   1.876  -2.692   5.186
  111   2HB   ARG  23          2HB       ARG  23   1.158  -4.275   4.954
  112   1HG   ARG  23          1HG       ARG  23   2.330  -4.705   6.896
  113   2HG   ARG  23          2HG       ARG  23   3.463  -5.093   5.645
  114   1HD   ARG  23          1HD       ARG  23   4.217  -3.509   7.663
  115   2HD   ARG  23          2HD       ARG  23   4.918  -3.494   6.052
  116    HE   ARG  23           HE       ARG  23   3.619  -1.571   5.545
  117   1HH1  ARG  23          1HH1      ARG  23   3.448  -2.384   9.007
  118   2HH1  ARG  23          2HH1      ARG  23   3.387  -0.767   9.504
  119   1HH2  ARG  23          1HH2      ARG  23   3.534   0.600   6.226
  120   2HH2  ARG  23          2HH2      ARG  23   3.423   0.993   7.893
  121    H    LYS  24           H        LYS  24   5.004  -4.936   3.689
  122    HA   LYS  24           HA       LYS  24   6.447  -2.573   4.128
  123   1HB   LYS  24          1HB       LYS  24   7.337  -4.736   4.840
  124   2HB   LYS  24          2HB       LYS  24   7.507  -5.225   3.161
  125   1HG   LYS  24          1HG       LYS  24   9.115  -3.446   2.766
  126   2HG   LYS  24          2HG       LYS  24   8.926  -2.880   4.422
  127   1HD   LYS  24          1HD       LYS  24   9.825  -4.965   5.254
  128   2HD   LYS  24          2HD       LYS  24   9.948  -5.589   3.606
  129   1HE   LYS  24          1HE       LYS  24  12.131  -4.810   4.356
  130   2HE   LYS  24          2HE       LYS  24  11.531  -3.790   3.054
  131   1HZ   LYS  24          1HZ       LYS  24  10.856  -2.148   4.733
  132   2HZ   LYS  24          2HZ       LYS  24  12.486  -2.436   4.755
  133   3HZ   LYS  24          3HZ       LYS  24  11.507  -3.116   5.957
  134    H    GLU  25           H        GLU  25   5.856  -4.633   1.257
  135    HA   GLU  25           HA       GLU  25   7.603  -3.431  -0.563
  136   1HB   GLU  25          1HB       GLU  25   4.852  -4.377  -1.254
  137   2HB   GLU  25          2HB       GLU  25   6.277  -4.387  -2.264
  138   1HG   GLU  25          1HG       GLU  25   6.455  -5.952   0.154
  139   2HG   GLU  25          2HG       GLU  25   5.194  -6.411  -0.989
  140    H    MET  26           H        MET  26   4.245  -3.097   0.210
  141    HA   MET  26           HA       MET  26   3.670  -1.085  -1.676
  142   1HB   MET  26          1HB       MET  26   2.066  -2.708  -0.873
  143   2HB   MET  26          2HB       MET  26   2.144  -1.943   0.705
  144   1HG   MET  26          1HG       MET  26   0.167  -1.285  -0.827
  145   2HG   MET  26          2HG       MET  26   1.034  -0.029   0.051
  146   1HE   MET  26          1HE       MET  26   0.046  -1.397  -3.495
  147   2HE   MET  26          2HE       MET  26   1.749  -1.916  -3.580
  148   3HE   MET  26          3HE       MET  26   1.161  -0.520  -4.523
  149    H    SER  27           H        SER  27   4.332  -0.944   1.742
  150    HA   SER  27           HA       SER  27   3.902   1.817   1.964
  151   1HB   SER  27          1HB       SER  27   5.739   0.066   3.628
  152   2HB   SER  27          2HB       SER  27   5.517   1.787   3.951
  153    HG   SER  27           HG       SER  27   3.140   0.917   3.728
  154    H    GLN  28           H        GLN  28   6.694  -0.052   0.877
  155    HA   GLN  28           HA       GLN  28   8.338   2.253   0.598
  156   1HB   GLN  28          1HB       GLN  28   8.520  -0.486  -0.635
  157   2HB   GLN  28          2HB       GLN  28   9.759   0.755  -0.792
  158   1HG   GLN  28          1HG       GLN  28   8.792  -0.393   1.801
  159   2HG   GLN  28          2HG       GLN  28  10.248  -0.904   0.962
  160   1HE2  GLN  28          1HE2      GLN  28   8.743   1.573   2.856
  161   2HE2  GLN  28          2HE2      GLN  28  10.165   2.501   3.148
  162    H    PHE  29           H        PHE  29   6.313   0.430  -1.597
  163    HA   PHE  29           HA       PHE  29   6.797   1.825  -3.936
  164   1HB   PHE  29          1HB       PHE  29   5.557  -0.293  -3.851
  165   2HB   PHE  29          2HB       PHE  29   4.257   0.492  -2.970
  166    HD1  PHE  29           1HD      PHE  29   5.913   0.162  -6.217
  167    HD2  PHE  29           2HD      PHE  29   2.599   1.763  -4.103
  168    HE1  PHE  29           1HE      PHE  29   4.765   0.605  -8.336
  169    HE2  PHE  29           2HE      PHE  29   1.457   2.213  -6.237
  170    HZ   PHE  29           HZ       PHE  29   2.519   1.629  -8.320
  171    H    ILE  30           H        ILE  30   4.282   2.328  -1.507
  172    HA   ILE  30           HA       ILE  30   3.187   4.646  -2.600
  173    HB   ILE  30           HB       ILE  30   3.167   3.609   0.237
  174   1HG1  ILE  30          1HG1      ILE  30   0.972   3.765  -1.828
  175   2HG1  ILE  30          2HG1      ILE  30   2.002   2.362  -1.603
  176   1HG2  ILE  30          1HG2      ILE  30   2.940   6.056   0.250
  177   2HG2  ILE  30          2HG2      ILE  30   1.434   5.269   0.741
  178   3HG2  ILE  30          3HG2      ILE  30   1.605   5.942  -0.888
  179   1HD1  ILE  30          1HD1      ILE  30  -0.144   2.078  -0.493
  180   2HD1  ILE  30          2HD1      ILE  30   0.142   3.510   0.479
  181   3HD1  ILE  30          3HD1      ILE  30   1.163   2.103   0.665
  182    H    VAL  31           H        VAL  31   5.679   4.223  -0.063
  183    HA   VAL  31           HA       VAL  31   6.258   6.848   0.399
  184    HB   VAL  31           HB       VAL  31   8.010   4.397   0.296
  185   1HG1  VAL  31          1HG1      VAL  31   9.926   5.610   1.108
  186   2HG1  VAL  31          2HG1      VAL  31   9.012   7.093   1.225
  187   3HG1  VAL  31          3HG1      VAL  31   9.412   6.434  -0.371
  188   1HG2  VAL  31          1HG2      VAL  31   8.150   4.805   2.718
  189   2HG2  VAL  31          2HG2      VAL  31   6.471   4.707   2.162
  190   3HG2  VAL  31          3HG2      VAL  31   7.186   6.268   2.510
  191    H    GLN  32           H        GLN  32   7.539   4.850  -2.283
  192    HA   GLN  32           HA       GLN  32   9.080   6.752  -3.388
  193   1HB   GLN  32          1HB       GLN  32   9.197   4.430  -3.901
  194   2HB   GLN  32          2HB       GLN  32   7.632   4.470  -4.687
  195   1HG   GLN  32          1HG       GLN  32   9.414   4.412  -6.296
  196   2HG   GLN  32          2HG       GLN  32   8.485   5.918  -6.379
  197   1HE2  GLN  32          1HE2      GLN  32  10.906   5.299  -3.899
  198   2HE2  GLN  32          2HE2      GLN  32  12.019   6.483  -4.438
  199    H    CYS  33           H        CYS  33   5.719   5.892  -3.882
  200    HA   CYS  33           HA       CYS  33   5.104   7.551  -6.030
  201   1HB   CYS  33          1HB       CYS  33   3.435   6.424  -3.831
  202   2HB   CYS  33          2HB       CYS  33   2.737   7.263  -5.226
  203    HG   CYS  33           HG       CYS  33   4.417   4.318  -5.104
  204    H    LEU  34           H        LEU  34   5.033   8.075  -2.587
  205    HA   LEU  34           HA       LEU  34   3.999  10.738  -2.800
  206   1HB   LEU  34          1HB       LEU  34   5.135   9.267  -0.449
  207   2HB   LEU  34          2HB       LEU  34   4.463  10.878  -0.366
  208    HG   LEU  34           HG       LEU  34   2.978   8.355  -1.069
  209   1HD1  LEU  34          1HD1      LEU  34   2.891  10.168   1.332
  210   2HD1  LEU  34          2HD1      LEU  34   3.537   8.528   1.271
  211   3HD1  LEU  34          3HD1      LEU  34   1.813   8.807   1.044
  212   1HD2  LEU  34          1HD2      LEU  34   0.959   9.775  -1.011
  213   2HD2  LEU  34          2HD2      LEU  34   2.043  10.222  -2.322
  214   3HD2  LEU  34          3HD2      LEU  34   1.979  11.204  -0.857
  215    H    ASN  35           H        ASN  35   7.141   9.344  -2.843
  216    HA   ASN  35           HA       ASN  35   8.881  11.162  -2.079
  217   1HB   ASN  35          1HB       ASN  35   8.910   9.360  -4.342
  218   2HB   ASN  35          2HB       ASN  35  10.094  10.689  -4.491
  219   1HD2  ASN  35          1HD2      ASN  35   8.808   9.240  -1.652
  220   2HD2  ASN  35          2HD2      ASN  35  10.248   8.488  -1.184
  221    HA   PRO  36           HA       PRO  36   8.355  14.231  -5.824
  222   1HB   PRO  36          1HB       PRO  36   6.074  14.084  -7.295
  223   2HB   PRO  36          2HB       PRO  36   7.540  13.211  -7.739
  224   1HG   PRO  36          1HG       PRO  36   5.116  12.205  -6.305
  225   2HG   PRO  36          2HG       PRO  36   6.054  11.437  -7.598
  226   1HD   PRO  36          1HD       PRO  36   6.311  10.787  -5.008
  227   2HD   PRO  36          2HD       PRO  36   7.674  10.691  -6.124
  228    H    TYR  37           H        TYR  37   5.772  13.257  -3.776
  229    HA   TYR  37           HA       TYR  37   4.356  15.753  -4.031
  230   1HB   TYR  37          1HB       TYR  37   3.914  13.387  -2.221
  231   2HB   TYR  37          2HB       TYR  37   2.911  14.833  -2.203
  232    HD1  TYR  37           1HD      TYR  37   1.264  15.184  -3.845
  233    HD2  TYR  37           2HD      TYR  37   3.960  11.963  -4.239
  234    HE1  TYR  37           1HE      TYR  37  -0.128  14.267  -5.646
  235    HE2  TYR  37           2HE      TYR  37   2.618  10.996  -6.008
  236    HH   TYR  37           HH       TYR  37   0.093  12.734  -7.562
  237    H    ARG  38           H        ARG  38   6.749  14.417  -2.009
  238    HA   ARG  38           HA       ARG  38   6.348  16.392   0.088
  239   1HB   ARG  38          1HB       ARG  38   8.342  15.419   1.137
  240   2HB   ARG  38          2HB       ARG  38   7.165  14.184   0.704
  241   1HG   ARG  38          1HG       ARG  38   8.433  13.627  -1.256
  242   2HG   ARG  38          2HG       ARG  38   9.592  14.901  -0.904
  243   1HD   ARG  38          1HD       ARG  38  10.158  13.754   1.213
  244   2HD   ARG  38          2HD       ARG  38   8.983  12.499   0.819
  245    HE   ARG  38           HE       ARG  38  10.777  12.690  -1.292
  246   1HH1  ARG  38          1HH1      ARG  38  10.852  11.726   2.132
  247   2HH1  ARG  38          2HH1      ARG  38  12.103  10.602   1.913
  248   1HH2  ARG  38          1HH2      ARG  38  12.521  11.142  -1.554
  249   2HH2  ARG  38          2HH2      ARG  38  13.096  10.283  -0.212
  250    H    LYS  39           H        LYS  39   7.536  16.601  -2.857
  251    HA   LYS  39           HA       LYS  39   9.902  18.209  -2.410
  252   1HB   LYS  39          1HB       LYS  39   8.280  17.801  -4.930
  253   2HB   LYS  39          2HB       LYS  39   9.882  18.516  -4.834
  254   1HG   LYS  39          1HG       LYS  39   9.167  15.673  -4.174
  255   2HG   LYS  39          2HG       LYS  39   9.982  16.234  -5.633
  256   1HD   LYS  39          1HD       LYS  39  11.881  16.960  -4.352
  257   2HD   LYS  39          2HD       LYS  39  11.040  16.601  -2.842
  258   1HE   LYS  39          1HE       LYS  39  12.566  14.814  -3.302
  259   2HE   LYS  39          2HE       LYS  39  10.903  14.272  -3.500
  260   1HZ   LYS  39          1HZ       LYS  39  11.151  14.465  -5.906
  261   2HZ   LYS  39          2HZ       LYS  39  12.315  13.436  -5.269
  262   3HZ   LYS  39          3HZ       LYS  39  12.742  14.994  -5.721
  263    HA   PRO  40           HA       PRO  40   7.649  21.909  -1.768
  264   1HB   PRO  40          1HB       PRO  40   9.496  23.766  -2.425
  265   2HB   PRO  40          2HB       PRO  40   9.518  22.828  -0.928
  266   1HG   PRO  40          1HG       PRO  40  11.108  22.435  -3.419
  267   2HG   PRO  40          2HG       PRO  40  11.611  22.252  -1.734
  268   1HD   PRO  40          1HD       PRO  40  10.964  20.140  -3.349
  269   2HD   PRO  40          2HD       PRO  40  10.781  20.121  -1.584
  270    H    ASP  41           H        ASP  41   8.618  20.995  -4.950
  271    HA   ASP  41           HA       ASP  41   7.384  23.282  -6.165
  272   1HB   ASP  41          1HB       ASP  41   8.245  22.220  -8.173
  273   2HB   ASP  41          2HB       ASP  41   9.539  22.605  -7.033
  274    H    CYS  42           H        CYS  42   6.519  20.463  -4.890
  275    HA   CYS  42           HA       CYS  42   5.077  19.088  -6.848
  276   1HB   CYS  42          1HB       CYS  42   5.527  18.152  -4.606
  277   2HB   CYS  42          2HB       CYS  42   4.358  19.272  -3.929
  278    HG   CYS  42           HG       CYS  42   2.475  17.454  -4.072
  279    H    LYS  43           H        LYS  43   3.172  19.298  -7.758
  280    HA   LYS  43           HA       LYS  43   2.020  21.921  -7.672
  281   1HB   LYS  43          1HB       LYS  43   1.329  19.512  -9.331
  282   2HB   LYS  43          2HB       LYS  43   0.667  21.124  -9.560
  283   1HG   LYS  43          1HG       LYS  43   2.889  21.985 -10.064
  284   2HG   LYS  43          2HG       LYS  43   3.577  20.387  -9.783
  285   1HD   LYS  43          1HD       LYS  43   2.288  19.483 -11.628
  286   2HD   LYS  43          2HD       LYS  43   1.520  21.047 -11.870
  287   1HE   LYS  43          1HE       LYS  43   3.680  22.036 -12.424
  288   2HE   LYS  43          2HE       LYS  43   4.463  20.478 -12.163
  289   1HZ   LYS  43          1HZ       LYS  43   4.008  20.972 -14.504
  290   2HZ   LYS  43          2HZ       LYS  43   2.348  20.964 -14.177
  291   3HZ   LYS  43          3HZ       LYS  43   3.256  19.560 -13.977
  292    H    VAL  44           H        VAL  44   1.153  18.746  -6.541
  293    HA   VAL  44           HA       VAL  44  -1.212  19.852  -5.329
  294    HB   VAL  44           HB       VAL  44  -2.002  19.159  -7.521
  295   1HG1  VAL  44          1HG1      VAL  44  -1.933  16.832  -8.273
  296   2HG1  VAL  44          2HG1      VAL  44  -0.882  16.448  -6.906
  297   3HG1  VAL  44          3HG1      VAL  44  -0.336  17.573  -8.146
  298   1HG2  VAL  44          1HG2      VAL  44  -3.765  17.591  -6.890
  299   2HG2  VAL  44          2HG2      VAL  44  -3.542  18.836  -5.659
  300   3HG2  VAL  44          3HG2      VAL  44  -2.901  17.212  -5.400
  301    H    GLY  45           H        GLY  45  -1.493  19.023  -3.388
  302   1HA   GLY  45          1HA       GLY  45  -1.380  17.620  -1.578
  303   2HA   GLY  45          2HA       GLY  45  -0.977  16.306  -2.675
  304    H    ARG  46           H        ARG  46   0.880  19.415  -1.916
  305    HA   ARG  46           HA       ARG  46   3.251  17.964  -1.795
  306   1HB   ARG  46          1HB       ARG  46   3.269  20.298  -2.479
  307   2HB   ARG  46          2HB       ARG  46   2.542  20.756  -0.939
  308   1HG   ARG  46          1HG       ARG  46   4.480  20.179   0.278
  309   2HG   ARG  46          2HG       ARG  46   5.213  19.412  -1.126
  310   1HD   ARG  46          1HD       ARG  46   6.185  21.575  -0.618
  311   2HD   ARG  46          2HD       ARG  46   5.411  21.532  -2.218
  312    HE   ARG  46           HE       ARG  46   3.566  22.742  -1.160
  313   1HH1  ARG  46          1HH1      ARG  46   6.776  22.946   0.390
  314   2HH1  ARG  46          2HH1      ARG  46   6.533  24.520   0.969
  315   1HH2  ARG  46          1HH2      ARG  46   3.273  24.931  -0.328
  316   2HH2  ARG  46          2HH2      ARG  46   4.516  25.674   0.563
  317    H    ILE  47           H        ILE  47   3.971  16.868  -0.244
  318    HA   ILE  47           HA       ILE  47   2.744  16.861   2.339
  319    HB   ILE  47           HB       ILE  47   5.219  15.317   1.463
  320   1HG1  ILE  47          1HG1      ILE  47   2.291  14.491   1.562
  321   2HG1  ILE  47          2HG1      ILE  47   3.191  14.872   0.112
  322   1HG2  ILE  47          1HG2      ILE  47   5.120  15.562   3.812
  323   2HG2  ILE  47          2HG2      ILE  47   4.676  13.917   3.346
  324   3HG2  ILE  47          3HG2      ILE  47   3.440  15.053   3.849
  325   1HD1  ILE  47          1HD1      ILE  47   3.866  12.641   1.992
  326   2HD1  ILE  47          2HD1      ILE  47   4.634  12.998   0.437
  327   3HD1  ILE  47          3HD1      ILE  47   2.951  12.482   0.496
  328    H    THR  48           H        THR  48   3.145  18.091   3.871
  329    HA   THR  48           HA       THR  48   4.965  20.169   3.860
  330    HB   THR  48           HB       THR  48   4.010  20.532   6.141
  331    HG1  THR  48           1HG      THR  48   2.817  18.943   7.012
  332   1HG2  THR  48          1HG2      THR  48   2.903  21.337   4.109
  333   2HG2  THR  48          2HG2      THR  48   1.705  20.766   5.310
  334   3HG2  THR  48          3HG2      THR  48   2.191  19.726   3.957
  335    H    THR  49           H        THR  49   4.829  17.240   5.830
  336    HA   THR  49           HA       THR  49   7.599  17.831   6.688
  337    HB   THR  49           HB       THR  49   5.664  16.470   8.538
  338    HG1  THR  49           1HG      THR  49   4.547  18.197   8.599
  339   1HG2  THR  49          1HG2      THR  49   8.057  16.565   9.105
  340   2HG2  THR  49          2HG2      THR  49   7.092  17.495  10.247
  341   3HG2  THR  49          3HG2      THR  49   8.011  18.326   8.993
  342    H    THR  50           H        THR  50   8.843  15.974   7.211
  343    HA   THR  50           HA       THR  50   8.542  13.632   5.759
  344    HB   THR  50           HB       THR  50  10.560  14.466   6.603
  345    HG1  THR  50           1HG      THR  50  11.117  12.435   6.433
  346   1HG2  THR  50          1HG2      THR  50  11.267  14.268   8.985
  347   2HG2  THR  50          2HG2      THR  50   9.608  13.767   9.364
  348   3HG2  THR  50          3HG2      THR  50   9.907  15.376   8.721
  349    H    GLU  51           H        GLU  51   7.707  14.409   9.083
  350    HA   GLU  51           HA       GLU  51   6.674  11.911   9.913
  351   1HB   GLU  51          1HB       GLU  51   5.675  14.632  10.742
  352   2HB   GLU  51          2HB       GLU  51   5.521  13.130  11.639
  353   1HG   GLU  51          1HG       GLU  51   7.972  13.073  11.877
  354   2HG   GLU  51          2HG       GLU  51   8.053  14.640  11.074
  355    H    ASP  52           H        ASP  52   5.140  14.559   8.064
  356    HA   ASP  52           HA       ASP  52   2.550  13.392   8.085
  357   1HB   ASP  52          1HB       ASP  52   3.975  15.558   6.587
  358   2HB   ASP  52          2HB       ASP  52   2.387  15.024   6.085
  359    H    PHE  53           H        PHE  53   5.341  13.371   6.029
  360    HA   PHE  53           HA       PHE  53   4.260  12.028   3.840
  361   1HB   PHE  53          1HB       PHE  53   6.452  13.147   3.724
  362   2HB   PHE  53          2HB       PHE  53   7.045  12.136   5.022
  363    HD1  PHE  53           1HD      PHE  53   7.701   9.870   4.617
  364    HD2  PHE  53           2HD      PHE  53   6.296  12.341   1.480
  365    HE1  PHE  53           1HE      PHE  53   8.571   8.285   3.020
  366    HE2  PHE  53           2HE      PHE  53   7.174  10.756  -0.168
  367    HZ   PHE  53           HZ       PHE  53   8.314   8.741   0.560
  368    H    LYS  54           H        LYS  54   5.881  10.862   6.642
  369    HA   LYS  54           HA       LYS  54   5.719   8.051   6.099
  370   1HB   LYS  54          1HB       LYS  54   6.104   9.582   8.645
  371   2HB   LYS  54          2HB       LYS  54   6.273   7.836   8.484
  372   1HG   LYS  54          1HG       LYS  54   8.064   8.167   6.829
  373   2HG   LYS  54          2HG       LYS  54   7.891   9.911   7.009
  374   1HD   LYS  54          1HD       LYS  54   8.485   9.754   9.312
  375   2HD   LYS  54          2HD       LYS  54   8.619   7.984   9.182
  376   1HE   LYS  54          1HE       LYS  54  10.424   8.304   7.510
  377   2HE   LYS  54          2HE       LYS  54  10.320  10.046   7.770
  378   1HZ   LYS  54          1HZ       LYS  54  12.113   9.145   9.062
  379   2HZ   LYS  54          2HZ       LYS  54  11.129   7.992   9.759
  380   3HZ   LYS  54          3HZ       LYS  54  10.906   9.621  10.137
  381    H    HIS  55           H        HIS  55   3.593  10.315   7.843
  382    HA   HIS  55           HA       HIS  55   1.807   8.351   8.926
  383   1HB   HIS  55          1HB       HIS  55   1.964  10.717   9.754
  384   2HB   HIS  55          2HB       HIS  55   1.407  11.265   8.198
  385    HD1  HIS  55           1HD      HIS  55   0.134   9.795  11.389
  386    HD2  HIS  55           2HD      HIS  55  -1.411  11.026   7.718
  387    HE1  HIS  55           1HE      HIS  55  -2.358   9.837  11.669
  388    H    LEU  56           H        LEU  56   1.803  10.326   6.035
  389    HA   LEU  56           HA       LEU  56  -0.648   9.235   5.097
  390   1HB   LEU  56          1HB       LEU  56   0.952  11.341   4.373
  391   2HB   LEU  56          2HB       LEU  56   1.171  10.199   3.068
  392    HG   LEU  56           HG       LEU  56  -1.046  11.872   3.847
  393   1HD1  LEU  56          1HD1      LEU  56  -1.411  12.063   1.505
  394   2HD1  LEU  56          2HD1      LEU  56  -0.183  10.833   1.209
  395   3HD1  LEU  56          3HD1      LEU  56   0.259  12.358   1.969
  396   1HD2  LEU  56          1HD2      LEU  56  -1.660   9.133   2.738
  397   2HD2  LEU  56          2HD2      LEU  56  -2.793  10.490   2.838
  398   3HD2  LEU  56          3HD2      LEU  56  -2.206   9.781   4.288
  399    H    ALA  57           H        ALA  57   2.773   8.429   4.328
  400    HA   ALA  57           HA       ALA  57   2.120   6.556   2.389
  401   1HB   ALA  57          1HB       ALA  57   4.452   6.414   4.312
  402   2HB   ALA  57          2HB       ALA  57   4.443   7.356   2.822
  403   3HB   ALA  57          3HB       ALA  57   4.341   5.596   2.754
  404    H    ARG  58           H        ARG  58   2.255   6.229   5.816
  405    HA   ARG  58           HA       ARG  58   1.775   3.386   5.699
  406   1HB   ARG  58          1HB       ARG  58   1.557   3.390   8.138
  407   2HB   ARG  58          2HB       ARG  58   2.932   4.364   7.644
  408   1HG   ARG  58          1HG       ARG  58   1.675   6.380   8.014
  409   2HG   ARG  58          2HG       ARG  58   0.262   5.430   8.480
  410   1HD   ARG  58          1HD       ARG  58   2.934   5.359   9.858
  411   2HD   ARG  58          2HD       ARG  58   1.534   6.280  10.412
  412    HE   ARG  58           HE       ARG  58   0.704   3.670  10.103
  413   1HH1  ARG  58          1HH1      ARG  58   3.096   5.368  12.049
  414   2HH1  ARG  58          2HH1      ARG  58   2.966   4.329  13.392
  415   1HH2  ARG  58          1HH2      ARG  58   0.524   2.201  11.934
  416   2HH2  ARG  58          2HH2      ARG  58   1.495   2.467  13.304
  417    H    LYS  59           H        LYS  59  -0.248   6.207   6.126
  418    HA   LYS  59           HA       LYS  59  -2.698   5.000   6.722
  419   1HB   LYS  59          1HB       LYS  59  -2.225   7.440   6.882
  420   2HB   LYS  59          2HB       LYS  59  -2.089   7.526   5.146
  421   1HG   LYS  59          1HG       LYS  59  -4.657   6.778   6.531
  422   2HG   LYS  59          2HG       LYS  59  -4.215   8.449   6.219
  423   1HD   LYS  59          1HD       LYS  59  -4.116   7.901   3.782
  424   2HD   LYS  59          2HD       LYS  59  -4.667   6.271   4.161
  425   1HE   LYS  59          1HE       LYS  59  -6.546   7.624   3.422
  426   2HE   LYS  59          2HE       LYS  59  -6.741   7.225   5.124
  427   1HZ   LYS  59          1HZ       LYS  59  -7.261   9.563   4.733
  428   2HZ   LYS  59          2HZ       LYS  59  -5.801   9.832   4.022
  429   3HZ   LYS  59          3HZ       LYS  59  -5.887   9.450   5.674
  430    H    LEU  60           H        LEU  60  -1.251   5.872   3.613
  431    HA   LEU  60           HA       LEU  60  -3.370   5.048   2.142
  432   1HB   LEU  60          1HB       LEU  60  -0.513   5.393   1.382
  433   2HB   LEU  60          2HB       LEU  60  -1.809   5.265   0.180
  434    HG   LEU  60           HG       LEU  60  -1.895   7.219   2.386
  435   1HD1  LEU  60          1HD1      LEU  60  -0.608   7.619  -0.332
  436   2HD1  LEU  60          2HD1      LEU  60   0.136   7.769   1.254
  437   3HD1  LEU  60          3HD1      LEU  60  -1.077   8.938   0.734
  438   1HD2  LEU  60          1HD2      LEU  60  -3.951   6.795   1.299
  439   2HD2  LEU  60          2HD2      LEU  60  -3.236   7.074  -0.291
  440   3HD2  LEU  60          3HD2      LEU  60  -3.416   8.413   0.845
  441    H    THR  61           H        THR  61  -0.371   3.488   3.076
  442    HA   THR  61           HA       THR  61  -0.527   1.068   1.642
  443    HB   THR  61           HB       THR  61   0.452   1.384   4.500
  444    HG1  THR  61           1HG      THR  61   1.561   2.775   2.993
  445   1HG2  THR  61          1HG2      THR  61   0.112  -0.962   3.828
  446   2HG2  THR  61          2HG2      THR  61   1.825  -0.601   4.022
  447   3HG2  THR  61          3HG2      THR  61   1.130  -0.706   2.411
  448    H    HIS  62           H        HIS  62  -1.877   2.140   4.620
  449    HA   HIS  62           HA       HIS  62  -3.005  -0.361   5.305
  450   1HB   HIS  62          1HB       HIS  62  -2.388   1.401   6.982
  451   2HB   HIS  62          2HB       HIS  62  -3.686   2.392   6.363
  452    HD1  HIS  62           1HD      HIS  62  -2.967  -0.455   8.609
  453    HD2  HIS  62           2HD      HIS  62  -6.288   1.604   7.208
  454    HE1  HIS  62           1HE      HIS  62  -4.841  -1.133  10.102
  455    H    GLY  63           H        GLY  63  -4.292   2.442   3.613
  456   1HA   GLY  63          1HA       GLY  63  -6.925   1.431   3.636
  457   2HA   GLY  63          2HA       GLY  63  -6.391   2.730   2.610
  458    H    VAL  64           H        VAL  64  -4.267   1.106   1.299
  459    HA   VAL  64           HA       VAL  64  -5.903  -0.143  -0.730
  460    HB   VAL  64           HB       VAL  64  -2.885  -0.298  -0.296
  461   1HG1  VAL  64          1HG1      VAL  64  -3.692  -2.208  -1.680
  462   2HG1  VAL  64          2HG1      VAL  64  -2.730  -1.107  -2.641
  463   3HG1  VAL  64          3HG1      VAL  64  -4.471  -1.077  -2.775
  464   1HG2  VAL  64          1HG2      VAL  64  -3.631   1.973  -0.749
  465   2HG2  VAL  64          2HG2      VAL  64  -4.510   1.416  -2.173
  466   3HG2  VAL  64          3HG2      VAL  64  -2.751   1.329  -2.137
  467    H    MET  65           H        MET  65  -4.037  -1.105   1.876
  468    HA   MET  65           HA       MET  65  -3.969  -3.909   1.593
  469   1HB   MET  65          1HB       MET  65  -2.501  -2.775   3.160
  470   2HB   MET  65          2HB       MET  65  -3.860  -2.158   4.040
  471   1HG   MET  65          1HG       MET  65  -4.408  -4.282   4.881
  472   2HG   MET  65          2HG       MET  65  -3.126  -5.049   3.941
  473   1HE   MET  65          1HE       MET  65  -1.936  -4.970   7.723
  474   2HE   MET  65          2HE       MET  65  -2.496  -5.998   6.374
  475   3HE   MET  65          3HE       MET  65  -3.615  -4.874   7.176
  476    H    ASN  66           H        ASN  66  -6.080  -1.857   3.554
  477    HA   ASN  66           HA       ASN  66  -7.847  -3.924   4.313
  478   1HB   ASN  66          1HB       ASN  66  -7.570  -1.044   4.635
  479   2HB   ASN  66          2HB       ASN  66  -9.222  -1.578   4.814
  480   1HD2  ASN  66          1HD2      ASN  66  -6.003  -1.588   5.989
  481   2HD2  ASN  66          2HD2      ASN  66  -6.325  -2.333   7.525
  482    H    LYS  67           H        LYS  67  -7.815  -1.678   1.611
  483    HA   LYS  67           HA       LYS  67 -10.352  -2.015   0.638
  484   1HB   LYS  67          1HB       LYS  67  -8.740  -0.362  -0.185
  485   2HB   LYS  67          2HB       LYS  67  -7.724  -1.651  -0.798
  486   1HG   LYS  67          1HG       LYS  67  -9.571  -2.278  -2.345
  487   2HG   LYS  67          2HG       LYS  67 -10.442  -0.840  -1.800
  488   1HD   LYS  67          1HD       LYS  67  -8.575   0.568  -2.526
  489   2HD   LYS  67          2HD       LYS  67  -7.695  -0.862  -3.054
  490   1HE   LYS  67          1HE       LYS  67  -8.706   0.161  -4.967
  491   2HE   LYS  67          2HE       LYS  67  -9.532  -1.355  -4.629
  492   1HZ   LYS  67          1HZ       LYS  67 -11.152   0.298  -5.119
  493   2HZ   LYS  67          2HZ       LYS  67 -10.466   1.386  -4.071
  494   3HZ   LYS  67          3HZ       LYS  67 -11.272   0.045  -3.449
  495    H    GLU  68           H        GLU  68  -7.370  -3.889  -0.023
  496    HA   GLU  68           HA       GLU  68  -9.015  -5.625  -1.471
  497   1HB   GLU  68          1HB       GLU  68  -6.990  -6.884  -1.942
  498   2HB   GLU  68          2HB       GLU  68  -7.017  -5.153  -2.348
  499   1HG   GLU  68          1HG       GLU  68  -5.588  -4.669  -0.495
  500   2HG   GLU  68          2HG       GLU  68  -5.467  -6.381  -0.076
  501    H    LEU  69           H        LEU  69  -7.593  -5.756   1.762
  502    HA   LEU  69           HA       LEU  69  -8.412  -8.336   2.186
  503   1HB   LEU  69          1HB       LEU  69  -8.154  -5.939   3.941
  504   2HB   LEU  69          2HB       LEU  69  -9.078  -7.269   4.583
  505    HG   LEU  69           HG       LEU  69  -6.709  -7.101   5.304
  506   1HD1  LEU  69          1HD1      LEU  69  -7.505  -9.642   3.843
  507   2HD1  LEU  69          2HD1      LEU  69  -7.968  -9.212   5.489
  508   3HD1  LEU  69          3HD1      LEU  69  -6.279  -9.542   5.106
  509   1HD2  LEU  69          1HD2      LEU  69  -5.709  -6.469   3.208
  510   2HD2  LEU  69          2HD2      LEU  69  -6.138  -8.036   2.514
  511   3HD2  LEU  69          3HD2      LEU  69  -4.975  -7.938   3.842
  512    H    LYS  70           H        LYS  70 -10.495  -5.430   1.850
  513    HA   LYS  70           HA       LYS  70 -12.736  -6.976   2.732
  514   1HB   LYS  70          1HB       LYS  70 -14.014  -4.917   2.508
  515   2HB   LYS  70          2HB       LYS  70 -12.467  -4.600   3.282
  516   1HG   LYS  70          1HG       LYS  70 -11.603  -3.501   1.471
  517   2HG   LYS  70          2HG       LYS  70 -12.886  -4.058   0.397
  518   1HD   LYS  70          1HD       LYS  70 -13.201  -1.714   1.066
  519   2HD   LYS  70          2HD       LYS  70 -14.512  -2.765   1.590
  520   1HE   LYS  70          1HE       LYS  70 -13.950  -1.192   3.369
  521   2HE   LYS  70          2HE       LYS  70 -13.542  -2.831   3.854
  522   1HZ   LYS  70          1HZ       LYS  70 -11.228  -2.362   3.326
  523   2HZ   LYS  70          2HZ       LYS  70 -11.850  -1.326   4.476
  524   3HZ   LYS  70          3HZ       LYS  70 -11.625  -0.754   2.908
  525    H    TYR  71           H        TYR  71 -11.251  -6.059  -0.309
  526    HA   TYR  71           HA       TYR  71 -13.541  -7.232  -1.778
  527   1HB   TYR  71          1HB       TYR  71 -11.320  -5.441  -2.764
  528   2HB   TYR  71          2HB       TYR  71 -12.655  -6.058  -3.729
  529    HD1  TYR  71           1HD      TYR  71 -11.840  -3.107  -3.143
  530    HD2  TYR  71           2HD      TYR  71 -14.757  -5.703  -1.433
  531    HE1  TYR  71           1HE      TYR  71 -13.189  -1.166  -2.469
  532    HE2  TYR  71           2HE      TYR  71 -16.074  -3.828  -0.750
  533    HH   TYR  71           HH       TYR  71 -15.816  -1.429  -0.306
  534    H    CYS  72           H        CYS  72 -11.031  -8.533  -0.509
  535    HA   CYS  72           HA       CYS  72 -10.669 -10.413  -2.736
  536   1HB   CYS  72          1HB       CYS  72  -8.603  -9.178  -0.978
  537   2HB   CYS  72          2HB       CYS  72  -8.222 -10.716  -1.610
  538    HG   CYS  72           HG       CYS  72  -6.953  -8.583  -3.020
  539    H    LYS  73           H        LYS  73 -10.162  -9.797   0.698
  540    HA   LYS  73           HA       LYS  73 -10.740 -10.860   2.559
  541   1HB   LYS  73          1HB       LYS  73 -12.273 -12.731   0.769
  542   2HB   LYS  73          2HB       LYS  73 -12.349 -12.745   2.516
  543   1HG   LYS  73          1HG       LYS  73 -13.312 -10.548   2.588
  544   2HG   LYS  73          2HG       LYS  73 -13.050 -10.323   0.857
  545   1HD   LYS  73          1HD       LYS  73 -14.584 -12.043   0.352
  546   2HD   LYS  73          2HD       LYS  73 -14.820 -12.438   2.062
  547   1HE   LYS  73          1HE       LYS  73 -16.687 -11.133   1.294
  548   2HE   LYS  73          2HE       LYS  73 -15.721 -10.142   2.380
  549   1HZ   LYS  73          1HZ       LYS  73 -14.793  -8.979   0.447
  550   2HZ   LYS  73          2HZ       LYS  73 -16.463  -8.935   0.425
  551   3HZ   LYS  73          3HZ       LYS  73 -15.656  -9.991  -0.599
  552    H    ASN  74           H        ASN  74  -9.570 -12.878  -0.005
  553    HA   ASN  74           HA       ASN  74  -8.268 -14.614   1.928
  554   1HB   ASN  74          1HB       ASN  74  -8.141 -14.798  -1.094
  555   2HB   ASN  74          2HB       ASN  74  -7.705 -16.047   0.064
  556   1HD2  ASN  74          1HD2      ASN  74  -9.464 -16.933   1.368
  557   2HD2  ASN  74          2HD2      ASN  74 -11.058 -17.001   0.724
  558    HA   PRO  75           HA       PRO  75  -4.888 -11.739   1.396
  559   1HB   PRO  75          1HB       PRO  75  -3.317 -12.805   3.175
  560   2HB   PRO  75          2HB       PRO  75  -4.515 -11.527   3.413
  561   1HG   PRO  75          1HG       PRO  75  -4.677 -14.485   4.160
  562   2HG   PRO  75          2HG       PRO  75  -5.505 -13.148   4.971
  563   1HD   PRO  75          1HD       PRO  75  -6.595 -14.940   3.190
  564   2HD   PRO  75          2HD       PRO  75  -7.288 -13.356   3.591
  565    H    GLU  76           H        GLU  76  -4.855 -14.984   1.013
  566    HA   GLU  76           HA       GLU  76  -2.279 -15.511   0.125
  567   1HB   GLU  76          1HB       GLU  76  -4.166 -17.152   0.227
  568   2HB   GLU  76          2HB       GLU  76  -4.847 -16.377  -1.186
  569   1HG   GLU  76          1HG       GLU  76  -2.785 -17.002  -2.432
  570   2HG   GLU  76          2HG       GLU  76  -2.296 -17.945  -1.019
  571    H    ASP  77           H        ASP  77  -4.611 -13.460  -0.953
  572    HA   ASP  77           HA       ASP  77  -3.508 -13.073  -3.699
  573   1HB   ASP  77          1HB       ASP  77  -6.184 -12.293  -2.530
  574   2HB   ASP  77          2HB       ASP  77  -5.590 -11.694  -4.071
  575    H    LEU  78           H        LEU  78  -3.381 -11.887  -0.600
  576    HA   LEU  78           HA       LEU  78  -3.269  -9.132  -1.218
  577   1HB   LEU  78          1HB       LEU  78  -4.154 -10.039   0.843
  578   2HB   LEU  78          2HB       LEU  78  -2.628 -10.859   1.105
  579    HG   LEU  78           HG       LEU  78  -1.541  -8.723   1.180
  580   1HD1  LEU  78          1HD1      LEU  78  -3.224  -7.276   0.149
  581   2HD1  LEU  78          2HD1      LEU  78  -2.927  -6.757   1.824
  582   3HD1  LEU  78          3HD1      LEU  78  -4.358  -7.692   1.440
  583   1HD2  LEU  78          1HD2      LEU  78  -3.564  -9.335   3.268
  584   2HD2  LEU  78          2HD2      LEU  78  -2.187  -8.233   3.466
  585   3HD2  LEU  78          3HD2      LEU  78  -1.916  -9.945   3.092
  586    H    GLU  79           H        GLU  79  -1.649  -8.840  -2.513
  587    HA   GLU  79           HA       GLU  79   1.098  -9.363  -1.695
  588   1HB   GLU  79          1HB       GLU  79   0.304 -11.182  -3.209
  589   2HB   GLU  79          2HB       GLU  79  -0.260  -9.897  -4.281
  590   1HG   GLU  79          1HG       GLU  79   1.688 -10.873  -5.034
  591   2HG   GLU  79          2HG       GLU  79   1.899  -9.169  -4.712
  592    H    CYS  80           H        CYS  80   2.363  -7.748  -2.473
  593    HA   CYS  80           HA       CYS  80   0.926  -5.449  -3.510
  594   1HB   CYS  80          1HB       CYS  80   2.472  -4.851  -1.793
  595   2HB   CYS  80          2HB       CYS  80   3.807  -5.728  -2.513
  596    HG   CYS  80           HG       CYS  80   4.642  -3.840  -4.030
  597    H    ASN  81           H        ASN  81   0.406  -6.665  -5.310
  598    HA   ASN  81           HA       ASN  81   2.658  -7.246  -6.955
  599   1HB   ASN  81          1HB       ASN  81   1.180  -8.574  -8.410
  600   2HB   ASN  81          2HB       ASN  81   0.926  -9.036  -6.728
  601   1HD2  ASN  81          1HD2      ASN  81  -1.030  -8.581  -5.875
  602   2HD2  ASN  81          2HD2      ASN  81  -2.375  -8.048  -6.801
  603    H    GLU  82           H        GLU  82   1.822  -6.977  -9.409
  604    HA   GLU  82           HA       GLU  82   1.974  -4.471 -10.162
  605   1HB   GLU  82          1HB       GLU  82   0.964  -6.909 -11.182
  606   2HB   GLU  82          2HB       GLU  82   0.720  -5.529 -12.262
  607   1HG   GLU  82          1HG       GLU  82   2.862  -6.557 -12.883
  608   2HG   GLU  82          2HG       GLU  82   3.138  -5.030 -12.032
  609    H    ASN  83           H        ASN  83  -0.998  -6.378 -10.042
  610    HA   ASN  83           HA       ASN  83  -2.975  -4.578 -10.841
  611   1HB   ASN  83          1HB       ASN  83  -3.238  -7.067 -10.424
  612   2HB   ASN  83          2HB       ASN  83  -3.148  -6.755  -8.708
  613   1HD2  ASN  83          1HD2      ASN  83  -5.320  -7.990 -10.131
  614   2HD2  ASN  83          2HD2      ASN  83  -6.709  -7.002  -9.932
  615    H    VAL  84           H        VAL  84  -1.684  -5.456  -7.626
  616    HA   VAL  84           HA       VAL  84  -3.276  -3.637  -6.277
  617    HB   VAL  84           HB       VAL  84  -0.677  -4.934  -5.494
  618   1HG1  VAL  84          1HG1      VAL  84  -0.932  -2.870  -4.194
  619   2HG1  VAL  84          2HG1      VAL  84  -1.175  -4.317  -3.214
  620   3HG1  VAL  84          3HG1      VAL  84  -2.568  -3.363  -3.730
  621   1HG2  VAL  84          1HG2      VAL  84  -2.107  -6.284  -4.146
  622   2HG2  VAL  84          2HG2      VAL  84  -2.601  -6.354  -5.854
  623   3HG2  VAL  84          3HG2      VAL  84  -3.502  -5.363  -4.686
  624    H    LYS  85           H        LYS  85   0.044  -3.374  -7.426
  625    HA   LYS  85           HA       LYS  85   0.740  -0.792  -6.517
  626   1HB   LYS  85          1HB       LYS  85   1.481  -2.162  -9.090
  627   2HB   LYS  85          2HB       LYS  85   2.257  -0.714  -8.464
  628   1HG   LYS  85          1HG       LYS  85   3.088  -1.878  -6.594
  629   2HG   LYS  85          2HG       LYS  85   2.134  -3.310  -6.991
  630   1HD   LYS  85          1HD       LYS  85   3.429  -3.409  -9.153
  631   2HD   LYS  85          2HD       LYS  85   4.489  -2.169  -8.462
  632   1HE   LYS  85          1HE       LYS  85   4.948  -3.570  -6.580
  633   2HE   LYS  85          2HE       LYS  85   3.783  -4.743  -7.209
  634   1HZ   LYS  85          1HZ       LYS  85   5.187  -5.192  -9.067
  635   2HZ   LYS  85          2HZ       LYS  85   6.120  -5.370  -7.676
  636   3HZ   LYS  85          3HZ       LYS  85   6.289  -3.987  -8.630
  637    H    HIS  86           H        HIS  86  -0.838  -1.828  -9.355
  638    HA   HIS  86           HA       HIS  86  -1.048   0.648 -10.567
  639   1HB   HIS  86          1HB       HIS  86  -1.578  -1.376 -11.840
  640   2HB   HIS  86          2HB       HIS  86  -3.043  -1.606 -10.884
  641    HD1  HIS  86           1HD      HIS  86  -1.559   0.779 -13.416
  642    HD2  HIS  86           2HD      HIS  86  -5.241  -0.195 -11.769
  643    HE1  HIS  86           1HE      HIS  86  -3.228   2.158 -14.665
  644    H    LYS  87           H        LYS  87  -3.399  -1.033  -8.551
  645    HA   LYS  87           HA       LYS  87  -5.347   1.105  -8.440
  646   1HB   LYS  87          1HB       LYS  87  -4.846  -0.919  -6.252
  647   2HB   LYS  87          2HB       LYS  87  -6.265   0.074  -6.452
  648   1HG   LYS  87          1HG       LYS  87  -6.648  -1.245  -8.607
  649   2HG   LYS  87          2HG       LYS  87  -5.442  -2.373  -7.964
  650   1HD   LYS  87          1HD       LYS  87  -6.742  -2.490  -5.854
  651   2HD   LYS  87          2HD       LYS  87  -7.981  -1.486  -6.592
  652   1HE   LYS  87          1HE       LYS  87  -8.810  -3.631  -6.838
  653   2HE   LYS  87          2HE       LYS  87  -8.047  -3.271  -8.389
  654   1HZ   LYS  87          1HZ       LYS  87  -6.663  -4.795  -6.239
  655   2HZ   LYS  87          2HZ       LYS  87  -6.222  -4.666  -7.886
  656   3HZ   LYS  87          3HZ       LYS  87  -7.581  -5.508  -7.441
  657    H    THR  88           H        THR  88  -2.505   0.547  -6.782
  658    HA   THR  88           HA       THR  88  -3.093   2.237  -4.608
  659    HB   THR  88           HB       THR  88  -0.657   0.961  -5.686
  660    HG1  THR  88           1HG      THR  88  -1.983  -0.466  -4.739
  661   1HG2  THR  88          1HG2      THR  88  -0.963   2.641  -3.203
  662   2HG2  THR  88          2HG2      THR  88  -0.055   3.009  -4.686
  663   3HG2  THR  88          3HG2      THR  88   0.471   1.670  -3.644
  664    H    LYS  89           H        LYS  89  -0.771   2.547  -7.260
  665    HA   LYS  89           HA       LYS  89  -0.225   5.077  -6.460
  666   1HB   LYS  89          1HB       LYS  89   0.775   5.339  -8.905
  667   2HB   LYS  89          2HB       LYS  89   1.514   4.332  -7.673
  668   1HG   LYS  89          1HG       LYS  89   1.487   3.103  -9.715
  669   2HG   LYS  89          2HG       LYS  89   0.287   2.407  -8.614
  670   1HD   LYS  89          1HD       LYS  89  -0.910   2.425 -10.417
  671   2HD   LYS  89          2HD       LYS  89  -1.221   4.002  -9.780
  672   1HE   LYS  89          1HE       LYS  89   0.965   3.677 -11.834
  673   2HE   LYS  89          2HE       LYS  89  -0.700   3.889 -12.347
  674   1HZ   LYS  89          1HZ       LYS  89   0.822   5.844 -10.664
  675   2HZ   LYS  89          2HZ       LYS  89  -0.750   6.035 -11.309
  676   3HZ   LYS  89          3HZ       LYS  89   0.568   5.944 -12.315
  677    H    GLU  90           H        GLU  90  -2.605   3.867  -8.697
  678    HA   GLU  90           HA       GLU  90  -3.448   6.389  -9.736
  679   1HB   GLU  90          1HB       GLU  90  -4.918   3.767  -9.519
  680   2HB   GLU  90          2HB       GLU  90  -5.580   5.187 -10.321
  681   1HG   GLU  90          1HG       GLU  90  -3.034   3.778 -11.087
  682   2HG   GLU  90          2HG       GLU  90  -4.585   3.614 -11.907
  683    H    TYR  91           H        TYR  91  -4.286   4.577  -6.819
  684    HA   TYR  91           HA       TYR  91  -6.543   6.166  -6.203
  685   1HB   TYR  91          1HB       TYR  91  -6.666   4.123  -5.100
  686   2HB   TYR  91          2HB       TYR  91  -4.940   4.067  -4.796
  687    HD1  TYR  91           1HD      TYR  91  -7.941   6.095  -3.769
  688    HD2  TYR  91           2HD      TYR  91  -4.239   4.321  -2.646
  689    HE1  TYR  91           1HE      TYR  91  -8.308   6.797  -1.426
  690    HE2  TYR  91           2HE      TYR  91  -4.560   5.005  -0.362
  691    HH   TYR  91           HH       TYR  91  -7.564   6.168   0.820
  692    H    ILE  92           H        ILE  92  -3.181   5.924  -5.195
  693    HA   ILE  92           HA       ILE  92  -2.925   8.022  -3.431
  694    HB   ILE  92           HB       ILE  92  -1.004   7.169  -5.592
  695   1HG1  ILE  92          1HG1      ILE  92  -1.857   5.611  -3.680
  696   2HG1  ILE  92          2HG1      ILE  92  -0.142   5.549  -4.137
  697   1HG2  ILE  92          1HG2      ILE  92  -0.458   9.381  -4.845
  698   2HG2  ILE  92          2HG2      ILE  92   0.783   8.251  -4.270
  699   3HG2  ILE  92          3HG2      ILE  92  -0.463   8.861  -3.164
  700   1HD1  ILE  92          1HD1      ILE  92  -0.450   5.491  -1.774
  701   2HD1  ILE  92          2HD1      ILE  92  -1.518   6.903  -1.886
  702   3HD1  ILE  92          3HD1      ILE  92   0.221   7.066  -2.240
  703    H    LYS  93           H        LYS  93  -2.389   8.334  -6.932
  704    HA   LYS  93           HA       LYS  93  -2.040  11.096  -6.643
  705   1HB   LYS  93          1HB       LYS  93  -2.338  11.256  -9.135
  706   2HB   LYS  93          2HB       LYS  93  -1.114  10.124  -8.621
  707   1HG   LYS  93          1HG       LYS  93  -2.131   8.971 -10.338
  708   2HG   LYS  93          2HG       LYS  93  -2.979   8.343  -8.933
  709   1HD   LYS  93          1HD       LYS  93  -4.583   8.774 -10.672
  710   2HD   LYS  93          2HD       LYS  93  -4.811   9.972  -9.401
  711   1HE   LYS  93          1HE       LYS  93  -3.645  11.639 -10.683
  712   2HE   LYS  93          2HE       LYS  93  -3.204  10.451 -11.912
  713   1HZ   LYS  93          1HZ       LYS  93  -5.972  11.345 -11.281
  714   2HZ   LYS  93          2HZ       LYS  93  -5.531  10.209 -12.452
  715   3HZ   LYS  93          3HZ       LYS  93  -5.051  11.794 -12.623
  716    H    LYS  94           H        LYS  94  -4.951   9.250  -7.252
  717    HA   LYS  94           HA       LYS  94  -6.435  11.598  -7.783
  718   1HB   LYS  94          1HB       LYS  94  -6.997   9.110  -8.369
  719   2HB   LYS  94          2HB       LYS  94  -7.610   8.995  -6.739
  720   1HG   LYS  94          1HG       LYS  94  -8.677  10.878  -8.862
  721   2HG   LYS  94          2HG       LYS  94  -9.359   9.314  -8.463
  722   1HD   LYS  94          1HD       LYS  94  -9.122  11.632  -6.560
  723   2HD   LYS  94          2HD       LYS  94 -10.581  11.227  -7.464
  724   1HE   LYS  94          1HE       LYS  94 -10.632   9.042  -6.349
  725   2HE   LYS  94          2HE       LYS  94  -9.200   9.486  -5.419
  726   1HZ   LYS  94          1HZ       LYS  94 -11.831  10.863  -5.311
  727   2HZ   LYS  94          2HZ       LYS  94 -10.470  11.306  -4.435
  728   3HZ   LYS  94          3HZ       LYS  94 -11.203   9.834  -4.135
  729    H    TYR  95           H        TYR  95  -5.642   9.742  -4.934
  730    HA   TYR  95           HA       TYR  95  -7.294  10.974  -3.069
  731   1HB   TYR  95          1HB       TYR  95  -6.211   8.924  -2.655
  732   2HB   TYR  95          2HB       TYR  95  -4.647   9.667  -3.005
  733    HD1  TYR  95           1HD      TYR  95  -3.386  10.540  -1.244
  734    HD2  TYR  95           2HD      TYR  95  -7.511   9.772  -0.626
  735    HE1  TYR  95           1HE      TYR  95  -3.113  11.047   1.070
  736    HE2  TYR  95           2HE      TYR  95  -7.244  10.276   1.748
  737    HH   TYR  95           HH       TYR  95  -4.363  11.621   2.998
  738    H    MET  96           H        MET  96  -3.929  11.635  -3.896
  739    HA   MET  96           HA       MET  96  -3.666  13.779  -2.153
  740   1HB   MET  96          1HB       MET  96  -2.147  13.460  -4.737
  741   2HB   MET  96          2HB       MET  96  -1.706  14.378  -3.298
  742   1HG   MET  96          1HG       MET  96  -1.944  11.391  -3.421
  743   2HG   MET  96          2HG       MET  96  -0.437  12.304  -3.463
  744   1HE   MET  96          1HE       MET  96   0.355  13.837  -1.510
  745   2HE   MET  96          2HE       MET  96  -0.495  13.996   0.051
  746   3HE   MET  96          3HE       MET  96  -1.221  14.617  -1.446
  747    H    GLN  97           H        GLN  97  -5.069  13.607  -5.213
  748    HA   GLN  97           HA       GLN  97  -5.054  16.391  -5.832
  749   1HB   GLN  97          1HB       GLN  97  -7.276  14.538  -6.680
  750   2HB   GLN  97          2HB       GLN  97  -6.826  16.061  -7.422
  751   1HG   GLN  97          1HG       GLN  97  -5.418  13.438  -7.502
  752   2HG   GLN  97          2HG       GLN  97  -6.032  14.383  -8.844
  753   1HE2  GLN  97          1HE2      GLN  97  -3.536  13.800  -6.667
  754   2HE2  GLN  97          2HE2      GLN  97  -2.324  14.834  -7.278
  755    H    LYS  98           H        LYS  98  -6.829  14.680  -3.502
  756    HA   LYS  98           HA       LYS  98  -8.952  16.579  -3.406
  757   1HB   LYS  98          1HB       LYS  98  -9.937  15.302  -1.670
  758   2HB   LYS  98          2HB       LYS  98  -9.149  14.162  -2.709
  759   1HG   LYS  98          1HG       LYS  98  -7.839  13.349  -1.062
  760   2HG   LYS  98          2HG       LYS  98  -7.372  14.974  -0.563
  761   1HD   LYS  98          1HD       LYS  98  -9.946  13.511   0.093
  762   2HD   LYS  98          2HD       LYS  98  -8.569  13.716   1.178
  763   1HE   LYS  98          1HE       LYS  98  -8.929  15.979   1.454
  764   2HE   LYS  98          2HE       LYS  98  -9.882  16.164  -0.001
  765   1HZ   LYS  98          1HZ       LYS  98 -11.677  14.964   1.091
  766   2HZ   LYS  98          2HZ       LYS  98 -11.201  16.324   1.975
  767   3HZ   LYS  98          3HZ       LYS  98 -10.746  14.808   2.497
  768    H    PHE  99           H        PHE  99  -5.833  16.381  -2.052
  769    HA   PHE  99           HA       PHE  99  -6.353  18.023   0.240
  770   1HB   PHE  99          1HB       PHE  99  -3.770  17.125  -1.010
  771   2HB   PHE  99          2HB       PHE  99  -3.833  18.186   0.391
  772    HD1  PHE  99           1HD      PHE  99  -5.673  17.210   2.190
  773    HD2  PHE  99           2HD      PHE  99  -3.244  14.965  -0.485
  774    HE1  PHE  99           1HE      PHE  99  -5.825  15.260   3.687
  775    HE2  PHE  99           2HE      PHE  99  -3.388  13.010   1.054
  776    HZ   PHE  99           HZ       PHE  99  -4.738  13.182   3.089
  777    H    GLY 100           H        GLY 100  -5.039  18.623  -2.952
  778   1HA   GLY 100          1HA       GLY 100  -5.489  20.723  -3.994
  779   2HA   GLY 100          2HA       GLY 100  -5.401  21.471  -2.399
  780    H    ALA 101           H        ALA 101  -3.686  22.596  -2.197
  781    HA   ALA 101           HA       ALA 101  -1.361  22.190  -3.873
  782   1HB   ALA 101          1HB       ALA 101  -1.780  24.079  -1.573
  783   2HB   ALA 101          2HB       ALA 101  -2.235  24.422  -3.238
  784   3HB   ALA 101          3HB       ALA 101  -0.530  24.188  -2.821
  785    H    VAL 102           H        VAL 102  -2.099  21.902  -0.403
  786    HA   VAL 102           HA       VAL 102   0.325  20.362  -0.197
  787    HB   VAL 102           HB       VAL 102   0.115  21.026   2.244
  788   1HG1  VAL 102          1HG1      VAL 102   1.600  23.034   1.842
  789   2HG1  VAL 102          2HG1      VAL 102   1.175  22.911   0.126
  790   3HG1  VAL 102          3HG1      VAL 102   2.041  21.596   0.927
  791   1HG2  VAL 102          1HG2      VAL 102  -0.654  23.363   2.619
  792   2HG2  VAL 102          2HG2      VAL 102  -1.940  22.235   2.183
  793   3HG2  VAL 102          3HG2      VAL 102  -1.301  23.349   0.976
  794    H    TYR 103           H        TYR 103   0.354  18.870   1.441
  795    HA   TYR 103           HA       TYR 103  -2.039  17.381   1.506
  796   1HB   TYR 103          1HB       TYR 103  -0.132  16.072   1.130
  797   2HB   TYR 103          2HB       TYR 103   0.799  16.959   2.313
  798    HD1  TYR 103           1HD      TYR 103  -2.498  15.345   2.792
  799    HD2  TYR 103           2HD      TYR 103   1.609  15.318   3.664
  800    HE1  TYR 103           1HE      TYR 103  -2.911  13.650   4.444
  801    HE2  TYR 103           2HE      TYR 103   1.257  13.568   5.343
  802    HH   TYR 103           HH       TYR 103  -0.561  12.850   6.801
  803    H    LYS 104           H        LYS 104  -3.518  18.010   2.813
  804    HA   LYS 104           HA       LYS 104  -2.865  18.739   5.545
  805   1HB   LYS 104          1HB       LYS 104  -5.026  20.046   5.379
  806   2HB   LYS 104          2HB       LYS 104  -3.648  20.643   4.450
  807   1HG   LYS 104          1HG       LYS 104  -4.583  19.622   2.438
  808   2HG   LYS 104          2HG       LYS 104  -5.980  19.083   3.368
  809   1HD   LYS 104          1HD       LYS 104  -6.642  21.099   2.308
  810   2HD   LYS 104          2HD       LYS 104  -6.291  21.477   4.004
  811   1HE   LYS 104          1HE       LYS 104  -4.092  22.331   3.390
  812   2HE   LYS 104          2HE       LYS 104  -4.401  21.935   1.700
  813   1HZ   LYS 104          1HZ       LYS 104  -6.277  23.513   1.769
  814   2HZ   LYS 104          2HZ       LYS 104  -4.805  24.258   2.093
  815   3HZ   LYS 104          3HZ       LYS 104  -5.855  23.903   3.356
  816    HA   PRO 105           HA       PRO 105  -5.070  14.664   5.641
  817   1HB   PRO 105          1HB       PRO 105  -4.138  14.006   8.134
  818   2HB   PRO 105          2HB       PRO 105  -3.271  13.660   6.634
  819   1HG   PRO 105          1HG       PRO 105  -2.937  15.902   8.550
  820   2HG   PRO 105          2HG       PRO 105  -1.683  14.948   7.696
  821   1HD   PRO 105          1HD       PRO 105  -2.383  17.433   6.981
  822   2HD   PRO 105          2HD       PRO 105  -1.912  16.235   5.766
  823    H    LYS 106           H        LYS 106  -5.004  17.136   8.111
  824    HA   LYS 106           HA       LYS 106  -7.289  16.407   9.492
  825   1HB   LYS 106          1HB       LYS 106  -7.481  18.682  10.229
  826   2HB   LYS 106          2HB       LYS 106  -5.778  18.270  10.132
  827   1HG   LYS 106          1HG       LYS 106  -5.735  19.400   7.903
  828   2HG   LYS 106          2HG       LYS 106  -7.378  19.951   8.235
  829   1HD   LYS 106          1HD       LYS 106  -6.508  20.974  10.343
  830   2HD   LYS 106          2HD       LYS 106  -4.879  20.583   9.775
  831   1HE   LYS 106          1HE       LYS 106  -5.227  22.797   9.093
  832   2HE   LYS 106          2HE       LYS 106  -5.495  21.778   7.672
  833   1HZ   LYS 106          1HZ       LYS 106  -7.629  22.922   9.378
  834   2HZ   LYS 106          2HZ       LYS 106  -7.912  21.954   8.037
  835   3HZ   LYS 106          3HZ       LYS 106  -7.195  23.476   7.852
  836    H    GLU 107           H        GLU 107  -7.013  17.629   6.282
  837    HA   GLU 107           HA       GLU 107  -9.900  18.066   6.137
  838   1HB   GLU 107          1HB       GLU 107  -7.758  18.884   4.175
  839   2HB   GLU 107          2HB       GLU 107  -9.469  19.244   4.042
  840   1HG   GLU 107          1HG       GLU 107  -7.540  20.314   6.083
  841   2HG   GLU 107          2HG       GLU 107  -8.315  21.195   4.772
  842    H    ASP 108           H        ASP 108  -8.144  15.519   6.028
  843    HA   ASP 108           HA       ASP 108  -8.326  14.538   3.410
  844   1HB   ASP 108          1HB       ASP 108  -6.630  13.593   4.675
  845   2HB   ASP 108          2HB       ASP 108  -7.608  13.367   6.100
  846    H    THR 109           H        THR 109  -9.499  12.305   3.169
  847    HA   THR 109           HA       THR 109 -12.286  12.775   3.214
  848    HB   THR 109           HB       THR 109 -11.192  11.463   1.450
  849    HG1  THR 109           1HG      THR 109 -13.262  10.878   1.603
  850   1HG2  THR 109          1HG2      THR 109 -10.653   9.406   3.588
  851   2HG2  THR 109          2HG2      THR 109  -9.465  10.475   2.872
  852   3HG2  THR 109          3HG2      THR 109 -10.253   9.244   1.865
  Start of MODEL    4
    1    H    THR  10           H        THR  10  -1.888 -22.002   1.486
    2    HA   THR  10           HA       THR  10  -1.866 -23.147   4.173
    3    HB   THR  10           HB       THR  10   0.637 -22.538   4.229
    4    HG1  THR  10           1HG      THR  10   0.370 -22.792   1.399
    5   1HG2  THR  10          1HG2      THR  10   1.387 -24.687   3.288
    6   2HG2  THR  10          2HG2      THR  10  -0.167 -24.865   2.471
    7   3HG2  THR  10          3HG2      THR  10  -0.092 -24.880   4.232
    8    H    SER  11           H        SER  11  -3.173 -21.083   2.824
    9    HA   SER  11           HA       SER  11  -1.771 -18.535   3.065
   10   1HB   SER  11          1HB       SER  11  -4.484 -19.232   2.224
   11   2HB   SER  11          2HB       SER  11  -3.537 -17.761   1.846
   12    HG   SER  11           HG       SER  11  -3.601 -19.639   0.179
   13    H    SER  12           H        SER  12  -3.510 -20.352   5.128
   14    HA   SER  12           HA       SER  12  -4.653 -18.112   6.379
   15   1HB   SER  12          1HB       SER  12  -4.992 -19.834   8.173
   16   2HB   SER  12          2HB       SER  12  -5.638 -20.178   6.543
   17    HG   SER  12           HG       SER  12  -4.000 -21.685   7.957
   18    H    GLU  13           H        GLU  13  -1.696 -20.258   6.935
   19    HA   GLU  13           HA       GLU  13  -0.741 -18.520   8.894
   20   1HB   GLU  13          1HB       GLU  13   1.231 -20.053   8.797
   21   2HB   GLU  13          2HB       GLU  13  -0.293 -20.872   9.099
   22   1HG   GLU  13          1HG       GLU  13  -0.405 -21.646   6.839
   23   2HG   GLU  13          2HG       GLU  13   0.954 -20.666   6.374
   24    H    LEU  14           H        LEU  14  -0.141 -19.134   5.477
   25    HA   LEU  14           HA       LEU  14   2.239 -17.888   4.918
   26   1HB   LEU  14          1HB       LEU  14   0.440 -19.127   3.474
   27   2HB   LEU  14          2HB       LEU  14  -0.144 -17.510   3.193
   28    HG   LEU  14           HG       LEU  14   2.664 -18.360   2.464
   29   1HD1  LEU  14          1HD1      LEU  14   1.072 -19.696   1.221
   30   2HD1  LEU  14          2HD1      LEU  14   1.851 -18.516   0.168
   31   3HD1  LEU  14          3HD1      LEU  14   0.204 -18.239   0.734
   32   1HD2  LEU  14          1HD2      LEU  14   2.621 -16.383   1.025
   33   2HD2  LEU  14          2HD2      LEU  14   2.343 -15.928   2.706
   34   3HD2  LEU  14          3HD2      LEU  14   0.990 -16.000   1.577
   35    H    ALA  15           H        ALA  15  -0.837 -16.705   5.584
   36    HA   ALA  15           HA       ALA  15  -0.573 -14.116   4.427
   37   1HB   ALA  15          1HB       ALA  15  -2.700 -15.208   6.173
   38   2HB   ALA  15          2HB       ALA  15  -2.658 -15.134   4.386
   39   3HB   ALA  15          3HB       ALA  15  -2.696 -13.655   5.336
   40    H    LYS  16           H        LYS  16  -0.040 -15.493   7.534
   41    HA   LYS  16           HA       LYS  16  -0.221 -13.110   9.022
   42   1HB   LYS  16          1HB       LYS  16  -0.194 -15.404   9.994
   43   2HB   LYS  16          2HB       LYS  16   1.483 -15.572   9.516
   44   1HG   LYS  16          1HG       LYS  16   2.133 -13.842  11.062
   45   2HG   LYS  16          2HG       LYS  16   0.442 -13.542  11.483
   46   1HD   LYS  16          1HD       LYS  16   0.256 -15.849  12.318
   47   2HD   LYS  16          2HD       LYS  16   1.948 -16.128  11.922
   48   1HE   LYS  16          1HE       LYS  16   0.939 -14.065  13.885
   49   2HE   LYS  16          2HE       LYS  16   1.591 -15.642  14.319
   50   1HZ   LYS  16          1HZ       LYS  16   3.227 -13.876  14.524
   51   2HZ   LYS  16          2HZ       LYS  16   3.086 -13.516  12.879
   52   3HZ   LYS  16          3HZ       LYS  16   3.679 -15.007  13.369
   53    H    LYS  17           H        LYS  17   2.171 -14.694   7.097
   54    HA   LYS  17           HA       LYS  17   4.210 -12.704   7.571
   55   1HB   LYS  17          1HB       LYS  17   4.214 -14.896   5.468
   56   2HB   LYS  17          2HB       LYS  17   5.579 -13.911   5.931
   57   1HG   LYS  17          1HG       LYS  17   5.961 -16.035   6.892
   58   2HG   LYS  17          2HG       LYS  17   5.407 -15.022   8.220
   59   1HD   LYS  17          1HD       LYS  17   3.181 -15.949   8.062
   60   2HD   LYS  17          2HD       LYS  17   3.634 -16.878   6.638
   61   1HE   LYS  17          1HE       LYS  17   4.864 -17.212   9.363
   62   2HE   LYS  17          2HE       LYS  17   3.531 -18.190   8.755
   63   1HZ   LYS  17          1HZ       LYS  17   5.014 -18.916   6.937
   64   2HZ   LYS  17          2HZ       LYS  17   5.556 -19.339   8.459
   65   3HZ   LYS  17          3HZ       LYS  17   6.293 -18.056   7.654
   66    H    SER  18           H        SER  18   1.806 -13.469   5.008
   67    HA   SER  18           HA       SER  18   3.114 -11.946   3.090
   68   1HB   SER  18          1HB       SER  18   0.983 -11.988   1.823
   69   2HB   SER  18          2HB       SER  18   1.522 -13.611   2.331
   70    HG   SER  18           HG       SER  18  -0.755 -12.882   2.552
   71    H    LYS  19           H        LYS  19   0.469 -11.135   5.162
   72    HA   LYS  19           HA       LYS  19  -0.040  -8.577   4.145
   73   1HB   LYS  19          1HB       LYS  19  -0.311  -9.370   7.036
   74   2HB   LYS  19          2HB       LYS  19  -1.191  -8.087   6.209
   75   1HG   LYS  19          1HG       LYS  19  -2.133  -9.958   4.703
   76   2HG   LYS  19          2HG       LYS  19  -1.504 -11.073   5.891
   77   1HD   LYS  19          1HD       LYS  19  -3.528  -8.894   6.413
   78   2HD   LYS  19          2HD       LYS  19  -3.863 -10.621   6.278
   79   1HE   LYS  19          1HE       LYS  19  -2.357 -11.003   8.171
   80   2HE   LYS  19          2HE       LYS  19  -2.158  -9.246   8.277
   81   1HZ   LYS  19          1HZ       LYS  19  -3.785 -10.059   9.872
   82   2HZ   LYS  19          2HZ       LYS  19  -4.722 -10.703   8.638
   83   3HZ   LYS  19          3HZ       LYS  19  -4.506  -9.022   8.763
   84    H    GLU  20           H        GLU  20   2.450  -9.591   6.312
   85    HA   GLU  20           HA       GLU  20   3.261  -6.932   7.048
   86   1HB   GLU  20          1HB       GLU  20   4.833  -9.494   7.171
   87   2HB   GLU  20          2HB       GLU  20   5.155  -8.010   8.065
   88   1HG   GLU  20          1HG       GLU  20   2.679  -9.523   8.182
   89   2HG   GLU  20          2HG       GLU  20   3.985  -9.846   9.343
   90    H    VAL  21           H        VAL  21   4.484  -9.459   4.904
   91    HA   VAL  21           HA       VAL  21   6.599  -7.929   3.754
   92    HB   VAL  21           HB       VAL  21   5.006 -10.214   2.554
   93   1HG1  VAL  21          1HG1      VAL  21   6.989 -10.566   1.136
   94   2HG1  VAL  21          2HG1      VAL  21   7.749  -9.150   1.864
   95   3HG1  VAL  21          3HG1      VAL  21   6.290  -8.964   0.891
   96   1HG2  VAL  21          1HG2      VAL  21   6.845 -11.676   3.309
   97   2HG2  VAL  21          2HG2      VAL  21   5.997 -10.917   4.654
   98   3HG2  VAL  21          3HG2      VAL  21   7.568 -10.303   4.148
   99    H    PHE  22           H        PHE  22   3.268  -8.331   3.016
  100    HA   PHE  22           HA       PHE  22   3.247  -6.957   0.496
  101   1HB   PHE  22          1HB       PHE  22   1.341  -8.281   0.778
  102   2HB   PHE  22          2HB       PHE  22   1.136  -7.800   2.458
  103    HD1  PHE  22           1HD      PHE  22  -0.581  -6.381   2.945
  104    HD2  PHE  22           2HD      PHE  22   1.087  -6.268  -0.941
  105    HE1  PHE  22           1HE      PHE  22  -2.175  -4.662   2.319
  106    HE2  PHE  22           2HE      PHE  22  -0.508  -4.513  -1.577
  107    HZ   PHE  22           HZ       PHE  22  -2.176  -3.711   0.096
  108    H    ARG  23           H        ARG  23   2.258  -6.019   3.700
  109    HA   ARG  23           HA       ARG  23   1.856  -3.328   2.962
  110   1HB   ARG  23          1HB       ARG  23   1.651  -2.721   5.274
  111   2HB   ARG  23          2HB       ARG  23   0.986  -4.333   5.073
  112   1HG   ARG  23          1HG       ARG  23   2.141  -4.683   6.979
  113   2HG   ARG  23          2HG       ARG  23   3.407  -5.027   5.820
  114   1HD   ARG  23          1HD       ARG  23   4.278  -3.586   7.577
  115   2HD   ARG  23          2HD       ARG  23   4.281  -2.746   6.027
  116    HE   ARG  23           HE       ARG  23   1.926  -2.024   7.156
  117   1HH1  ARG  23          1HH1      ARG  23   5.294  -1.853   8.305
  118   2HH1  ARG  23          2HH1      ARG  23   5.043  -0.481   9.261
  119   1HH2  ARG  23          1HH2      ARG  23   1.617  -0.100   8.453
  120   2HH2  ARG  23          2HH2      ARG  23   2.910   0.533   9.369
  121    H    LYS  24           H        LYS  24   4.787  -4.991   3.753
  122    HA   LYS  24           HA       LYS  24   6.386  -2.683   4.187
  123   1HB   LYS  24          1HB       LYS  24   7.048  -4.902   5.018
  124   2HB   LYS  24          2HB       LYS  24   7.164  -5.506   3.383
  125   1HG   LYS  24          1HG       LYS  24   8.906  -3.238   4.333
  126   2HG   LYS  24          2HG       LYS  24   9.331  -4.911   4.663
  127   1HD   LYS  24          1HD       LYS  24   8.828  -3.817   1.885
  128   2HD   LYS  24          2HD       LYS  24  10.422  -3.898   2.628
  129   1HE   LYS  24          1HE       LYS  24  10.210  -6.336   2.815
  130   2HE   LYS  24          2HE       LYS  24   8.601  -6.260   2.108
  131   1HZ   LYS  24          1HZ       LYS  24  11.003  -5.289   0.659
  132   2HZ   LYS  24          2HZ       LYS  24   9.475  -5.716   0.016
  133   3HZ   LYS  24          3HZ       LYS  24  10.480  -6.883   0.614
  134    H    GLU  25           H        GLU  25   5.793  -4.778   1.339
  135    HA   GLU  25           HA       GLU  25   7.547  -3.607  -0.480
  136   1HB   GLU  25          1HB       GLU  25   4.762  -4.517  -1.120
  137   2HB   GLU  25          2HB       GLU  25   6.149  -4.522  -2.184
  138   1HG   GLU  25          1HG       GLU  25   6.270  -6.118   0.260
  139   2HG   GLU  25          2HG       GLU  25   5.149  -6.571  -1.021
  140    H    MET  26           H        MET  26   4.180  -3.230   0.207
  141    HA   MET  26           HA       MET  26   3.681  -1.140  -1.578
  142   1HB   MET  26          1HB       MET  26   2.073  -2.731  -0.751
  143   2HB   MET  26          2HB       MET  26   2.185  -1.944   0.822
  144   1HG   MET  26          1HG       MET  26   0.200  -1.255  -0.701
  145   2HG   MET  26          2HG       MET  26   1.119  -0.011   0.145
  146   1HE   MET  26          1HE       MET  26   0.041  -1.397  -3.354
  147   2HE   MET  26          2HE       MET  26   1.708  -2.015  -3.419
  148   3HE   MET  26          3HE       MET  26   1.203  -0.620  -4.417
  149    H    SER  27           H        SER  27   4.609  -1.077   1.747
  150    HA   SER  27           HA       SER  27   4.081   1.668   2.184
  151   1HB   SER  27          1HB       SER  27   6.182  -0.050   3.557
  152   2HB   SER  27          2HB       SER  27   5.821   1.607   4.023
  153    HG   SER  27           HG       SER  27   3.955  -0.507   3.956
  154    H    GLN  28           H        GLN  28   6.805  -0.156   0.905
  155    HA   GLN  28           HA       GLN  28   8.506   2.115   0.649
  156   1HB   GLN  28          1HB       GLN  28   9.937   0.399   0.528
  157   2HB   GLN  28          2HB       GLN  28   8.530  -0.656   0.505
  158   1HG   GLN  28          1HG       GLN  28   9.631  -1.317  -1.133
  159   2HG   GLN  28          2HG       GLN  28   8.450  -0.264  -1.911
  160   1HE2  GLN  28          1HE2      GLN  28  11.844  -0.749  -1.283
  161   2HE2  GLN  28          2HE2      GLN  28  12.470   0.510  -2.286
  162    H    PHE  29           H        PHE  29   6.480   0.309  -1.472
  163    HA   PHE  29           HA       PHE  29   6.914   1.745  -3.803
  164   1HB   PHE  29          1HB       PHE  29   5.743  -0.403  -3.790
  165   2HB   PHE  29          2HB       PHE  29   4.419   0.304  -2.883
  166    HD1  PHE  29           1HD      PHE  29   6.096   0.159  -6.133
  167    HD2  PHE  29           2HD      PHE  29   2.726   1.542  -3.951
  168    HE1  PHE  29           1HE      PHE  29   4.928   0.658  -8.234
  169    HE2  PHE  29           2HE      PHE  29   1.567   2.043  -6.047
  170    HZ   PHE  29           HZ       PHE  29   2.637   1.598  -8.157
  171    H    ILE  30           H        ILE  30   4.385   2.222  -1.361
  172    HA   ILE  30           HA       ILE  30   3.274   4.523  -2.482
  173    HB   ILE  30           HB       ILE  30   3.235   3.477   0.348
  174   1HG1  ILE  30          1HG1      ILE  30   1.053   3.733  -1.712
  175   2HG1  ILE  30          2HG1      ILE  30   2.047   2.301  -1.509
  176   1HG2  ILE  30          1HG2      ILE  30   1.721   5.876  -0.707
  177   2HG2  ILE  30          2HG2      ILE  30   3.069   5.945   0.406
  178   3HG2  ILE  30          3HG2      ILE  30   1.555   5.172   0.908
  179   1HD1  ILE  30          1HD1      ILE  30  -0.097   2.048  -0.402
  180   2HD1  ILE  30          2HD1      ILE  30   0.230   3.459   0.598
  181   3HD1  ILE  30          3HD1      ILE  30   1.231   2.027   0.732
  182    H    VAL  31           H        VAL  31   5.785   4.162   0.026
  183    HA   VAL  31           HA       VAL  31   6.307   6.826   0.414
  184    HB   VAL  31           HB       VAL  31   8.108   4.407   0.423
  185   1HG1  VAL  31          1HG1      VAL  31   9.512   6.392  -0.222
  186   2HG1  VAL  31          2HG1      VAL  31   9.937   5.708   1.344
  187   3HG1  VAL  31          3HG1      VAL  31   8.989   7.185   1.270
  188   1HG2  VAL  31          1HG2      VAL  31   8.138   4.835   2.849
  189   2HG2  VAL  31          2HG2      VAL  31   6.486   4.687   2.232
  190   3HG2  VAL  31          3HG2      VAL  31   7.142   6.269   2.595
  191    H    GLN  32           H        GLN  32   7.612   4.741  -2.179
  192    HA   GLN  32           HA       GLN  32   9.165   6.537  -3.435
  193   1HB   GLN  32          1HB       GLN  32   9.120   4.171  -3.957
  194   2HB   GLN  32          2HB       GLN  32   7.488   4.313  -4.570
  195   1HG   GLN  32          1HG       GLN  32   8.776   4.174  -6.429
  196   2HG   GLN  32          2HG       GLN  32   8.404   5.891  -6.262
  197   1HE2  GLN  32          1HE2      GLN  32  10.585   6.036  -4.071
  198   2HE2  GLN  32          2HE2      GLN  32  12.027   6.117  -4.991
  199    H    CYS  33           H        CYS  33   5.772   5.770  -3.838
  200    HA   CYS  33           HA       CYS  33   5.123   7.453  -5.956
  201   1HB   CYS  33          1HB       CYS  33   3.499   6.269  -3.764
  202   2HB   CYS  33          2HB       CYS  33   2.769   7.125  -5.135
  203    HG   CYS  33           HG       CYS  33   4.441   4.188  -5.033
  204    H    LEU  34           H        LEU  34   5.071   7.970  -2.509
  205    HA   LEU  34           HA       LEU  34   3.908  10.597  -2.661
  206   1HB   LEU  34          1HB       LEU  34   5.262   9.212  -0.373
  207   2HB   LEU  34          2HB       LEU  34   4.461  10.761  -0.259
  208    HG   LEU  34           HG       LEU  34   3.162   8.124  -0.892
  209   1HD1  LEU  34          1HD1      LEU  34   3.022   9.926   1.527
  210   2HD1  LEU  34          2HD1      LEU  34   3.870   8.387   1.431
  211   3HD1  LEU  34          3HD1      LEU  34   2.112   8.433   1.298
  212   1HD2  LEU  34          1HD2      LEU  34   1.960  10.869  -0.564
  213   2HD2  LEU  34          2HD2      LEU  34   1.057   9.366  -0.717
  214   3HD2  LEU  34          3HD2      LEU  34   2.041   9.943  -2.061
  215    H    ASN  35           H        ASN  35   7.180   9.388  -2.618
  216    HA   ASN  35           HA       ASN  35   8.655  11.377  -1.891
  217   1HB   ASN  35          1HB       ASN  35   9.059   9.379  -3.889
  218   2HB   ASN  35          2HB       ASN  35  10.075  10.818  -4.153
  219   1HD2  ASN  35          1HD2      ASN  35   8.933   8.608  -1.777
  220   2HD2  ASN  35          2HD2      ASN  35  10.240   8.854  -0.713
  221    HA   PRO  36           HA       PRO  36   8.298  14.107  -5.910
  222   1HB   PRO  36          1HB       PRO  36   5.956  13.868  -7.315
  223   2HB   PRO  36          2HB       PRO  36   7.459  13.074  -7.787
  224   1HG   PRO  36          1HG       PRO  36   5.103  11.956  -6.341
  225   2HG   PRO  36          2HG       PRO  36   6.131  11.201  -7.572
  226   1HD   PRO  36          1HD       PRO  36   6.345  10.669  -4.934
  227   2HD   PRO  36          2HD       PRO  36   7.742  10.599  -6.010
  228    H    TYR  37           H        TYR  37   5.754  13.287  -3.760
  229    HA   TYR  37           HA       TYR  37   4.390  15.821  -4.068
  230   1HB   TYR  37          1HB       TYR  37   3.927  13.544  -2.147
  231   2HB   TYR  37          2HB       TYR  37   2.937  14.993  -2.240
  232    HD1  TYR  37           1HD      TYR  37   4.008  12.007  -4.084
  233    HD2  TYR  37           2HD      TYR  37   1.190  15.162  -3.845
  234    HE1  TYR  37           1HE      TYR  37   2.661  10.900  -5.744
  235    HE2  TYR  37           2HE      TYR  37  -0.183  14.101  -5.504
  236    HH   TYR  37           HH       TYR  37   0.167  12.480  -7.360
  237    H    ARG  38           H        ARG  38   6.804  14.397  -2.068
  238    HA   ARG  38           HA       ARG  38   6.411  16.331   0.050
  239   1HB   ARG  38          1HB       ARG  38   8.279  15.290   1.170
  240   2HB   ARG  38          2HB       ARG  38   7.177  14.056   0.557
  241   1HG   ARG  38          1HG       ARG  38   8.668  13.565  -1.224
  242   2HG   ARG  38          2HG       ARG  38   9.738  14.888  -0.755
  243   1HD   ARG  38          1HD       ARG  38   9.992  13.756   1.484
  244   2HD   ARG  38          2HD       ARG  38   8.998  12.456   0.836
  245    HE   ARG  38           HE       ARG  38  10.830  12.165  -0.854
  246   1HH1  ARG  38          1HH1      ARG  38  11.627  13.597   2.303
  247   2HH1  ARG  38          2HH1      ARG  38  13.142  12.830   2.398
  248   1HH2  ARG  38          1HH2      ARG  38  12.879  11.120  -0.674
  249   2HH2  ARG  38          2HH2      ARG  38  13.876  11.404   0.677
  250    H    LYS  39           H        LYS  39   7.739  16.493  -2.857
  251    HA   LYS  39           HA       LYS  39  10.064  18.097  -2.246
  252   1HB   LYS  39          1HB       LYS  39   8.663  17.504  -4.833
  253   2HB   LYS  39          2HB       LYS  39  10.240  18.262  -4.671
  254   1HG   LYS  39          1HG       LYS  39  11.121  16.292  -3.615
  255   2HG   LYS  39          2HG       LYS  39   9.537  15.536  -3.692
  256   1HD   LYS  39          1HD       LYS  39   9.614  15.696  -6.141
  257   2HD   LYS  39          2HD       LYS  39  11.244  16.371  -5.993
  258   1HE   LYS  39          1HE       LYS  39  10.451  13.862  -4.695
  259   2HE   LYS  39          2HE       LYS  39  11.063  13.818  -6.369
  260   1HZ   LYS  39          1HZ       LYS  39  12.853  13.413  -4.784
  261   2HZ   LYS  39          2HZ       LYS  39  12.475  14.798  -3.923
  262   3HZ   LYS  39          3HZ       LYS  39  13.103  14.930  -5.476
  263    HA   PRO  40           HA       PRO  40   7.868  21.972  -2.337
  264   1HB   PRO  40          1HB       PRO  40   9.818  23.655  -3.099
  265   2HB   PRO  40          2HB       PRO  40   9.860  22.852  -1.526
  266   1HG   PRO  40          1HG       PRO  40  11.295  22.133  -4.053
  267   2HG   PRO  40          2HG       PRO  40  11.926  22.186  -2.393
  268   1HD   PRO  40          1HD       PRO  40  11.151  19.904  -3.654
  269   2HD   PRO  40          2HD       PRO  40  11.061  20.075  -1.903
  270    H    ASP  41           H        ASP  41   8.552  20.276  -4.952
  271    HA   ASP  41           HA       ASP  41   7.959  22.313  -6.960
  272   1HB   ASP  41          1HB       ASP  41   9.925  20.847  -7.281
  273   2HB   ASP  41          2HB       ASP  41   8.865  19.445  -7.251
  274    H    CYS  42           H        CYS  42   6.552  20.086  -5.090
  275    HA   CYS  42           HA       CYS  42   4.662  18.900  -6.872
  276   1HB   CYS  42          1HB       CYS  42   5.287  17.845  -4.741
  277   2HB   CYS  42          2HB       CYS  42   4.450  19.127  -3.871
  278    HG   CYS  42           HG       CYS  42   2.429  17.479  -3.665
  279    H    LYS  43           H        LYS  43   2.986  19.742  -7.761
  280    HA   LYS  43           HA       LYS  43   2.019  22.362  -7.057
  281   1HB   LYS  43          1HB       LYS  43   1.003  20.413  -9.121
  282   2HB   LYS  43          2HB       LYS  43   0.578  22.106  -8.992
  283   1HG   LYS  43          1HG       LYS  43   2.847  22.747  -9.551
  284   2HG   LYS  43          2HG       LYS  43   3.328  21.048  -9.602
  285   1HD   LYS  43          1HD       LYS  43   1.681  20.667 -11.394
  286   2HD   LYS  43          2HD       LYS  43   1.289  22.386 -11.367
  287   1HE   LYS  43          1HE       LYS  43   3.579  22.931 -12.003
  288   2HE   LYS  43          2HE       LYS  43   4.000  21.217 -11.985
  289   1HZ   LYS  43          1HZ       LYS  43   2.014  22.463 -13.803
  290   2HZ   LYS  43          2HZ       LYS  43   2.496  20.842 -13.807
  291   3HZ   LYS  43          3HZ       LYS  43   3.585  22.031 -14.221
  292    H    VAL  44           H        VAL  44   0.959  19.016  -6.754
  293    HA   VAL  44           HA       VAL  44  -1.463  19.916  -5.384
  294    HB   VAL  44           HB       VAL  44  -1.363  17.650  -7.400
  295   1HG1  VAL  44          1HG1      VAL  44  -2.882  17.131  -5.591
  296   2HG1  VAL  44          2HG1      VAL  44  -3.789  17.492  -7.054
  297   3HG1  VAL  44          3HG1      VAL  44  -3.672  18.699  -5.770
  298   1HG2  VAL  44          1HG2      VAL  44  -1.370  19.820  -8.519
  299   2HG2  VAL  44          2HG2      VAL  44  -2.772  20.316  -7.574
  300   3HG2  VAL  44          3HG2      VAL  44  -2.916  19.003  -8.742
  301    H    GLY  45           H        GLY  45  -1.593  19.092  -3.496
  302   1HA   GLY  45          1HA       GLY  45  -1.410  17.682  -1.702
  303   2HA   GLY  45          2HA       GLY  45  -1.016  16.389  -2.828
  304    H    ARG  46           H        ARG  46   0.754  19.500  -2.037
  305    HA   ARG  46           HA       ARG  46   3.124  17.994  -1.980
  306   1HB   ARG  46          1HB       ARG  46   3.116  20.321  -2.755
  307   2HB   ARG  46          2HB       ARG  46   2.610  20.850  -1.153
  308   1HG   ARG  46          1HG       ARG  46   4.634  20.156  -0.170
  309   2HG   ARG  46          2HG       ARG  46   5.123  19.292  -1.620
  310   1HD   ARG  46          1HD       ARG  46   6.364  21.285  -1.442
  311   2HD   ARG  46          2HD       ARG  46   5.242  21.443  -2.796
  312    HE   ARG  46           HE       ARG  46   3.966  22.937  -1.486
  313   1HH1  ARG  46          1HH1      ARG  46   6.994  21.996   0.156
  314   2HH1  ARG  46          2HH1      ARG  46   7.184  23.511   0.912
  315   1HH2  ARG  46          1HH2      ARG  46   4.302  25.018  -0.434
  316   2HH2  ARG  46          2HH2      ARG  46   5.654  25.244   0.573
  317    H    ILE  47           H        ILE  47   3.929  16.973  -0.417
  318    HA   ILE  47           HA       ILE  47   2.718  17.014   2.183
  319    HB   ILE  47           HB       ILE  47   5.213  15.438   1.381
  320   1HG1  ILE  47          1HG1      ILE  47   2.291  14.615   1.433
  321   2HG1  ILE  47          2HG1      ILE  47   3.234  14.942  -0.019
  322   1HG2  ILE  47          1HG2      ILE  47   4.673  14.084   3.266
  323   2HG2  ILE  47          2HG2      ILE  47   3.403  15.206   3.749
  324   3HG2  ILE  47          3HG2      ILE  47   5.073  15.730   3.709
  325   1HD1  ILE  47          1HD1      ILE  47   3.838  12.780   1.969
  326   2HD1  ILE  47          2HD1      ILE  47   4.655  13.073   0.424
  327   3HD1  ILE  47          3HD1      ILE  47   2.974  12.557   0.450
  328    H    THR  48           H        THR  48   3.139  18.278   3.681
  329    HA   THR  48           HA       THR  48   4.895  20.360   3.710
  330    HB   THR  48           HB       THR  48   4.178  20.286   6.177
  331    HG1  THR  48           1HG      THR  48   3.189  18.469   6.694
  332   1HG2  THR  48          1HG2      THR  48   2.190  20.155   3.988
  333   2HG2  THR  48          2HG2      THR  48   3.130  21.611   4.402
  334   3HG2  THR  48          3HG2      THR  48   1.934  20.942   5.549
  335    H    THR  49           H        THR  49   4.944  17.463   5.680
  336    HA   THR  49           HA       THR  49   7.792  18.007   6.293
  337    HB   THR  49           HB       THR  49   6.090  16.944   8.501
  338    HG1  THR  49           1HG      THR  49   4.796  18.532   8.234
  339   1HG2  THR  49          1HG2      THR  49   8.488  17.293   8.823
  340   2HG2  THR  49          2HG2      THR  49   7.563  18.420   9.828
  341   3HG2  THR  49          3HG2      THR  49   8.318  18.982   8.342
  342    H    THR  50           H        THR  50   8.897  16.132   7.207
  343    HA   THR  50           HA       THR  50   8.543  13.748   5.829
  344    HB   THR  50           HB       THR  50  10.580  14.568   6.676
  345    HG1  THR  50           1HG      THR  50  11.439  12.609   7.347
  346   1HG2  THR  50          1HG2      THR  50  11.240  14.410   9.073
  347   2HG2  THR  50          2HG2      THR  50   9.569  13.917   9.417
  348   3HG2  THR  50          3HG2      THR  50   9.883  15.520   8.764
  349    H    GLU  51           H        GLU  51   7.680  14.659   9.117
  350    HA   GLU  51           HA       GLU  51   6.612  12.174   9.924
  351   1HB   GLU  51          1HB       GLU  51   5.811  14.942  10.810
  352   2HB   GLU  51          2HB       GLU  51   5.316  13.455  11.601
  353   1HG   GLU  51          1HG       GLU  51   7.710  12.962  12.016
  354   2HG   GLU  51          2HG       GLU  51   8.097  14.560  11.376
  355    H    ASP  52           H        ASP  52   5.137  14.815   8.012
  356    HA   ASP  52           HA       ASP  52   2.541  13.713   8.078
  357   1HB   ASP  52          1HB       ASP  52   4.019  15.670   6.365
  358   2HB   ASP  52          2HB       ASP  52   2.345  15.245   6.093
  359    H    PHE  53           H        PHE  53   5.322  13.580   6.007
  360    HA   PHE  53           HA       PHE  53   4.236  12.164   3.893
  361   1HB   PHE  53          1HB       PHE  53   6.437  13.262   3.768
  362   2HB   PHE  53          2HB       PHE  53   7.026  12.255   5.074
  363    HD1  PHE  53           1HD      PHE  53   7.659   9.965   4.675
  364    HD2  PHE  53           2HD      PHE  53   6.248  12.445   1.554
  365    HE1  PHE  53           1HE      PHE  53   8.487   8.349   3.035
  366    HE2  PHE  53           2HE      PHE  53   7.078  10.850  -0.107
  367    HZ   PHE  53           HZ       PHE  53   8.195   8.813   0.604
  368    H    LYS  54           H        LYS  54   5.856  11.076   6.779
  369    HA   LYS  54           HA       LYS  54   5.684   8.251   6.344
  370   1HB   LYS  54          1HB       LYS  54   5.997   9.829   8.883
  371   2HB   LYS  54          2HB       LYS  54   6.171   8.080   8.737
  372   1HG   LYS  54          1HG       LYS  54   8.030   8.356   7.209
  373   2HG   LYS  54          2HG       LYS  54   7.828  10.106   7.248
  374   1HD   LYS  54          1HD       LYS  54   9.662   9.478   8.676
  375   2HD   LYS  54          2HD       LYS  54   8.331  10.069   9.662
  376   1HE   LYS  54          1HE       LYS  54   7.691   7.757  10.172
  377   2HE   LYS  54          2HE       LYS  54   9.016   7.172   9.161
  378   1HZ   LYS  54          1HZ       LYS  54  10.564   8.282  10.647
  379   2HZ   LYS  54          2HZ       LYS  54   9.590   7.187  11.511
  380   3HZ   LYS  54          3HZ       LYS  54   9.285   8.828  11.594
  381    H    HIS  55           H        HIS  55   3.536  10.571   8.003
  382    HA   HIS  55           HA       HIS  55   1.744   8.651   9.133
  383   1HB   HIS  55          1HB       HIS  55   1.885  11.071   9.835
  384   2HB   HIS  55          2HB       HIS  55   1.315  11.515   8.248
  385    HD1  HIS  55           1HD      HIS  55   0.072   9.817  11.382
  386    HD2  HIS  55           2HD      HIS  55  -1.461  11.488   7.891
  387    HE1  HIS  55           1HE      HIS  55  -2.404   9.844  11.689
  388    H    LEU  56           H        LEU  56   1.753  10.475   6.157
  389    HA   LEU  56           HA       LEU  56  -0.679   9.312   5.262
  390   1HB   LEU  56          1HB       LEU  56   0.939  11.394   4.440
  391   2HB   LEU  56          2HB       LEU  56   1.073  10.212   3.164
  392    HG   LEU  56           HG       LEU  56  -1.080  11.967   4.000
  393   1HD1  LEU  56          1HD1      LEU  56   0.137  12.403   2.051
  394   2HD1  LEU  56          2HD1      LEU  56  -1.548  12.150   1.671
  395   3HD1  LEU  56          3HD1      LEU  56  -0.362  10.882   1.319
  396   1HD2  LEU  56          1HD2      LEU  56  -2.245   9.863   4.526
  397   2HD2  LEU  56          2HD2      LEU  56  -1.872   9.238   2.920
  398   3HD2  LEU  56          3HD2      LEU  56  -2.917  10.634   3.137
  399    H    ALA  57           H        ALA  57   2.758   8.477   4.564
  400    HA   ALA  57           HA       ALA  57   2.113   6.498   2.724
  401   1HB   ALA  57          1HB       ALA  57   4.319   5.514   3.206
  402   2HB   ALA  57          2HB       ALA  57   4.410   6.438   4.702
  403   3HB   ALA  57          3HB       ALA  57   4.455   7.273   3.150
  404    H    ARG  58           H        ARG  58   2.173   6.413   6.146
  405    HA   ARG  58           HA       ARG  58   1.685   3.615   6.508
  406   1HB   ARG  58          1HB       ARG  58   0.889   5.925   8.276
  407   2HB   ARG  58          2HB       ARG  58   0.735   4.237   8.728
  408   1HG   ARG  58          1HG       ARG  58   3.112   3.952   8.642
  409   2HG   ARG  58          2HG       ARG  58   3.316   5.600   8.040
  410   1HD   ARG  58          1HD       ARG  58   2.282   6.449  10.085
  411   2HD   ARG  58          2HD       ARG  58   2.151   4.803  10.687
  412    HE   ARG  58           HE       ARG  58   4.775   5.087  10.021
  413   1HH1  ARG  58          1HH1      ARG  58   2.627   6.830  12.249
  414   2HH1  ARG  58          2HH1      ARG  58   3.835   7.209  13.375
  415   1HH2  ARG  58          1HH2      ARG  58   6.490   5.643  11.591
  416   2HH2  ARG  58          2HH2      ARG  58   6.089   6.516  12.991
  417    H    LYS  59           H        LYS  59  -0.501   6.379   6.477
  418    HA   LYS  59           HA       LYS  59  -2.885   5.100   6.867
  419   1HB   LYS  59          1HB       LYS  59  -2.214   7.591   5.343
  420   2HB   LYS  59          2HB       LYS  59  -3.864   7.015   5.410
  421   1HG   LYS  59          1HG       LYS  59  -2.189   7.720   7.805
  422   2HG   LYS  59          2HG       LYS  59  -3.358   8.796   7.037
  423   1HD   LYS  59          1HD       LYS  59  -5.064   6.937   7.426
  424   2HD   LYS  59          2HD       LYS  59  -3.864   6.213   8.497
  425   1HE   LYS  59          1HE       LYS  59  -5.381   7.534   9.813
  426   2HE   LYS  59          2HE       LYS  59  -3.807   8.331   9.778
  427   1HZ   LYS  59          1HZ       LYS  59  -6.154   9.061   8.117
  428   2HZ   LYS  59          2HZ       LYS  59  -4.676   9.830   8.040
  429   3HZ   LYS  59          3HZ       LYS  59  -5.602   9.927   9.441
  430    H    LEU  60           H        LEU  60  -1.328   5.929   3.798
  431    HA   LEU  60           HA       LEU  60  -3.351   5.064   2.266
  432   1HB   LEU  60          1HB       LEU  60  -0.481   5.462   1.564
  433   2HB   LEU  60          2HB       LEU  60  -1.751   5.314   0.342
  434    HG   LEU  60           HG       LEU  60  -1.926   7.252   2.558
  435   1HD1  LEU  60          1HD1      LEU  60  -0.625   7.714  -0.144
  436   2HD1  LEU  60          2HD1      LEU  60   0.107   7.891   1.446
  437   3HD1  LEU  60          3HD1      LEU  60  -1.154   9.003   0.924
  438   1HD2  LEU  60          1HD2      LEU  60  -3.233   7.090  -0.134
  439   2HD2  LEU  60          2HD2      LEU  60  -3.460   8.414   1.012
  440   3HD2  LEU  60          3HD2      LEU  60  -3.962   6.776   1.440
  441    H    THR  61           H        THR  61  -0.311   3.541   3.159
  442    HA   THR  61           HA       THR  61  -0.459   1.114   1.747
  443    HB   THR  61           HB       THR  61   0.638   1.499   4.553
  444    HG1  THR  61           1HG      THR  61   1.779   2.878   3.293
  445   1HG2  THR  61          1HG2      THR  61   2.061  -0.428   4.018
  446   2HG2  THR  61          2HG2      THR  61   1.311  -0.563   2.437
  447   3HG2  THR  61          3HG2      THR  61   0.362  -0.873   3.888
  448    H    HIS  62           H        HIS  62  -1.796   2.155   4.751
  449    HA   HIS  62           HA       HIS  62  -2.887  -0.383   5.432
  450   1HB   HIS  62          1HB       HIS  62  -2.279   1.411   7.098
  451   2HB   HIS  62          2HB       HIS  62  -3.625   2.342   6.468
  452    HD1  HIS  62           1HD      HIS  62  -2.820  -0.515   8.782
  453    HD2  HIS  62           2HD      HIS  62  -6.160   1.563   7.415
  454    HE1  HIS  62           1HE      HIS  62  -4.659  -1.166  10.299
  455    H    GLY  63           H        GLY  63  -4.218   2.409   3.734
  456   1HA   GLY  63          1HA       GLY  63  -6.863   1.425   3.788
  457   2HA   GLY  63          2HA       GLY  63  -6.300   2.705   2.753
  458    H    VAL  64           H        VAL  64  -4.273   1.154   1.338
  459    HA   VAL  64           HA       VAL  64  -6.024  -0.067  -0.638
  460    HB   VAL  64           HB       VAL  64  -2.996  -0.281  -0.368
  461   1HG1  VAL  64          1HG1      VAL  64  -3.013  -1.025  -2.768
  462   2HG1  VAL  64          2HG1      VAL  64  -4.760  -0.983  -2.763
  463   3HG1  VAL  64          3HG1      VAL  64  -3.912  -2.137  -1.752
  464   1HG2  VAL  64          1HG2      VAL  64  -4.673   1.528  -2.110
  465   2HG2  VAL  64          2HG2      VAL  64  -2.920   1.387  -2.190
  466   3HG2  VAL  64          3HG2      VAL  64  -3.687   2.020  -0.729
  467    H    MET  65           H        MET  65  -4.099  -1.063   1.870
  468    HA   MET  65           HA       MET  65  -4.060  -3.887   1.518
  469   1HB   MET  65          1HB       MET  65  -2.478  -2.892   3.065
  470   2HB   MET  65          2HB       MET  65  -3.764  -2.168   3.972
  471   1HG   MET  65          1HG       MET  65  -4.488  -4.269   4.793
  472   2HG   MET  65          2HG       MET  65  -3.234  -5.113   3.890
  473   1HE   MET  65          1HE       MET  65  -2.270  -5.071   7.752
  474   2HE   MET  65          2HE       MET  65  -2.731  -6.107   6.377
  475   3HE   MET  65          3HE       MET  65  -3.889  -4.940   7.045
  476    H    ASN  66           H        ASN  66  -6.080  -1.818   3.493
  477    HA   ASN  66           HA       ASN  66  -7.803  -3.887   4.378
  478   1HB   ASN  66          1HB       ASN  66  -7.602  -0.988   4.602
  479   2HB   ASN  66          2HB       ASN  66  -9.239  -1.582   4.777
  480   1HD2  ASN  66          1HD2      ASN  66  -6.063  -1.420   5.992
  481   2HD2  ASN  66          2HD2      ASN  66  -6.343  -2.110   7.556
  482    H    LYS  67           H        LYS  67  -8.040  -1.621   1.722
  483    HA   LYS  67           HA       LYS  67 -10.669  -2.351   1.052
  484   1HB   LYS  67          1HB       LYS  67  -8.508  -0.957  -0.445
  485   2HB   LYS  67          2HB       LYS  67  -9.829  -1.638  -1.377
  486   1HG   LYS  67          1HG       LYS  67 -10.288   0.679  -0.933
  487   2HG   LYS  67          2HG       LYS  67 -11.421  -0.323  -0.032
  488   1HD   LYS  67          1HD       LYS  67 -10.050  -0.001   1.988
  489   2HD   LYS  67          2HD       LYS  67  -8.964   1.035   1.065
  490   1HE   LYS  67          1HE       LYS  67 -11.885   1.532   1.605
  491   2HE   LYS  67          2HE       LYS  67 -10.527   2.372   2.357
  492   1HZ   LYS  67          1HZ       LYS  67 -11.398   3.740   0.645
  493   2HZ   LYS  67          2HZ       LYS  67 -11.424   2.490  -0.457
  494   3HZ   LYS  67          3HZ       LYS  67  -9.951   3.132   0.029
  495    H    GLU  68           H        GLU  68  -7.547  -3.740  -0.008
  496    HA   GLU  68           HA       GLU  68  -9.061  -5.482  -1.608
  497   1HB   GLU  68          1HB       GLU  68  -6.957  -6.512  -2.205
  498   2HB   GLU  68          2HB       GLU  68  -7.039  -4.753  -2.406
  499   1HG   GLU  68          1HG       GLU  68  -5.710  -4.428  -0.446
  500   2HG   GLU  68          2HG       GLU  68  -5.561  -6.170  -0.204
  501    H    LEU  69           H        LEU  69  -7.453  -5.793   1.577
  502    HA   LEU  69           HA       LEU  69  -8.046  -8.447   1.867
  503   1HB   LEU  69          1HB       LEU  69  -8.036  -6.213   3.870
  504   2HB   LEU  69          2HB       LEU  69  -8.401  -7.853   4.354
  505    HG   LEU  69           HG       LEU  69  -5.819  -6.968   3.062
  506   1HD1  LEU  69          1HD1      LEU  69  -6.078  -6.065   5.317
  507   2HD1  LEU  69          2HD1      LEU  69  -4.840  -7.318   5.251
  508   3HD1  LEU  69          3HD1      LEU  69  -6.429  -7.684   5.925
  509   1HD2  LEU  69          1HD2      LEU  69  -6.292  -9.276   2.544
  510   2HD2  LEU  69          2HD2      LEU  69  -6.725  -9.594   4.219
  511   3HD2  LEU  69          3HD2      LEU  69  -5.057  -9.213   3.806
  512    H    LYS  70           H        LYS  70 -10.348  -5.770   1.879
  513    HA   LYS  70           HA       LYS  70 -12.514  -7.368   2.825
  514   1HB   LYS  70          1HB       LYS  70 -12.475  -4.893   1.125
  515   2HB   LYS  70          2HB       LYS  70 -13.917  -5.616   1.815
  516   1HG   LYS  70          1HG       LYS  70 -12.930  -5.227   4.030
  517   2HG   LYS  70          2HG       LYS  70 -11.620  -4.360   3.205
  518   1HD   LYS  70          1HD       LYS  70 -13.224  -2.838   2.182
  519   2HD   LYS  70          2HD       LYS  70 -14.557  -3.680   2.960
  520   1HE   LYS  70          1HE       LYS  70 -13.595  -3.039   5.163
  521   2HE   LYS  70          2HE       LYS  70 -12.372  -2.102   4.306
  522   1HZ   LYS  70          1HZ       LYS  70 -14.192  -0.678   4.990
  523   2HZ   LYS  70          2HZ       LYS  70 -15.309  -1.637   4.204
  524   3HZ   LYS  70          3HZ       LYS  70 -14.172  -0.772   3.318
  525    H    TYR  71           H        TYR  71 -11.458  -6.225  -0.319
  526    HA   TYR  71           HA       TYR  71 -13.601  -7.524  -1.736
  527   1HB   TYR  71          1HB       TYR  71 -11.123  -6.195  -2.860
  528   2HB   TYR  71          2HB       TYR  71 -12.568  -6.624  -3.761
  529    HD1  TYR  71           1HD      TYR  71 -11.741  -3.947  -4.101
  530    HD2  TYR  71           2HD      TYR  71 -13.950  -5.544  -0.836
  531    HE1  TYR  71           1HE      TYR  71 -12.631  -1.703  -3.599
  532    HE2  TYR  71           2HE      TYR  71 -14.836  -3.344  -0.326
  533    HH   TYR  71           HH       TYR  71 -14.665  -0.772  -2.462
  534    H    CYS  72           H        CYS  72 -10.427  -8.410  -0.918
  535    HA   CYS  72           HA       CYS  72 -10.375 -10.619  -2.821
  536   1HB   CYS  72          1HB       CYS  72  -8.434  -9.567  -0.802
  537   2HB   CYS  72          2HB       CYS  72  -8.090 -11.048  -1.654
  538    HG   CYS  72           HG       CYS  72  -7.538 -10.013  -3.955
  539    H    LYS  73           H        LYS  73 -10.908  -9.924   0.500
  540    HA   LYS  73           HA       LYS  73 -11.655 -10.965   2.266
  541   1HB   LYS  73          1HB       LYS  73 -12.372 -13.319   0.479
  542   2HB   LYS  73          2HB       LYS  73 -12.912 -13.089   2.126
  543   1HG   LYS  73          1HG       LYS  73 -14.787 -12.356   0.960
  544   2HG   LYS  73          2HG       LYS  73 -13.897 -10.842   1.165
  545   1HD   LYS  73          1HD       LYS  73 -12.947 -11.073  -1.057
  546   2HD   LYS  73          2HD       LYS  73 -13.817 -12.588  -1.268
  547   1HE   LYS  73          1HE       LYS  73 -15.943 -11.396  -1.068
  548   2HE   LYS  73          2HE       LYS  73 -15.064  -9.878  -0.863
  549   1HZ   LYS  73          1HZ       LYS  73 -14.985 -11.620  -3.268
  550   2HZ   LYS  73          2HZ       LYS  73 -14.089 -10.219  -3.064
  551   3HZ   LYS  73          3HZ       LYS  73 -15.777 -10.133  -3.136
  552    H    ASN  74           H        ASN  74  -9.835 -13.153   0.294
  553    HA   ASN  74           HA       ASN  74  -8.510 -14.245   2.680
  554   1HB   ASN  74          1HB       ASN  74  -8.538 -15.351  -0.146
  555   2HB   ASN  74          2HB       ASN  74  -7.798 -16.117   1.251
  556   1HD2  ASN  74          1HD2      ASN  74  -9.785 -17.142  -0.509
  557   2HD2  ASN  74          2HD2      ASN  74 -11.171 -17.527   0.443
  558    HA   PRO  75           HA       PRO  75  -4.997 -11.754   1.417
  559   1HB   PRO  75          1HB       PRO  75  -3.220 -12.887   2.919
  560   2HB   PRO  75          2HB       PRO  75  -4.322 -11.580   3.367
  561   1HG   PRO  75          1HG       PRO  75  -4.522 -14.584   3.965
  562   2HG   PRO  75          2HG       PRO  75  -4.981 -13.280   5.064
  563   1HD   PRO  75          1HD       PRO  75  -6.730 -14.716   3.626
  564   2HD   PRO  75          2HD       PRO  75  -7.017 -13.007   4.024
  565    H    GLU  76           H        GLU  76  -5.244 -14.952   1.030
  566    HA   GLU  76           HA       GLU  76  -2.804 -15.690  -0.034
  567   1HB   GLU  76          1HB       GLU  76  -4.690 -17.245   0.335
  568   2HB   GLU  76          2HB       GLU  76  -5.565 -16.470  -0.958
  569   1HG   GLU  76          1HG       GLU  76  -3.931 -17.275  -2.568
  570   2HG   GLU  76          2HG       GLU  76  -3.048 -18.069  -1.258
  571    H    ASP  77           H        ASP  77  -5.040 -13.534  -0.952
  572    HA   ASP  77           HA       ASP  77  -4.185 -13.276  -3.801
  573   1HB   ASP  77          1HB       ASP  77  -6.604 -13.926  -3.301
  574   2HB   ASP  77          2HB       ASP  77  -6.763 -12.338  -2.565
  575    H    LEU  78           H        LEU  78  -3.524 -12.083  -0.860
  576    HA   LEU  78           HA       LEU  78  -3.554  -9.285  -1.499
  577   1HB   LEU  78          1HB       LEU  78  -4.392 -10.101   0.618
  578   2HB   LEU  78          2HB       LEU  78  -2.891 -10.976   0.859
  579    HG   LEU  78           HG       LEU  78  -1.832  -8.711   0.683
  580   1HD1  LEU  78          1HD1      LEU  78  -3.194  -6.930   1.734
  581   2HD1  LEU  78          2HD1      LEU  78  -4.592  -7.984   1.619
  582   3HD1  LEU  78          3HD1      LEU  78  -3.807  -7.389   0.134
  583   1HD2  LEU  78          1HD2      LEU  78  -1.644 -10.037   2.571
  584   2HD2  LEU  78          2HD2      LEU  78  -3.307  -9.691   3.043
  585   3HD2  LEU  78          3HD2      LEU  78  -2.081  -8.411   3.116
  586    H    GLU  79           H        GLU  79  -1.826  -8.892  -2.712
  587    HA   GLU  79           HA       GLU  79   0.894  -9.480  -1.845
  588   1HB   GLU  79          1HB       GLU  79   0.177 -11.271  -3.462
  589   2HB   GLU  79          2HB       GLU  79  -0.365  -9.933  -4.483
  590   1HG   GLU  79          1HG       GLU  79   1.599 -10.833  -5.249
  591   2HG   GLU  79          2HG       GLU  79   1.804  -9.153  -4.811
  592    H    CYS  80           H        CYS  80   2.172  -7.850  -2.461
  593    HA   CYS  80           HA       CYS  80   0.837  -5.533  -3.564
  594   1HB   CYS  80          1HB       CYS  80   2.317  -4.978  -1.756
  595   2HB   CYS  80          2HB       CYS  80   3.678  -5.846  -2.427
  596    HG   CYS  80           HG       CYS  80   4.673  -3.722  -3.439
  597    H    ASN  81           H        ASN  81   0.375  -6.662  -5.390
  598    HA   ASN  81           HA       ASN  81   2.651  -7.194  -7.032
  599   1HB   ASN  81          1HB       ASN  81   1.155  -8.460  -8.556
  600   2HB   ASN  81          2HB       ASN  81   0.904  -8.987  -6.891
  601   1HD2  ASN  81          1HD2      ASN  81  -1.055  -8.507  -5.983
  602   2HD2  ASN  81          2HD2      ASN  81  -2.396  -7.927  -6.885
  603    H    GLU  82           H        GLU  82   1.836  -6.802  -9.495
  604    HA   GLU  82           HA       GLU  82   1.930  -4.270 -10.170
  605   1HB   GLU  82          1HB       GLU  82   0.923  -6.688 -11.248
  606   2HB   GLU  82          2HB       GLU  82   0.641  -5.276 -12.275
  607   1HG   GLU  82          1HG       GLU  82   2.784  -6.356 -12.933
  608   2HG   GLU  82          2HG       GLU  82   3.043  -4.772 -12.174
  609    H    ASN  83           H        ASN  83  -1.044  -6.188 -10.120
  610    HA   ASN  83           HA       ASN  83  -3.031  -4.350 -10.790
  611   1HB   ASN  83          1HB       ASN  83  -3.343  -6.833 -10.456
  612   2HB   ASN  83          2HB       ASN  83  -3.139  -6.611  -8.735
  613   1HD2  ASN  83          1HD2      ASN  83  -5.341  -7.751 -10.168
  614   2HD2  ASN  83          2HD2      ASN  83  -6.764  -6.860  -9.816
  615    H    VAL  84           H        VAL  84  -1.681  -5.326  -7.645
  616    HA   VAL  84           HA       VAL  84  -3.203  -3.480  -6.270
  617    HB   VAL  84           HB       VAL  84  -0.707  -4.935  -5.461
  618   1HG1  VAL  84          1HG1      VAL  84  -2.455  -3.104  -3.806
  619   2HG1  VAL  84          2HG1      VAL  84  -0.684  -3.036  -4.002
  620   3HG1  VAL  84          3HG1      VAL  84  -1.446  -4.367  -3.136
  621   1HG2  VAL  84          1HG2      VAL  84  -2.268  -6.210  -4.159
  622   2HG2  VAL  84          2HG2      VAL  84  -2.669  -6.229  -5.885
  623   3HG2  VAL  84          3HG2      VAL  84  -3.591  -5.213  -4.762
  624    H    LYS  85           H        LYS  85   0.100  -3.277  -7.405
  625    HA   LYS  85           HA       LYS  85   0.827  -0.706  -6.459
  626   1HB   LYS  85          1HB       LYS  85   1.550  -2.071  -9.039
  627   2HB   LYS  85          2HB       LYS  85   2.361  -0.652  -8.389
  628   1HG   LYS  85          1HG       LYS  85   3.157  -1.862  -6.536
  629   2HG   LYS  85          2HG       LYS  85   2.166  -3.266  -6.947
  630   1HD   LYS  85          1HD       LYS  85   3.459  -3.347  -9.124
  631   2HD   LYS  85          2HD       LYS  85   4.559  -2.175  -8.388
  632   1HE   LYS  85          1HE       LYS  85   4.965  -3.659  -6.555
  633   2HE   LYS  85          2HE       LYS  85   3.769  -4.776  -7.219
  634   1HZ   LYS  85          1HZ       LYS  85   6.071  -5.466  -7.747
  635   2HZ   LYS  85          2HZ       LYS  85   6.295  -4.005  -8.576
  636   3HZ   LYS  85          3HZ       LYS  85   5.176  -5.135  -9.140
  637    H    HIS  86           H        HIS  86  -0.721  -1.667  -9.327
  638    HA   HIS  86           HA       HIS  86  -0.983   0.770 -10.633
  639   1HB   HIS  86          1HB       HIS  86  -1.577  -1.326 -11.748
  640   2HB   HIS  86          2HB       HIS  86  -2.953  -1.534 -10.673
  641    HD1  HIS  86           1HD      HIS  86  -5.071  -0.991 -11.871
  642    HD2  HIS  86           2HD      HIS  86  -1.903   1.389 -13.036
  643    HE1  HIS  86           1HE      HIS  86  -6.035   0.565 -13.549
  644    H    LYS  87           H        LYS  87  -3.248  -0.826  -8.575
  645    HA   LYS  87           HA       LYS  87  -5.239   1.269  -8.325
  646   1HB   LYS  87          1HB       LYS  87  -4.478  -0.757  -6.264
  647   2HB   LYS  87          2HB       LYS  87  -5.953   0.176  -6.303
  648   1HG   LYS  87          1HG       LYS  87  -6.629  -1.072  -8.331
  649   2HG   LYS  87          2HG       LYS  87  -5.172  -2.059  -8.153
  650   1HD   LYS  87          1HD       LYS  87  -7.265  -1.686  -6.054
  651   2HD   LYS  87          2HD       LYS  87  -7.200  -3.089  -7.135
  652   1HE   LYS  87          1HE       LYS  87  -5.070  -3.743  -6.219
  653   2HE   LYS  87          2HE       LYS  87  -4.966  -2.296  -5.208
  654   1HZ   LYS  87          1HZ       LYS  87  -6.823  -4.590  -4.949
  655   2HZ   LYS  87          2HZ       LYS  87  -6.953  -3.187  -4.018
  656   3HZ   LYS  87          3HZ       LYS  87  -5.575  -4.155  -3.899
  657    H    THR  88           H        THR  88  -2.345   0.641  -6.679
  658    HA   THR  88           HA       THR  88  -2.973   2.326  -4.523
  659    HB   THR  88           HB       THR  88  -0.554   0.982  -5.538
  660    HG1  THR  88           1HG      THR  88  -1.862  -0.444  -4.629
  661   1HG2  THR  88          1HG2      THR  88   0.520   1.635  -3.422
  662   2HG2  THR  88          2HG2      THR  88  -0.888   2.685  -3.082
  663   3HG2  THR  88          3HG2      THR  88   0.129   2.974  -4.512
  664    H    LYS  89           H        LYS  89  -0.562   2.600  -7.105
  665    HA   LYS  89           HA       LYS  89   0.019   5.079  -6.227
  666   1HB   LYS  89          1HB       LYS  89   1.121   5.388  -8.591
  667   2HB   LYS  89          2HB       LYS  89   1.777   4.330  -7.364
  668   1HG   LYS  89          1HG       LYS  89   1.854   3.189  -9.487
  669   2HG   LYS  89          2HG       LYS  89   0.615   2.466  -8.437
  670   1HD   LYS  89          1HD       LYS  89  -0.977   3.029  -9.612
  671   2HD   LYS  89          2HD       LYS  89  -0.306   4.555 -10.237
  672   1HE   LYS  89          1HE       LYS  89   0.559   1.770 -11.069
  673   2HE   LYS  89          2HE       LYS  89  -0.584   2.755 -12.004
  674   1HZ   LYS  89          1HZ       LYS  89   1.209   4.375 -12.285
  675   2HZ   LYS  89          2HZ       LYS  89   1.613   2.871 -12.898
  676   3HZ   LYS  89          3HZ       LYS  89   2.286   3.366 -11.449
  677    H    GLU  90           H        GLU  90  -2.241   4.032  -8.645
  678    HA   GLU  90           HA       GLU  90  -2.968   6.654  -9.541
  679   1HB   GLU  90          1HB       GLU  90  -4.428   4.056  -9.672
  680   2HB   GLU  90          2HB       GLU  90  -5.070   5.533 -10.384
  681   1HG   GLU  90          1HG       GLU  90  -2.468   4.188 -11.116
  682   2HG   GLU  90          2HG       GLU  90  -3.941   4.211 -12.088
  683    H    TYR  91           H        TYR  91  -3.982   4.716  -6.827
  684    HA   TYR  91           HA       TYR  91  -6.320   6.238  -6.233
  685   1HB   TYR  91          1HB       TYR  91  -6.450   4.148  -5.191
  686   2HB   TYR  91          2HB       TYR  91  -4.741   4.127  -4.796
  687    HD1  TYR  91           1HD      TYR  91  -7.872   6.000  -3.865
  688    HD2  TYR  91           2HD      TYR  91  -4.125   4.412  -2.595
  689    HE1  TYR  91           1HE      TYR  91  -8.372   6.657  -1.537
  690    HE2  TYR  91           2HE      TYR  91  -4.579   5.059  -0.330
  691    HH   TYR  91           HH       TYR  91  -5.971   6.620   0.915
  692    H    ILE  92           H        ILE  92  -3.014   6.002  -5.052
  693    HA   ILE  92           HA       ILE  92  -2.902   8.112  -3.268
  694    HB   ILE  92           HB       ILE  92  -0.798   7.402  -5.322
  695   1HG1  ILE  92          1HG1      ILE  92  -1.756   5.686  -3.551
  696   2HG1  ILE  92          2HG1      ILE  92  -0.017   5.680  -3.940
  697   1HG2  ILE  92          1HG2      ILE  92  -0.435   9.574  -4.337
  698   2HG2  ILE  92          2HG2      ILE  92   0.810   8.447  -3.767
  699   3HG2  ILE  92          3HG2      ILE  92  -0.547   8.892  -2.719
  700   1HD1  ILE  92          1HD1      ILE  92  -1.507   6.839  -1.648
  701   2HD1  ILE  92          2HD1      ILE  92   0.244   7.043  -1.934
  702   3HD1  ILE  92          3HD1      ILE  92  -0.424   5.436  -1.615
  703    H    LYS  93           H        LYS  93  -2.331   8.317  -6.772
  704    HA   LYS  93           HA       LYS  93  -1.890  11.005  -7.035
  705   1HB   LYS  93          1HB       LYS  93  -3.695   9.362  -8.841
  706   2HB   LYS  93          2HB       LYS  93  -3.000  10.913  -9.252
  707   1HG   LYS  93          1HG       LYS  93  -1.453   8.391  -8.736
  708   2HG   LYS  93          2HG       LYS  93  -1.885   9.011 -10.326
  709   1HD   LYS  93          1HD       LYS  93  -0.603  11.042  -9.848
  710   2HD   LYS  93          2HD       LYS  93  -0.127  10.371  -8.289
  711   1HE   LYS  93          1HE       LYS  93   0.464   9.215 -11.000
  712   2HE   LYS  93          2HE       LYS  93   1.624  10.040  -9.954
  713   1HZ   LYS  93          1HZ       LYS  93   0.189   7.551  -9.234
  714   2HZ   LYS  93          2HZ       LYS  93   1.469   8.273  -8.379
  715   3HZ   LYS  93          3HZ       LYS  93   1.735   7.592  -9.901
  716    H    LYS  94           H        LYS  94  -4.965   9.327  -7.092
  717    HA   LYS  94           HA       LYS  94  -6.453  11.701  -7.523
  718   1HB   LYS  94          1HB       LYS  94  -7.324   9.584  -8.338
  719   2HB   LYS  94          2HB       LYS  94  -7.343   8.920  -6.713
  720   1HG   LYS  94          1HG       LYS  94  -9.088  10.578  -6.128
  721   2HG   LYS  94          2HG       LYS  94  -9.118  11.082  -7.823
  722   1HD   LYS  94          1HD       LYS  94  -9.738   8.827  -8.493
  723   2HD   LYS  94          2HD       LYS  94  -9.647   8.284  -6.821
  724   1HE   LYS  94          1HE       LYS  94 -11.590  10.295  -7.967
  725   2HE   LYS  94          2HE       LYS  94 -11.958   8.658  -7.442
  726   1HZ   LYS  94          1HZ       LYS  94 -12.608  10.193  -5.750
  727   2HZ   LYS  94          2HZ       LYS  94 -11.128  10.938  -5.731
  728   3HZ   LYS  94          3HZ       LYS  94 -11.276   9.346  -5.161
  729    H    TYR  95           H        TYR  95  -5.598   9.767  -4.772
  730    HA   TYR  95           HA       TYR  95  -7.252  10.952  -2.894
  731   1HB   TYR  95          1HB       TYR  95  -6.190   8.899  -2.476
  732   2HB   TYR  95          2HB       TYR  95  -4.604   9.635  -2.784
  733    HD1  TYR  95           1HD      TYR  95  -7.598   9.893  -0.574
  734    HD2  TYR  95           2HD      TYR  95  -3.412  10.458  -0.922
  735    HE1  TYR  95           1HE      TYR  95  -7.503  10.543   1.780
  736    HE2  TYR  95           2HE      TYR  95  -3.317  11.135   1.414
  737    HH   TYR  95           HH       TYR  95  -6.157  10.847   3.469
  738    H    MET  96           H        MET  96  -3.915  11.690  -3.750
  739    HA   MET  96           HA       MET  96  -3.812  13.774  -1.899
  740   1HB   MET  96          1HB       MET  96  -2.079  13.393  -4.288
  741   2HB   MET  96          2HB       MET  96  -1.759  14.411  -2.877
  742   1HG   MET  96          1HG       MET  96  -2.207  12.100  -1.605
  743   2HG   MET  96          2HG       MET  96  -1.643  11.468  -3.158
  744   1HE   MET  96          1HE       MET  96  -0.930  13.744  -0.209
  745   2HE   MET  96          2HE       MET  96  -0.449  14.759  -1.592
  746   3HE   MET  96          3HE       MET  96   0.773  14.200  -0.443
  747    H    GLN  97           H        GLN  97  -5.021  13.589  -5.011
  748    HA   GLN  97           HA       GLN  97  -4.993  16.356  -5.669
  749   1HB   GLN  97          1HB       GLN  97  -7.171  14.471  -6.548
  750   2HB   GLN  97          2HB       GLN  97  -6.699  15.973  -7.322
  751   1HG   GLN  97          1HG       GLN  97  -5.272  13.347  -7.274
  752   2HG   GLN  97          2HG       GLN  97  -5.855  14.239  -8.669
  753   1HE2  GLN  97          1HE2      GLN  97  -3.390  13.755  -6.403
  754   2HE2  GLN  97          2HE2      GLN  97  -2.196  14.795  -7.045
  755    H    LYS  98           H        LYS  98  -6.878  14.601  -3.445
  756    HA   LYS  98           HA       LYS  98  -9.098  16.457  -3.342
  757   1HB   LYS  98          1HB       LYS  98 -10.022  15.149  -1.655
  758   2HB   LYS  98          2HB       LYS  98  -9.214  14.019  -2.717
  759   1HG   LYS  98          1HG       LYS  98  -7.762  13.376  -1.184
  760   2HG   LYS  98          2HG       LYS  98  -7.558  14.986  -0.525
  761   1HD   LYS  98          1HD       LYS  98  -9.870  13.073  -0.029
  762   2HD   LYS  98          2HD       LYS  98  -8.510  13.401   1.046
  763   1HE   LYS  98          1HE       LYS  98 -10.493  14.574   1.792
  764   2HE   LYS  98          2HE       LYS  98  -9.222  15.697   1.347
  765   1HZ   LYS  98          1HZ       LYS  98 -11.589  15.044  -0.366
  766   2HZ   LYS  98          2HZ       LYS  98 -10.510  16.352  -0.554
  767   3HZ   LYS  98          3HZ       LYS  98 -11.532  16.296   0.738
  768    H    PHE  99           H        PHE  99  -6.000  16.401  -2.052
  769    HA   PHE  99           HA       PHE  99  -6.613  18.011   0.264
  770   1HB   PHE  99          1HB       PHE  99  -3.975  17.261  -0.987
  771   2HB   PHE  99          2HB       PHE  99  -4.105  18.317   0.412
  772    HD1  PHE  99           1HD      PHE  99  -5.863  17.221   2.224
  773    HD2  PHE  99           2HD      PHE  99  -3.320  15.126  -0.471
  774    HE1  PHE  99           1HE      PHE  99  -5.845  15.319   3.733
  775    HE2  PHE  99           2HE      PHE  99  -3.320  13.175   1.090
  776    HZ   PHE  99           HZ       PHE  99  -4.631  13.295   3.152
  777    H    GLY 100           H        GLY 100  -5.201  18.544  -2.885
  778   1HA   GLY 100          1HA       GLY 100  -5.854  20.586  -4.018
  779   2HA   GLY 100          2HA       GLY 100  -5.667  21.398  -2.462
  780    H    ALA 101           H        ALA 101  -3.998  22.587  -2.534
  781    HA   ALA 101           HA       ALA 101  -1.700  21.966  -4.172
  782   1HB   ALA 101          1HB       ALA 101  -0.800  24.062  -3.310
  783   2HB   ALA 101          2HB       ALA 101  -2.132  24.164  -2.161
  784   3HB   ALA 101          3HB       ALA 101  -2.452  24.280  -3.891
  785    H    VAL 102           H        VAL 102  -2.403  22.093  -0.705
  786    HA   VAL 102           HA       VAL 102   0.181  20.731  -0.315
  787    HB   VAL 102           HB       VAL 102  -0.988  21.972   2.068
  788   1HG1  VAL 102          1HG1      VAL 102   1.770  22.088   0.917
  789   2HG1  VAL 102          2HG1      VAL 102   1.172  21.000   2.168
  790   3HG1  VAL 102          3HG1      VAL 102   1.298  22.732   2.489
  791   1HG2  VAL 102          1HG2      VAL 102  -0.302  24.303   1.562
  792   2HG2  VAL 102          2HG2      VAL 102  -1.646  23.744   0.576
  793   3HG2  VAL 102          3HG2      VAL 102  -0.031  23.828  -0.118
  794    H    TYR 103           H        TYR 103   0.293  19.117   1.276
  795    HA   TYR 103           HA       TYR 103  -2.101  17.639   1.446
  796   1HB   TYR 103          1HB       TYR 103  -0.247  16.262   1.014
  797   2HB   TYR 103          2HB       TYR 103   0.777  17.158   2.118
  798    HD1  TYR 103           1HD      TYR 103  -2.533  15.639   2.850
  799    HD2  TYR 103           2HD      TYR 103   1.622  15.479   3.431
  800    HE1  TYR 103           1HE      TYR 103  -2.881  13.962   4.553
  801    HE2  TYR 103           2HE      TYR 103   1.318  13.737   5.172
  802    HH   TYR 103           HH       TYR 103  -0.421  13.106   6.749
  803    H    LYS 104           H        LYS 104  -3.465  18.348   2.754
  804    HA   LYS 104           HA       LYS 104  -2.740  19.065   5.497
  805   1HB   LYS 104          1HB       LYS 104  -5.038  19.868   3.749
  806   2HB   LYS 104          2HB       LYS 104  -4.866  20.362   5.418
  807   1HG   LYS 104          1HG       LYS 104  -2.926  21.686   4.886
  808   2HG   LYS 104          2HG       LYS 104  -2.858  21.011   3.258
  809   1HD   LYS 104          1HD       LYS 104  -5.105  22.718   4.340
  810   2HD   LYS 104          2HD       LYS 104  -3.796  23.300   3.310
  811   1HE   LYS 104          1HE       LYS 104  -4.512  21.749   1.538
  812   2HE   LYS 104          2HE       LYS 104  -5.828  21.182   2.554
  813   1HZ   LYS 104          1HZ       LYS 104  -6.617  22.804   0.998
  814   2HZ   LYS 104          2HZ       LYS 104  -5.477  23.927   1.520
  815   3HZ   LYS 104          3HZ       LYS 104  -6.711  23.433   2.558
  816    HA   PRO 105           HA       PRO 105  -5.044  15.045   5.596
  817   1HB   PRO 105          1HB       PRO 105  -4.228  14.431   8.160
  818   2HB   PRO 105          2HB       PRO 105  -3.342  13.978   6.703
  819   1HG   PRO 105          1HG       PRO 105  -2.922  16.252   8.551
  820   2HG   PRO 105          2HG       PRO 105  -1.703  15.235   7.724
  821   1HD   PRO 105          1HD       PRO 105  -2.344  17.752   6.993
  822   2HD   PRO 105          2HD       PRO 105  -1.841  16.564   5.783
  823    H    LYS 106           H        LYS 106  -5.097  17.642   7.899
  824    HA   LYS 106           HA       LYS 106  -7.521  17.010   9.125
  825   1HB   LYS 106          1HB       LYS 106  -7.737  19.447   9.557
  826   2HB   LYS 106          2HB       LYS 106  -6.171  18.766   9.988
  827   1HG   LYS 106          1HG       LYS 106  -5.219  19.643   7.918
  828   2HG   LYS 106          2HG       LYS 106  -6.786  20.337   7.502
  829   1HD   LYS 106          1HD       LYS 106  -5.285  20.950  10.002
  830   2HD   LYS 106          2HD       LYS 106  -5.147  21.927   8.533
  831   1HE   LYS 106          1HE       LYS 106  -7.635  22.299   8.673
  832   2HE   LYS 106          2HE       LYS 106  -7.619  21.449  10.214
  833   1HZ   LYS 106          1HZ       LYS 106  -6.098  23.912   9.620
  834   2HZ   LYS 106          2HZ       LYS 106  -6.147  23.130  11.106
  835   3HZ   LYS 106          3HZ       LYS 106  -7.546  23.859  10.472
  836    H    GLU 107           H        GLU 107  -6.862  18.005   5.913
  837    HA   GLU 107           HA       GLU 107  -9.655  18.619   5.312
  838   1HB   GLU 107          1HB       GLU 107  -7.076  19.103   3.819
  839   2HB   GLU 107          2HB       GLU 107  -8.661  19.357   3.110
  840   1HG   GLU 107          1HG       GLU 107  -7.699  20.748   5.589
  841   2HG   GLU 107          2HG       GLU 107  -7.543  21.414   3.964
  842    H    ASP 108           H        ASP 108  -8.066  15.939   5.733
  843    HA   ASP 108           HA       ASP 108  -8.276  14.599   3.231
  844   1HB   ASP 108          1HB       ASP 108  -6.559  13.746   4.635
  845   2HB   ASP 108          2HB       ASP 108  -7.540  13.837   6.069
  846    H    THR 109           H        THR 109  -9.607  12.378   3.589
  847    HA   THR 109           HA       THR 109 -12.324  13.260   3.721
  848    HB   THR 109           HB       THR 109 -11.728  11.593   2.032
  849    HG1  THR 109           1HG      THR 109 -13.799  11.438   3.342
  850   1HG2  THR 109          1HG2      THR 109  -9.870  10.597   3.207
  851   2HG2  THR 109          2HG2      THR 109 -10.975   9.331   2.637
  852   3HG2  THR 109          3HG2      THR 109 -10.962   9.822   4.344
  Start of MODEL    5
    1    H    THR  10           H        THR  10  -1.860 -23.070   4.099
    2    HA   THR  10           HA       THR  10  -4.238 -22.511   5.674
    3    HB   THR  10           HB       THR  10  -2.579 -22.278   7.654
    4    HG1  THR  10           1HG      THR  10  -0.716 -22.554   6.305
    5   1HG2  THR  10          1HG2      THR  10  -3.229 -25.030   6.572
    6   2HG2  THR  10          2HG2      THR  10  -4.303 -24.032   7.549
    7   3HG2  THR  10          3HG2      THR  10  -2.811 -24.665   8.247
    8    H    SER  11           H        SER  11  -4.584 -20.625   4.662
    9    HA   SER  11           HA       SER  11  -2.467 -18.761   4.098
   10   1HB   SER  11          1HB       SER  11  -5.385 -18.603   3.916
   11   2HB   SER  11          2HB       SER  11  -4.251 -17.413   3.238
   12    HG   SER  11           HG       SER  11  -5.112 -19.673   2.070
   13    H    SER  12           H        SER  12  -4.277 -19.409   6.759
   14    HA   SER  12           HA       SER  12  -4.536 -16.848   7.727
   15   1HB   SER  12          1HB       SER  12  -4.627 -18.151   9.909
   16   2HB   SER  12          2HB       SER  12  -5.698 -18.651   8.573
   17    HG   SER  12           HG       SER  12  -3.785 -20.099   9.815
   18    H    GLU  13           H        GLU  13  -1.884 -19.360   8.243
   19    HA   GLU  13           HA       GLU  13  -0.261 -17.464   9.381
   20   1HB   GLU  13          1HB       GLU  13   1.342 -19.405   9.442
   21   2HB   GLU  13          2HB       GLU  13  -0.209 -19.691  10.214
   22   1HG   GLU  13          1HG       GLU  13  -0.953 -20.863   8.089
   23   2HG   GLU  13          2HG       GLU  13   0.675 -20.670   7.507
   24    H    LEU  14           H        LEU  14  -0.514 -18.995   6.213
   25    HA   LEU  14           HA       LEU  14   1.978 -18.372   5.078
   26   1HB   LEU  14          1HB       LEU  14   0.021 -19.795   4.154
   27   2HB   LEU  14          2HB       LEU  14  -0.673 -18.279   3.667
   28    HG   LEU  14           HG       LEU  14   1.985 -19.221   2.575
   29   1HD1  LEU  14          1HD1      LEU  14   0.738 -19.961   0.599
   30   2HD1  LEU  14          2HD1      LEU  14  -0.778 -19.597   1.424
   31   3HD1  LEU  14          3HD1      LEU  14   0.274 -20.870   2.038
   32   1HD2  LEU  14          1HD2      LEU  14   1.486 -17.650   0.758
   33   2HD2  LEU  14          2HD2      LEU  14   1.500 -16.812   2.313
   34   3HD2  LEU  14          3HD2      LEU  14  -0.033 -17.211   1.542
   35    H    ALA  15           H        ALA  15  -0.858 -16.698   5.422
   36    HA   ALA  15           HA       ALA  15   0.108 -14.483   3.853
   37   1HB   ALA  15          1HB       ALA  15  -2.152 -14.991   3.348
   38   2HB   ALA  15          2HB       ALA  15  -2.043 -13.399   4.145
   39   3HB   ALA  15          3HB       ALA  15  -2.584 -14.802   5.048
   40    H    LYS  16           H        LYS  16  -0.036 -15.379   7.083
   41    HA   LYS  16           HA       LYS  16  -0.156 -12.840   8.324
   42   1HB   LYS  16          1HB       LYS  16  -0.240 -14.991   9.571
   43   2HB   LYS  16          2HB       LYS  16   1.444 -15.283   9.166
   44   1HG   LYS  16          1HG       LYS  16   2.055 -13.240  10.426
   45   2HG   LYS  16          2HG       LYS  16   0.371 -13.055  10.895
   46   1HD   LYS  16          1HD       LYS  16   2.155 -15.400  11.560
   47   2HD   LYS  16          2HD       LYS  16   1.676 -14.119  12.667
   48   1HE   LYS  16          1HE       LYS  16  -0.154 -16.141  11.359
   49   2HE   LYS  16          2HE       LYS  16   0.356 -16.120  13.042
   50   1HZ   LYS  16          1HZ       LYS  16  -1.830 -15.223  12.835
   51   2HZ   LYS  16          2HZ       LYS  16  -1.372 -14.131  11.684
   52   3HZ   LYS  16          3HZ       LYS  16  -0.810 -13.959  13.278
   53    H    LYS  17           H        LYS  17   2.375 -14.708   6.817
   54    HA   LYS  17           HA       LYS  17   4.372 -12.720   7.272
   55   1HB   LYS  17          1HB       LYS  17   4.328 -15.228   5.588
   56   2HB   LYS  17          2HB       LYS  17   5.676 -14.109   5.537
   57   1HG   LYS  17          1HG       LYS  17   6.238 -15.942   7.000
   58   2HG   LYS  17          2HG       LYS  17   6.035 -14.490   7.967
   59   1HD   LYS  17          1HD       LYS  17   3.816 -15.246   8.653
   60   2HD   LYS  17          2HD       LYS  17   3.970 -16.673   7.633
   61   1HE   LYS  17          1HE       LYS  17   5.932 -17.384   8.977
   62   2HE   LYS  17          2HE       LYS  17   5.699 -15.981  10.018
   63   1HZ   LYS  17          1HZ       LYS  17   4.761 -18.057  10.908
   64   2HZ   LYS  17          2HZ       LYS  17   3.701 -18.151   9.627
   65   3HZ   LYS  17          3HZ       LYS  17   3.592 -16.871  10.743
   66    H    SER  18           H        SER  18   2.177 -13.628   4.632
   67    HA   SER  18           HA       SER  18   3.287 -11.895   2.782
   68   1HB   SER  18          1HB       SER  18   0.385 -12.749   2.916
   69   2HB   SER  18          2HB       SER  18   1.211 -12.111   1.503
   70    HG   SER  18           HG       SER  18   2.720 -13.963   1.927
   71    H    LYS  19           H        LYS  19   1.113 -11.243   5.434
   72    HA   LYS  19           HA       LYS  19   0.165  -8.624   4.670
   73   1HB   LYS  19          1HB       LYS  19   0.708  -9.742   7.468
   74   2HB   LYS  19          2HB       LYS  19  -0.267  -8.334   7.042
   75   1HG   LYS  19          1HG       LYS  19  -1.012 -11.067   6.163
   76   2HG   LYS  19          2HG       LYS  19  -1.427 -10.439   7.752
   77   1HD   LYS  19          1HD       LYS  19  -2.537  -8.550   6.724
   78   2HD   LYS  19          2HD       LYS  19  -2.097  -9.161   5.125
   79   1HE   LYS  19          1HE       LYS  19  -4.326  -9.806   5.602
   80   2HE   LYS  19          2HE       LYS  19  -3.213 -11.196   5.620
   81   1HZ   LYS  19          1HZ       LYS  19  -4.187  -9.833   8.074
   82   2HZ   LYS  19          2HZ       LYS  19  -3.281 -11.273   7.978
   83   3HZ   LYS  19          3HZ       LYS  19  -4.861 -11.243   7.451
   84    H    GLU  20           H        GLU  20   2.954  -9.620   6.604
   85    HA   GLU  20           HA       GLU  20   3.747  -6.914   6.748
   86   1HB   GLU  20          1HB       GLU  20   5.872  -7.745   7.710
   87   2HB   GLU  20          2HB       GLU  20   4.440  -8.310   8.548
   88   1HG   GLU  20          1HG       GLU  20   4.657 -10.471   7.541
   89   2HG   GLU  20          2HG       GLU  20   6.005  -9.909   6.549
   90    H    VAL  21           H        VAL  21   4.624  -9.559   4.596
   91    HA   VAL  21           HA       VAL  21   6.721  -8.143   3.319
   92    HB   VAL  21           HB       VAL  21   5.006 -10.450   2.317
   93   1HG1  VAL  21          1HG1      VAL  21   5.959  -9.197   0.431
   94   2HG1  VAL  21          2HG1      VAL  21   6.728 -10.775   0.601
   95   3HG1  VAL  21          3HG1      VAL  21   7.561  -9.324   1.157
   96   1HG2  VAL  21          1HG2      VAL  21   6.372 -11.022   4.245
   97   2HG2  VAL  21          2HG2      VAL  21   7.801 -10.365   3.449
   98   3HG2  VAL  21          3HG2      VAL  21   7.009 -11.794   2.793
   99    H    PHE  22           H        PHE  22   3.297  -8.536   2.469
  100    HA   PHE  22           HA       PHE  22   3.358  -6.926   0.161
  101   1HB   PHE  22          1HB       PHE  22   1.437  -8.224   0.307
  102   2HB   PHE  22          2HB       PHE  22   1.272  -7.928   2.038
  103    HD1  PHE  22           1HD      PHE  22  -0.399  -6.467   2.733
  104    HD2  PHE  22           2HD      PHE  22   1.101  -6.097  -1.213
  105    HE1  PHE  22           1HE      PHE  22  -1.985  -4.674   2.299
  106    HE2  PHE  22           2HE      PHE  22  -0.493  -4.286  -1.645
  107    HZ   PHE  22           HZ       PHE  22  -2.051  -3.577   0.123
  108    H    ARG  23           H        ARG  23   2.375  -6.178   3.477
  109    HA   ARG  23           HA       ARG  23   1.909  -3.466   2.901
  110   1HB   ARG  23          1HB       ARG  23   1.871  -2.930   5.236
  111   2HB   ARG  23          2HB       ARG  23   1.221  -4.554   5.038
  112   1HG   ARG  23          1HG       ARG  23   2.678  -5.391   6.414
  113   2HG   ARG  23          2HG       ARG  23   4.048  -4.698   5.529
  114   1HD   ARG  23          1HD       ARG  23   3.602  -2.574   6.718
  115   2HD   ARG  23          2HD       ARG  23   2.388  -3.404   7.713
  116    HE   ARG  23           HE       ARG  23   5.179  -4.308   7.599
  117   1HH1  ARG  23          1HH1      ARG  23   2.461  -3.214   9.604
  118   2HH1  ARG  23          2HH1      ARG  23   3.334  -3.328  11.058
  119   1HH2  ARG  23          1HH2      ARG  23   6.350  -4.449   9.598
  120   2HH2  ARG  23          2HH2      ARG  23   5.582  -4.071  11.071
  121    H    LYS  24           H        LYS  24   4.933  -5.095   3.618
  122    HA   LYS  24           HA       LYS  24   6.422  -2.786   4.115
  123   1HB   LYS  24          1HB       LYS  24   7.068  -5.127   4.686
  124   2HB   LYS  24          2HB       LYS  24   7.350  -5.423   2.991
  125   1HG   LYS  24          1HG       LYS  24   9.180  -3.835   2.985
  126   2HG   LYS  24          2HG       LYS  24   8.845  -3.444   4.674
  127   1HD   LYS  24          1HD       LYS  24   9.256  -5.749   5.321
  128   2HD   LYS  24          2HD       LYS  24   9.597  -6.170   3.646
  129   1HE   LYS  24          1HE       LYS  24  11.134  -4.127   5.230
  130   2HE   LYS  24          2HE       LYS  24  11.617  -5.817   5.073
  131   1HZ   LYS  24          1HZ       LYS  24  12.761  -4.346   3.503
  132   2HZ   LYS  24          2HZ       LYS  24  11.289  -3.960   2.759
  133   3HZ   LYS  24          3HZ       LYS  24  11.862  -5.521   2.727
  134    H    GLU  25           H        GLU  25   5.899  -4.739   1.101
  135    HA   GLU  25           HA       GLU  25   7.541  -2.969  -0.366
  136   1HB   GLU  25          1HB       GLU  25   6.221  -4.283  -2.277
  137   2HB   GLU  25          2HB       GLU  25   7.730  -4.873  -1.548
  138   1HG   GLU  25          1HG       GLU  25   6.160  -6.124  -0.006
  139   2HG   GLU  25          2HG       GLU  25   4.879  -5.674  -1.118
  140    H    MET  26           H        MET  26   4.192  -3.113   0.282
  141    HA   MET  26           HA       MET  26   3.628  -1.154  -1.696
  142   1HB   MET  26          1HB       MET  26   2.003  -2.737  -0.849
  143   2HB   MET  26          2HB       MET  26   2.098  -1.919   0.703
  144   1HG   MET  26          1HG       MET  26   0.125  -1.247  -0.879
  145   2HG   MET  26          2HG       MET  26   1.010  -0.008   0.009
  146   1HE   MET  26          1HE       MET  26   1.248  -0.539  -4.570
  147   2HE   MET  26          2HE       MET  26  -0.089  -1.122  -3.625
  148   3HE   MET  26          3HE       MET  26   1.478  -1.989  -3.561
  149    H    SER  27           H        SER  27   4.421  -1.046   1.662
  150    HA   SER  27           HA       SER  27   3.925   1.686   2.090
  151   1HB   SER  27          1HB       SER  27   6.080   0.013   3.442
  152   2HB   SER  27          2HB       SER  27   5.581   1.620   3.960
  153    HG   SER  27           HG       SER  27   3.915  -0.651   3.787
  154    H    GLN  28           H        GLN  28   6.694  -0.084   0.842
  155    HA   GLN  28           HA       GLN  28   8.282   2.281   0.653
  156   1HB   GLN  28          1HB       GLN  28   9.759   1.028  -0.783
  157   2HB   GLN  28          2HB       GLN  28   9.424   0.190   0.770
  158   1HG   GLN  28          1HG       GLN  28   7.894  -1.196  -0.486
  159   2HG   GLN  28          2HG       GLN  28   8.360  -0.375  -1.961
  160   1HE2  GLN  28          1HE2      GLN  28  11.168  -0.185  -1.132
  161   2HE2  GLN  28          2HE2      GLN  28  11.831  -1.751  -1.376
  162    H    PHE  29           H        PHE  29   6.570   0.395  -1.592
  163    HA   PHE  29           HA       PHE  29   6.841   1.832  -3.940
  164   1HB   PHE  29          1HB       PHE  29   5.609  -0.297  -3.867
  165   2HB   PHE  29          2HB       PHE  29   4.317   0.472  -2.963
  166    HD1  PHE  29           1HD      PHE  29   2.596   1.704  -4.070
  167    HD2  PHE  29           2HD      PHE  29   5.975   0.270  -6.227
  168    HE1  PHE  29           1HE      PHE  29   1.473   2.221  -6.152
  169    HE2  PHE  29           2HE      PHE  29   4.834   0.788  -8.332
  170    HZ   PHE  29           HZ       PHE  29   2.545   1.775  -8.273
  171    H    ILE  30           H        ILE  30   4.315   2.314  -1.479
  172    HA   ILE  30           HA       ILE  30   3.230   4.622  -2.612
  173    HB   ILE  30           HB       ILE  30   3.167   3.602   0.231
  174   1HG1  ILE  30          1HG1      ILE  30   0.988   3.793  -1.845
  175   2HG1  ILE  30          2HG1      ILE  30   1.997   2.372  -1.623
  176   1HG2  ILE  30          1HG2      ILE  30   2.985   6.045   0.254
  177   2HG2  ILE  30          2HG2      ILE  30   1.440   5.302   0.702
  178   3HG2  ILE  30          3HG2      ILE  30   1.683   5.970  -0.919
  179   1HD1  ILE  30          1HD1      ILE  30   1.156   2.123   0.638
  180   2HD1  ILE  30          2HD1      ILE  30  -0.154   2.106  -0.511
  181   3HD1  ILE  30          3HD1      ILE  30   0.146   3.541   0.457
  182    H    VAL  31           H        VAL  31   5.651   4.239  -0.021
  183    HA   VAL  31           HA       VAL  31   6.185   6.888   0.409
  184    HB   VAL  31           HB       VAL  31   7.974   4.461   0.440
  185   1HG1  VAL  31          1HG1      VAL  31   9.771   5.772   1.485
  186   2HG1  VAL  31          2HG1      VAL  31   8.843   7.246   1.266
  187   3HG1  VAL  31          3HG1      VAL  31   9.450   6.373  -0.143
  188   1HG2  VAL  31          1HG2      VAL  31   7.946   4.870   2.869
  189   2HG2  VAL  31          2HG2      VAL  31   6.313   4.716   2.203
  190   3HG2  VAL  31          3HG2      VAL  31   6.947   6.300   2.600
  191    H    GLN  32           H        GLN  32   7.577   4.858  -2.149
  192    HA   GLN  32           HA       GLN  32   9.259   6.687  -3.273
  193   1HB   GLN  32          1HB       GLN  32   8.960   4.166  -3.628
  194   2HB   GLN  32          2HB       GLN  32   7.711   4.570  -4.762
  195   1HG   GLN  32          1HG       GLN  32  10.611   5.318  -5.042
  196   2HG   GLN  32          2HG       GLN  32   9.829   3.967  -5.836
  197   1HE2  GLN  32          1HE2      GLN  32  10.425   7.336  -5.856
  198   2HE2  GLN  32          2HE2      GLN  32   9.659   7.691  -7.353
  199    H    CYS  33           H        CYS  33   5.866   5.886  -3.916
  200    HA   CYS  33           HA       CYS  33   5.311   7.603  -6.077
  201   1HB   CYS  33          1HB       CYS  33   3.584   6.410  -3.957
  202   2HB   CYS  33          2HB       CYS  33   2.932   7.260  -5.361
  203    HG   CYS  33           HG       CYS  33   4.567   4.319  -5.148
  204    H    LEU  34           H        LEU  34   5.124   8.087  -2.631
  205    HA   LEU  34           HA       LEU  34   3.981  10.709  -2.836
  206   1HB   LEU  34          1HB       LEU  34   5.234   9.338  -0.485
  207   2HB   LEU  34          2HB       LEU  34   4.416  10.881  -0.417
  208    HG   LEU  34           HG       LEU  34   3.177   8.239  -1.115
  209   1HD1  LEU  34          1HD1      LEU  34   3.739   8.498   1.240
  210   2HD1  LEU  34          2HD1      LEU  34   1.988   8.572   1.024
  211   3HD1  LEU  34          3HD1      LEU  34   2.912  10.051   1.293
  212   1HD2  LEU  34          1HD2      LEU  34   1.050   9.454  -1.032
  213   2HD2  LEU  34          2HD2      LEU  34   2.087  10.010  -2.339
  214   3HD2  LEU  34          3HD2      LEU  34   1.933  10.969  -0.866
  215    H    ASN  35           H        ASN  35   7.207   9.483  -2.739
  216    HA   ASN  35           HA       ASN  35   8.760  11.439  -1.986
  217   1HB   ASN  35          1HB       ASN  35   9.057   9.474  -4.042
  218   2HB   ASN  35          2HB       ASN  35  10.101  10.892  -4.314
  219   1HD2  ASN  35          1HD2      ASN  35   8.906   8.760  -1.858
  220   2HD2  ASN  35          2HD2      ASN  35  10.288   8.883  -0.881
  221    HA   PRO  36           HA       PRO  36   8.326  14.286  -5.929
  222   1HB   PRO  36          1HB       PRO  36   6.063  13.977  -7.442
  223   2HB   PRO  36          2HB       PRO  36   7.591  13.196  -7.838
  224   1HG   PRO  36          1HG       PRO  36   5.202  12.073  -6.457
  225   2HG   PRO  36          2HG       PRO  36   6.252  11.328  -7.676
  226   1HD   PRO  36          1HD       PRO  36   6.429  10.779  -5.045
  227   2HD   PRO  36          2HD       PRO  36   7.845  10.731  -6.094
  228    H    TYR  37           H        TYR  37   5.832  13.340  -3.803
  229    HA   TYR  37           HA       TYR  37   4.363  15.823  -4.078
  230   1HB   TYR  37          1HB       TYR  37   3.938  13.457  -2.255
  231   2HB   TYR  37          2HB       TYR  37   2.926  14.893  -2.254
  232    HD1  TYR  37           1HD      TYR  37   4.010  12.024  -4.276
  233    HD2  TYR  37           2HD      TYR  37   1.210  15.175  -3.862
  234    HE1  TYR  37           1HE      TYR  37   2.697  11.018  -6.011
  235    HE2  TYR  37           2HE      TYR  37  -0.151  14.266  -5.606
  236    HH   TYR  37           HH       TYR  37   0.049  12.756  -7.506
  237    H    ARG  38           H        ARG  38   6.809  14.489  -2.091
  238    HA   ARG  38           HA       ARG  38   6.381  16.512  -0.049
  239   1HB   ARG  38          1HB       ARG  38   8.244  15.553   1.134
  240   2HB   ARG  38          2HB       ARG  38   7.131  14.292   0.627
  241   1HG   ARG  38          1HG       ARG  38   8.570  13.691  -1.178
  242   2HG   ARG  38          2HG       ARG  38   9.672  15.007  -0.793
  243   1HD   ARG  38          1HD       ARG  38   9.969  14.000   1.480
  244   2HD   ARG  38          2HD       ARG  38   8.896  12.699   0.964
  245    HE   ARG  38           HE       ARG  38  11.146  12.883  -0.751
  246   1HH1  ARG  38          1HH1      ARG  38  10.258  11.842   2.521
  247   2HH1  ARG  38          2HH1      ARG  38  11.406  10.598   2.608
  248   1HH2  ARG  38          1HH2      ARG  38  12.763  11.193  -0.620
  249   2HH2  ARG  38          2HH2      ARG  38  12.890  10.233   0.783
  250    H    LYS  39           H        LYS  39   7.650  16.566  -2.965
  251    HA   LYS  39           HA       LYS  39  10.037  18.124  -2.614
  252   1HB   LYS  39          1HB       LYS  39   8.177  17.869  -4.993
  253   2HB   LYS  39          2HB       LYS  39   9.781  18.580  -5.016
  254   1HG   LYS  39          1HG       LYS  39   9.161  15.710  -4.391
  255   2HG   LYS  39          2HG       LYS  39   9.744  16.321  -5.943
  256   1HD   LYS  39          1HD       LYS  39  11.768  17.100  -4.907
  257   2HD   LYS  39          2HD       LYS  39  11.169  16.603  -3.324
  258   1HE   LYS  39          1HE       LYS  39  11.085  14.336  -4.024
  259   2HE   LYS  39          2HE       LYS  39  11.655  14.759  -5.641
  260   1HZ   LYS  39          1HZ       LYS  39  13.483  13.958  -4.273
  261   2HZ   LYS  39          2HZ       LYS  39  13.160  15.121  -3.104
  262   3HZ   LYS  39          3HZ       LYS  39  13.720  15.591  -4.621
  263    HA   PRO  40           HA       PRO  40   7.816  21.960  -1.824
  264   1HB   PRO  40          1HB       PRO  40   9.775  23.710  -2.555
  265   2HB   PRO  40          2HB       PRO  40   9.756  22.866  -1.004
  266   1HG   PRO  40          1HG       PRO  40  11.304  22.220  -3.491
  267   2HG   PRO  40          2HG       PRO  40  11.827  22.159  -1.801
  268   1HD   PRO  40          1HD       PRO  40  11.123  19.950  -3.191
  269   2HD   PRO  40          2HD       PRO  40  10.847  20.102  -1.441
  270    H    ASP  41           H        ASP  41   8.732  20.757  -4.772
  271    HA   ASP  41           HA       ASP  41   7.768  22.981  -6.383
  272   1HB   ASP  41          1HB       ASP  41   9.887  22.023  -7.069
  273   2HB   ASP  41          2HB       ASP  41   9.217  20.401  -7.029
  274    H    CYS  42           H        CYS  42   6.611  20.440  -4.792
  275    HA   CYS  42           HA       CYS  42   4.999  19.066  -6.667
  276   1HB   CYS  42          1HB       CYS  42   5.475  18.154  -4.424
  277   2HB   CYS  42          2HB       CYS  42   4.464  19.402  -3.717
  278    HG   CYS  42           HG       CYS  42   2.776  17.309  -3.577
  279    H    LYS  43           H        LYS  43   3.082  19.444  -7.514
  280    HA   LYS  43           HA       LYS  43   2.107  22.159  -7.241
  281   1HB   LYS  43          1HB       LYS  43   1.355  19.997  -9.217
  282   2HB   LYS  43          2HB       LYS  43   0.698  21.618  -9.214
  283   1HG   LYS  43          1HG       LYS  43   2.328  21.574 -10.919
  284   2HG   LYS  43          2HG       LYS  43   3.047  22.449  -9.575
  285   1HD   LYS  43          1HD       LYS  43   4.335  20.490  -8.941
  286   2HD   LYS  43          2HD       LYS  43   3.554  19.539 -10.203
  287   1HE   LYS  43          1HE       LYS  43   4.522  21.000 -11.909
  288   2HE   LYS  43          2HE       LYS  43   5.280  21.970 -10.651
  289   1HZ   LYS  43          1HZ       LYS  43   6.698  20.252 -11.794
  290   2HZ   LYS  43          2HZ       LYS  43   5.879  19.070 -10.902
  291   3HZ   LYS  43          3HZ       LYS  43   6.756  20.275 -10.126
  292    H    VAL  44           H        VAL  44   1.147  18.904  -6.530
  293    HA   VAL  44           HA       VAL  44  -1.271  19.921  -5.315
  294    HB   VAL  44           HB       VAL  44  -1.942  19.218  -7.570
  295   1HG1  VAL  44          1HG1      VAL  44  -0.262  17.657  -8.121
  296   2HG1  VAL  44          2HG1      VAL  44  -1.847  16.894  -8.286
  297   3HG1  VAL  44          3HG1      VAL  44  -0.834  16.535  -6.886
  298   1HG2  VAL  44          1HG2      VAL  44  -3.719  17.660  -6.985
  299   2HG2  VAL  44          2HG2      VAL  44  -3.551  18.932  -5.772
  300   3HG2  VAL  44          3HG2      VAL  44  -2.916  17.315  -5.452
  301    H    GLY  45           H        GLY  45  -1.508  19.169  -3.407
  302   1HA   GLY  45          1HA       GLY  45  -1.368  17.842  -1.552
  303   2HA   GLY  45          2HA       GLY  45  -1.004  16.485  -2.617
  304    H    ARG  46           H        ARG  46   0.819  19.615  -1.864
  305    HA   ARG  46           HA       ARG  46   3.219  18.151  -1.831
  306   1HB   ARG  46          1HB       ARG  46   3.125  20.533  -2.495
  307   2HB   ARG  46          2HB       ARG  46   2.624  20.943  -0.856
  308   1HG   ARG  46          1HG       ARG  46   4.701  20.082   0.033
  309   2HG   ARG  46          2HG       ARG  46   5.231  19.639  -1.586
  310   1HD   ARG  46          1HD       ARG  46   6.252  21.699  -0.849
  311   2HD   ARG  46          2HD       ARG  46   5.175  21.985  -2.235
  312    HE   ARG  46           HE       ARG  46   3.848  23.230  -0.914
  313   1HH1  ARG  46          1HH1      ARG  46   6.304  21.664   1.147
  314   2HH1  ARG  46          2HH1      ARG  46   5.966  22.590   2.521
  315   1HH2  ARG  46          1HH2      ARG  46   3.363  24.493   1.004
  316   2HH2  ARG  46          2HH2      ARG  46   4.219  24.240   2.460
  317    H    ILE  47           H        ILE  47   3.957  17.015  -0.263
  318    HA   ILE  47           HA       ILE  47   2.699  16.976   2.286
  319    HB   ILE  47           HB       ILE  47   5.264  15.495   1.504
  320   1HG1  ILE  47          1HG1      ILE  47   2.361  14.600   1.481
  321   2HG1  ILE  47          2HG1      ILE  47   3.287  15.025   0.048
  322   1HG2  ILE  47          1HG2      ILE  47   3.415  15.162   3.823
  323   2HG2  ILE  47          2HG2      ILE  47   5.099  15.672   3.839
  324   3HG2  ILE  47          3HG2      ILE  47   4.668  14.047   3.312
  325   1HD1  ILE  47          1HD1      ILE  47   3.947  12.776   1.922
  326   2HD1  ILE  47          2HD1      ILE  47   4.759  13.169   0.397
  327   3HD1  ILE  47          3HD1      ILE  47   3.087  12.621   0.393
  328    H    THR  48           H        THR  48   3.003  18.154   3.882
  329    HA   THR  48           HA       THR  48   4.638  20.348   4.059
  330    HB   THR  48           HB       THR  48   3.818  20.326   6.444
  331    HG1  THR  48           1HG      THR  48   2.924  18.531   7.153
  332   1HG2  THR  48          1HG2      THR  48   1.504  20.581   5.814
  333   2HG2  THR  48          2HG2      THR  48   1.858  19.664   4.337
  334   3HG2  THR  48          3HG2      THR  48   2.554  21.282   4.552
  335    H    THR  49           H        THR  49   4.853  17.309   5.762
  336    HA   THR  49           HA       THR  49   7.687  17.738   6.168
  337    HB   THR  49           HB       THR  49   6.862  16.907   8.725
  338    HG1  THR  49           1HG      THR  49   4.799  17.756   8.382
  339   1HG2  THR  49          1HG2      THR  49   7.850  19.075   9.406
  340   2HG2  THR  49          2HG2      THR  49   7.872  19.570   7.712
  341   3HG2  THR  49          3HG2      THR  49   8.846  18.201   8.247
  342    H    THR  50           H        THR  50   8.754  15.943   7.176
  343    HA   THR  50           HA       THR  50   8.314  13.596   5.782
  344    HB   THR  50           HB       THR  50  10.338  14.495   6.556
  345    HG1  THR  50           1HG      THR  50  10.112  12.308   5.981
  346   1HG2  THR  50          1HG2      THR  50  11.184  14.062   8.856
  347   2HG2  THR  50          2HG2      THR  50   9.545  13.501   9.267
  348   3HG2  THR  50          3HG2      THR  50   9.795  15.164   8.757
  349    H    GLU  51           H        GLU  51   7.514  14.420   9.154
  350    HA   GLU  51           HA       GLU  51   6.533  11.870   9.917
  351   1HB   GLU  51          1HB       GLU  51   5.246  14.407  10.782
  352   2HB   GLU  51          2HB       GLU  51   5.440  12.937  11.743
  353   1HG   GLU  51          1HG       GLU  51   6.918  14.358  12.763
  354   2HG   GLU  51          2HG       GLU  51   7.986  13.667  11.535
  355    H    ASP  52           H        ASP  52   4.980  14.540   8.115
  356    HA   ASP  52           HA       ASP  52   2.375  13.416   8.130
  357   1HB   ASP  52          1HB       ASP  52   3.840  15.471   6.522
  358   2HB   ASP  52          2HB       ASP  52   2.157  15.068   6.258
  359    H    PHE  53           H        PHE  53   5.145  13.418   6.056
  360    HA   PHE  53           HA       PHE  53   4.104  12.055   3.875
  361   1HB   PHE  53          1HB       PHE  53   6.332  13.174   3.861
  362   2HB   PHE  53          2HB       PHE  53   6.874  12.078   5.111
  363    HD1  PHE  53           1HD      PHE  53   6.309  12.546   1.587
  364    HD2  PHE  53           2HD      PHE  53   7.371   9.748   4.583
  365    HE1  PHE  53           1HE      PHE  53   7.202  11.052  -0.135
  366    HE2  PHE  53           2HE      PHE  53   8.246   8.247   2.906
  367    HZ   PHE  53           HZ       PHE  53   8.176   8.907   0.493
  368    H    LYS  54           H        LYS  54   5.688  10.909   6.766
  369    HA   LYS  54           HA       LYS  54   5.526   8.085   6.280
  370   1HB   LYS  54          1HB       LYS  54   5.853   9.640   8.834
  371   2HB   LYS  54          2HB       LYS  54   5.963   7.885   8.697
  372   1HG   LYS  54          1HG       LYS  54   7.842   8.061   7.204
  373   2HG   LYS  54          2HG       LYS  54   7.685   9.805   7.152
  374   1HD   LYS  54          1HD       LYS  54   9.531   9.262   8.560
  375   2HD   LYS  54          2HD       LYS  54   8.236   9.863   9.587
  376   1HE   LYS  54          1HE       LYS  54   8.763   6.921   9.151
  377   2HE   LYS  54          2HE       LYS  54   9.557   7.844  10.420
  378   1HZ   LYS  54          1HZ       LYS  54   7.334   8.334  11.325
  379   2HZ   LYS  54          2HZ       LYS  54   7.684   6.709  11.307
  380   3HZ   LYS  54          3HZ       LYS  54   6.622   7.316  10.183
  381    H    HIS  55           H        HIS  55   3.352  10.357   7.923
  382    HA   HIS  55           HA       HIS  55   1.529   8.429   8.985
  383   1HB   HIS  55          1HB       HIS  55   1.660  10.783   9.789
  384   2HB   HIS  55          2HB       HIS  55   1.237  11.339   8.197
  385    HD1  HIS  55           1HD      HIS  55  -0.342   9.762  11.211
  386    HD2  HIS  55           2HD      HIS  55  -1.493  11.345   7.550
  387    HE1  HIS  55           1HE      HIS  55  -2.832   9.982  11.344
  388    H    LEU  56           H        LEU  56   1.548  10.394   6.089
  389    HA   LEU  56           HA       LEU  56  -0.873   9.272   5.108
  390   1HB   LEU  56          1HB       LEU  56   0.792  11.374   4.371
  391   2HB   LEU  56          2HB       LEU  56   0.909  10.220   3.064
  392    HG   LEU  56           HG       LEU  56  -1.235  11.981   3.940
  393   1HD1  LEU  56          1HD1      LEU  56  -0.014  12.476   1.996
  394   2HD1  LEU  56          2HD1      LEU  56  -1.692  12.185   1.586
  395   3HD1  LEU  56          3HD1      LEU  56  -0.473  10.951   1.248
  396   1HD2  LEU  56          1HD2      LEU  56  -1.950   9.262   2.826
  397   2HD2  LEU  56          2HD2      LEU  56  -3.051  10.638   2.958
  398   3HD2  LEU  56          3HD2      LEU  56  -2.444   9.915   4.394
  399    H    ALA  57           H        ALA  57   2.571   8.522   4.356
  400    HA   ALA  57           HA       ALA  57   1.968   6.656   2.405
  401   1HB   ALA  57          1HB       ALA  57   4.284   6.508   4.339
  402   2HB   ALA  57          2HB       ALA  57   4.266   7.533   2.914
  403   3HB   ALA  57          3HB       ALA  57   4.206   5.777   2.737
  404    H    ARG  58           H        ARG  58   2.171   6.305   5.837
  405    HA   ARG  58           HA       ARG  58   1.866   3.467   5.708
  406   1HB   ARG  58          1HB       ARG  58   1.732   3.402   8.116
  407   2HB   ARG  58          2HB       ARG  58   2.930   4.602   7.670
  408   1HG   ARG  58          1HG       ARG  58   1.265   6.367   8.073
  409   2HG   ARG  58          2HG       ARG  58   0.134   5.131   8.623
  410   1HD   ARG  58          1HD       ARG  58   2.830   5.724   9.808
  411   2HD   ARG  58          2HD       ARG  58   1.277   6.207  10.492
  412    HE   ARG  58           HE       ARG  58   1.305   3.423  10.126
  413   1HH1  ARG  58          1HH1      ARG  58   2.749   5.889  12.223
  414   2HH1  ARG  58          2HH1      ARG  58   3.057   4.829  13.501
  415   1HH2  ARG  58          1HH2      ARG  58   1.707   1.976  11.859
  416   2HH2  ARG  58          2HH2      ARG  58   2.441   2.505  13.302
  417    H    LYS  59           H        LYS  59  -0.378   6.123   6.183
  418    HA   LYS  59           HA       LYS  59  -2.611   4.554   6.821
  419   1HB   LYS  59          1HB       LYS  59  -2.476   6.949   7.302
  420   2HB   LYS  59          2HB       LYS  59  -2.502   7.305   5.581
  421   1HG   LYS  59          1HG       LYS  59  -4.742   6.490   5.385
  422   2HG   LYS  59          2HG       LYS  59  -4.725   5.909   7.047
  423   1HD   LYS  59          1HD       LYS  59  -4.411   8.257   7.805
  424   2HD   LYS  59          2HD       LYS  59  -4.583   8.776   6.126
  425   1HE   LYS  59          1HE       LYS  59  -6.666   7.184   7.617
  426   2HE   LYS  59          2HE       LYS  59  -6.661   8.939   7.490
  427   1HZ   LYS  59          1HZ       LYS  59  -8.080   7.702   5.874
  428   2HZ   LYS  59          2HZ       LYS  59  -6.674   7.245   5.039
  429   3HZ   LYS  59          3HZ       LYS  59  -7.066   8.874   5.257
  430    H    LEU  60           H        LEU  60  -1.380   5.834   3.765
  431    HA   LEU  60           HA       LEU  60  -3.489   5.044   2.230
  432   1HB   LEU  60          1HB       LEU  60  -0.621   5.469   1.487
  433   2HB   LEU  60          2HB       LEU  60  -1.911   5.356   0.282
  434    HG   LEU  60           HG       LEU  60  -2.033   7.245   2.539
  435   1HD1  LEU  60          1HD1      LEU  60  -1.268   9.013   0.823
  436   2HD1  LEU  60          2HD1      LEU  60  -0.595   7.649  -0.096
  437   3HD1  LEU  60          3HD1      LEU  60  -0.057   7.972   1.534
  438   1HD2  LEU  60          1HD2      LEU  60  -3.572   8.464   1.031
  439   2HD2  LEU  60          2HD2      LEU  60  -4.075   6.817   1.429
  440   3HD2  LEU  60          3HD2      LEU  60  -3.366   7.161  -0.148
  441    H    THR  61           H        THR  61  -0.438   3.518   3.024
  442    HA   THR  61           HA       THR  61  -0.566   1.117   1.578
  443    HB   THR  61           HB       THR  61   0.443   1.444   4.421
  444    HG1  THR  61           1HG      THR  61   1.505   2.885   2.937
  445   1HG2  THR  61          1HG2      THR  61   1.890  -0.484   3.875
  446   2HG2  THR  61          2HG2      THR  61   1.109  -0.611   2.299
  447   3HG2  THR  61          3HG2      THR  61   0.179  -0.900   3.770
  448    H    HIS  62           H        HIS  62  -1.890   2.088   4.621
  449    HA   HIS  62           HA       HIS  62  -2.932  -0.480   5.228
  450   1HB   HIS  62          1HB       HIS  62  -2.279   1.114   7.003
  451   2HB   HIS  62          2HB       HIS  62  -3.555   2.202   6.492
  452    HD1  HIS  62           1HD      HIS  62  -2.939  -0.942   8.415
  453    HD2  HIS  62           2HD      HIS  62  -6.119   1.544   7.446
  454    HE1  HIS  62           1HE      HIS  62  -4.788  -1.610   9.954
  455    H    GLY  63           H        GLY  63  -4.288   2.305   3.629
  456   1HA   GLY  63          1HA       GLY  63  -6.957   1.293   3.767
  457   2HA   GLY  63          2HA       GLY  63  -6.473   2.646   2.786
  458    H    VAL  64           H        VAL  64  -4.366   1.120   1.366
  459    HA   VAL  64           HA       VAL  64  -5.975  -0.082  -0.721
  460    HB   VAL  64           HB       VAL  64  -2.966  -0.216  -0.210
  461   1HG1  VAL  64          1HG1      VAL  64  -2.750  -1.066  -2.564
  462   2HG1  VAL  64          2HG1      VAL  64  -4.490  -1.144  -2.672
  463   3HG1  VAL  64          3HG1      VAL  64  -3.645  -2.180  -1.548
  464   1HG2  VAL  64          1HG2      VAL  64  -3.741   2.029  -0.759
  465   2HG2  VAL  64          2HG2      VAL  64  -4.555   1.404  -2.197
  466   3HG2  VAL  64          3HG2      VAL  64  -2.799   1.352  -2.091
  467    H    MET  65           H        MET  65  -4.069  -1.104   1.799
  468    HA   MET  65           HA       MET  65  -4.020  -3.919   1.462
  469   1HB   MET  65          1HB       MET  65  -2.482  -2.888   3.035
  470   2HB   MET  65          2HB       MET  65  -3.809  -2.235   3.950
  471   1HG   MET  65          1HG       MET  65  -4.450  -4.372   4.722
  472   2HG   MET  65          2HG       MET  65  -3.181  -5.155   3.786
  473   1HE   MET  65          1HE       MET  65  -2.705  -6.174   6.320
  474   2HE   MET  65          2HE       MET  65  -3.836  -4.988   6.999
  475   3HE   MET  65          3HE       MET  65  -2.207  -5.130   7.676
  476    H    ASN  66           H        ASN  66  -6.074  -1.935   3.526
  477    HA   ASN  66           HA       ASN  66  -7.746  -4.068   4.289
  478   1HB   ASN  66          1HB       ASN  66  -7.590  -1.218   4.686
  479   2HB   ASN  66          2HB       ASN  66  -9.237  -1.804   4.743
  480   1HD2  ASN  66          1HD2      ASN  66  -6.142  -1.724   6.133
  481   2HD2  ASN  66          2HD2      ASN  66  -6.522  -2.538   7.616
  482    H    LYS  67           H        LYS  67  -7.973  -1.718   1.725
  483    HA   LYS  67           HA       LYS  67 -10.630  -2.312   1.043
  484   1HB   LYS  67          1HB       LYS  67  -9.310  -0.335   0.234
  485   2HB   LYS  67          2HB       LYS  67  -8.421  -1.415  -0.815
  486   1HG   LYS  67          1HG       LYS  67 -10.479  -1.937  -2.033
  487   2HG   LYS  67          2HG       LYS  67 -11.385  -0.873  -0.952
  488   1HD   LYS  67          1HD       LYS  67  -9.927   1.007  -1.659
  489   2HD   LYS  67          2HD       LYS  67  -9.151  -0.071  -2.813
  490   1HE   LYS  67          1HE       LYS  67 -10.827   1.285  -3.928
  491   2HE   LYS  67          2HE       LYS  67 -11.307  -0.409  -3.932
  492   1HZ   LYS  67          1HZ       LYS  67 -12.890   0.008  -2.209
  493   2HZ   LYS  67          2HZ       LYS  67 -13.127   1.162  -3.381
  494   3HZ   LYS  67          3HZ       LYS  67 -12.316   1.573  -1.959
  495    H    GLU  68           H        GLU  68  -7.515  -3.757  -0.059
  496    HA   GLU  68           HA       GLU  68  -9.043  -5.459  -1.656
  497   1HB   GLU  68          1HB       GLU  68  -6.948  -6.555  -2.231
  498   2HB   GLU  68          2HB       GLU  68  -7.015  -4.800  -2.452
  499   1HG   GLU  68          1HG       GLU  68  -5.656  -4.474  -0.504
  500   2HG   GLU  68          2HG       GLU  68  -5.508  -6.216  -0.268
  501    H    LEU  69           H        LEU  69  -7.573  -5.798   1.554
  502    HA   LEU  69           HA       LEU  69  -8.232  -8.428   1.952
  503   1HB   LEU  69          1HB       LEU  69  -8.063  -6.027   3.650
  504   2HB   LEU  69          2HB       LEU  69  -9.047  -7.309   4.304
  505    HG   LEU  69           HG       LEU  69  -6.685  -7.210   5.082
  506   1HD1  LEU  69          1HD1      LEU  69  -6.342  -9.666   4.937
  507   2HD1  LEU  69          2HD1      LEU  69  -7.551  -9.745   3.654
  508   3HD1  LEU  69          3HD1      LEU  69  -8.025  -9.268   5.283
  509   1HD2  LEU  69          1HD2      LEU  69  -4.955  -8.125   3.670
  510   2HD2  LEU  69          2HD2      LEU  69  -5.636  -6.649   2.978
  511   3HD2  LEU  69          3HD2      LEU  69  -6.092  -8.228   2.328
  512    H    LYS  70           H        LYS  70 -10.483  -5.670   1.696
  513    HA   LYS  70           HA       LYS  70 -12.717  -7.142   2.659
  514   1HB   LYS  70          1HB       LYS  70 -12.567  -4.623   1.046
  515   2HB   LYS  70          2HB       LYS  70 -14.010  -5.262   1.827
  516   1HG   LYS  70          1HG       LYS  70 -12.919  -5.052   3.941
  517   2HG   LYS  70          2HG       LYS  70 -11.491  -4.403   3.137
  518   1HD   LYS  70          1HD       LYS  70 -12.721  -2.456   3.891
  519   2HD   LYS  70          2HD       LYS  70 -12.935  -2.647   2.141
  520   1HE   LYS  70          1HE       LYS  70 -15.044  -2.058   3.164
  521   2HE   LYS  70          2HE       LYS  70 -15.113  -3.686   2.500
  522   1HZ   LYS  70          1HZ       LYS  70 -14.826  -2.926   5.356
  523   2HZ   LYS  70          2HZ       LYS  70 -14.726  -4.516   4.841
  524   3HZ   LYS  70          3HZ       LYS  70 -16.154  -3.648   4.651
  525    H    TYR  71           H        TYR  71 -11.395  -6.350  -0.383
  526    HA   TYR  71           HA       TYR  71 -13.621  -7.549  -1.842
  527   1HB   TYR  71          1HB       TYR  71 -10.980  -6.467  -2.848
  528   2HB   TYR  71          2HB       TYR  71 -12.273  -7.044  -3.883
  529    HD1  TYR  71           1HD      TYR  71 -13.046  -5.067  -0.841
  530    HD2  TYR  71           2HD      TYR  71 -12.403  -4.904  -5.051
  531    HE1  TYR  71           1HE      TYR  71 -13.912  -2.873  -0.838
  532    HE2  TYR  71           2HE      TYR  71 -13.307  -2.617  -5.069
  533    HH   TYR  71           HH       TYR  71 -14.839  -1.265  -3.645
  534    H    CYS  72           H        CYS  72 -10.432  -8.446  -0.945
  535    HA   CYS  72           HA       CYS  72 -10.309 -10.736  -2.700
  536   1HB   CYS  72          1HB       CYS  72  -8.485  -9.725  -0.546
  537   2HB   CYS  72          2HB       CYS  72  -8.105 -11.155  -1.468
  538    HG   CYS  72           HG       CYS  72  -7.359  -9.973  -3.661
  539    H    LYS  73           H        LYS  73 -10.504 -10.158   0.794
  540    HA   LYS  73           HA       LYS  73 -11.407 -11.300   2.464
  541   1HB   LYS  73          1HB       LYS  73 -12.561 -12.989   0.258
  542   2HB   LYS  73          2HB       LYS  73 -13.007 -13.174   1.960
  543   1HG   LYS  73          1HG       LYS  73 -14.163 -11.214   2.030
  544   2HG   LYS  73          2HG       LYS  73 -13.146 -10.442   0.818
  545   1HD   LYS  73          1HD       LYS  73 -14.223 -11.666  -0.919
  546   2HD   LYS  73          2HD       LYS  73 -15.217 -12.562   0.247
  547   1HE   LYS  73          1HE       LYS  73 -16.223 -10.419   0.958
  548   2HE   LYS  73          2HE       LYS  73 -15.231  -9.574  -0.222
  549   1HZ   LYS  73          1HZ       LYS  73 -17.492  -9.949  -0.983
  550   2HZ   LYS  73          2HZ       LYS  73 -17.261 -11.629  -0.909
  551   3HZ   LYS  73          3HZ       LYS  73 -16.371 -10.694  -1.986
  552    H    ASN  74           H        ASN  74  -9.730 -13.230   0.147
  553    HA   ASN  74           HA       ASN  74  -8.462 -14.646   2.364
  554   1HB   ASN  74          1HB       ASN  74  -7.805 -16.389   0.761
  555   2HB   ASN  74          2HB       ASN  74  -9.540 -16.141   0.660
  556   1HD2  ASN  74          1HD2      ASN  74 -10.391 -15.140  -1.215
  557   2HD2  ASN  74          2HD2      ASN  74  -9.473 -15.046  -2.672
  558    HA   PRO  75           HA       PRO  75  -5.110 -11.876   1.254
  559   1HB   PRO  75          1HB       PRO  75  -3.379 -12.883   2.853
  560   2HB   PRO  75          2HB       PRO  75  -4.509 -11.564   3.218
  561   1HG   PRO  75          1HG       PRO  75  -4.522 -14.428   4.183
  562   2HG   PRO  75          2HG       PRO  75  -5.341 -13.048   4.927
  563   1HD   PRO  75          1HD       PRO  75  -6.508 -15.055   3.370
  564   2HD   PRO  75          2HD       PRO  75  -7.246 -13.500   3.801
  565    H    GLU  76           H        GLU  76  -5.273 -14.999   0.634
  566    HA   GLU  76           HA       GLU  76  -2.641 -15.606  -0.146
  567   1HB   GLU  76          1HB       GLU  76  -4.429 -17.310   0.149
  568   2HB   GLU  76          2HB       GLU  76  -5.283 -16.627  -1.223
  569   1HG   GLU  76          1HG       GLU  76  -3.247 -17.221  -2.603
  570   2HG   GLU  76          2HG       GLU  76  -2.709 -18.159  -1.212
  571    H    ASP  77           H        ASP  77  -4.918 -13.531  -1.091
  572    HA   ASP  77           HA       ASP  77  -4.057 -13.196  -3.925
  573   1HB   ASP  77          1HB       ASP  77  -6.503 -13.744  -3.401
  574   2HB   ASP  77          2HB       ASP  77  -6.571 -12.182  -2.602
  575    H    LEU  78           H        LEU  78  -3.326 -12.122  -0.938
  576    HA   LEU  78           HA       LEU  78  -3.356  -9.308  -1.484
  577   1HB   LEU  78          1HB       LEU  78  -4.188 -10.216   0.628
  578   2HB   LEU  78          2HB       LEU  78  -2.632 -11.011   0.826
  579    HG   LEU  78           HG       LEU  78  -1.581  -8.888   0.846
  580   1HD1  LEU  78          1HD1      LEU  78  -4.396  -7.819   1.150
  581   2HD1  LEU  78          2HD1      LEU  78  -3.318  -7.504  -0.211
  582   3HD1  LEU  78          3HD1      LEU  78  -2.944  -6.860   1.388
  583   1HD2  LEU  78          1HD2      LEU  78  -1.891 -10.026   2.881
  584   2HD2  LEU  78          2HD2      LEU  78  -3.553  -9.470   3.009
  585   3HD2  LEU  78          3HD2      LEU  78  -2.221  -8.319   3.179
  586    H    GLU  79           H        GLU  79  -1.674  -8.959  -2.804
  587    HA   GLU  79           HA       GLU  79   1.075  -9.549  -1.993
  588   1HB   GLU  79          1HB       GLU  79   0.200 -11.285  -3.627
  589   2HB   GLU  79          2HB       GLU  79  -0.225  -9.894  -4.635
  590   1HG   GLU  79          1HG       GLU  79   1.671 -10.916  -5.390
  591   2HG   GLU  79          2HG       GLU  79   2.028  -9.277  -4.870
  592    H    CYS  80           H        CYS  80   2.389  -7.885  -2.654
  593    HA   CYS  80           HA       CYS  80   0.986  -5.535  -3.606
  594   1HB   CYS  80          1HB       CYS  80   2.634  -5.130  -1.824
  595   2HB   CYS  80          2HB       CYS  80   3.920  -5.851  -2.746
  596    HG   CYS  80           HG       CYS  80   2.973  -2.772  -2.578
  597    H    ASN  81           H        ASN  81   0.451  -6.603  -5.470
  598    HA   ASN  81           HA       ASN  81   2.710  -7.129  -7.127
  599   1HB   ASN  81          1HB       ASN  81   1.234  -8.378  -8.668
  600   2HB   ASN  81          2HB       ASN  81   1.000  -8.931  -7.006
  601   1HD2  ASN  81          1HD2      ASN  81  -0.931  -8.499  -6.081
  602   2HD2  ASN  81          2HD2      ASN  81  -2.285  -7.900  -6.948
  603    H    GLU  82           H        GLU  82   1.916  -6.760  -9.580
  604    HA   GLU  82           HA       GLU  82   2.033  -4.253 -10.272
  605   1HB   GLU  82          1HB       GLU  82   1.033  -6.681 -11.334
  606   2HB   GLU  82          2HB       GLU  82   0.738  -5.280 -12.372
  607   1HG   GLU  82          1HG       GLU  82   2.901  -6.362 -13.003
  608   2HG   GLU  82          2HG       GLU  82   3.099  -4.741 -12.309
  609    H    ASN  83           H        ASN  83  -0.939  -6.159 -10.237
  610    HA   ASN  83           HA       ASN  83  -2.914  -4.340 -10.957
  611   1HB   ASN  83          1HB       ASN  83  -3.294  -6.784 -10.611
  612   2HB   ASN  83          2HB       ASN  83  -3.041  -6.574  -8.886
  613   1HD2  ASN  83          1HD2      ASN  83  -5.116  -7.272  -8.352
  614   2HD2  ASN  83          2HD2      ASN  83  -6.536  -6.365  -8.701
  615    H    VAL  84           H        VAL  84  -1.656  -5.279  -7.734
  616    HA   VAL  84           HA       VAL  84  -3.223  -3.472  -6.405
  617    HB   VAL  84           HB       VAL  84  -0.639  -4.799  -5.596
  618   1HG1  VAL  84          1HG1      VAL  84  -2.506  -3.139  -3.898
  619   2HG1  VAL  84          2HG1      VAL  84  -0.780  -2.841  -4.208
  620   3HG1  VAL  84          3HG1      VAL  84  -1.294  -4.256  -3.288
  621   1HG2  VAL  84          1HG2      VAL  84  -3.490  -5.261  -4.854
  622   2HG2  VAL  84          2HG2      VAL  84  -2.098  -6.178  -4.278
  623   3HG2  VAL  84          3HG2      VAL  84  -2.544  -6.224  -5.991
  624    H    LYS  85           H        LYS  85   0.122  -3.241  -7.516
  625    HA   LYS  85           HA       LYS  85   0.868  -0.711  -6.513
  626   1HB   LYS  85          1HB       LYS  85   1.627  -2.029  -9.114
  627   2HB   LYS  85          2HB       LYS  85   2.410  -0.600  -8.457
  628   1HG   LYS  85          1HG       LYS  85   3.244  -1.791  -6.624
  629   2HG   LYS  85          2HG       LYS  85   2.247  -3.201  -7.001
  630   1HD   LYS  85          1HD       LYS  85   3.534  -3.305  -9.202
  631   2HD   LYS  85          2HD       LYS  85   4.656  -2.152  -8.467
  632   1HE   LYS  85          1HE       LYS  85   5.049  -3.626  -6.639
  633   2HE   LYS  85          2HE       LYS  85   3.802  -4.714  -7.252
  634   1HZ   LYS  85          1HZ       LYS  85   5.234  -5.082  -9.244
  635   2HZ   LYS  85          2HZ       LYS  85   5.903  -5.624  -7.822
  636   3HZ   LYS  85          3HZ       LYS  85   6.472  -4.194  -8.494
  637    H    HIS  86           H        HIS  86  -0.576  -1.587  -9.458
  638    HA   HIS  86           HA       HIS  86  -0.695   0.890 -10.704
  639   1HB   HIS  86          1HB       HIS  86  -1.190  -1.275 -11.820
  640   2HB   HIS  86          2HB       HIS  86  -2.742  -1.304 -10.991
  641    HD1  HIS  86           1HD      HIS  86  -4.457  -0.780 -12.692
  642    HD2  HIS  86           2HD      HIS  86  -1.114   1.604 -12.994
  643    HE1  HIS  86           1HE      HIS  86  -4.958   0.782 -14.592
  644    H    LYS  87           H        LYS  87  -3.180  -0.760  -8.892
  645    HA   LYS  87           HA       LYS  87  -5.046   1.363  -8.994
  646   1HB   LYS  87          1HB       LYS  87  -4.881  -0.912  -7.036
  647   2HB   LYS  87          2HB       LYS  87  -6.209   0.232  -7.109
  648   1HG   LYS  87          1HG       LYS  87  -6.716  -0.504  -9.371
  649   2HG   LYS  87          2HG       LYS  87  -5.367  -1.647  -9.280
  650   1HD   LYS  87          1HD       LYS  87  -6.412  -2.732  -7.364
  651   2HD   LYS  87          2HD       LYS  87  -7.754  -1.592  -7.466
  652   1HE   LYS  87          1HE       LYS  87  -6.929  -3.389  -9.691
  653   2HE   LYS  87          2HE       LYS  87  -8.164  -3.862  -8.511
  654   1HZ   LYS  87          1HZ       LYS  87  -9.157  -2.992 -10.507
  655   2HZ   LYS  87          2HZ       LYS  87  -8.260  -1.598 -10.442
  656   3HZ   LYS  87          3HZ       LYS  87  -9.446  -1.875  -9.280
  657    H    THR  88           H        THR  88  -2.495   0.693  -6.934
  658    HA   THR  88           HA       THR  88  -3.236   2.257  -4.706
  659    HB   THR  88           HB       THR  88  -0.717   1.023  -5.675
  660    HG1  THR  88           1HG      THR  88  -2.081  -0.435  -4.884
  661   1HG2  THR  88          1HG2      THR  88  -0.155   3.011  -4.564
  662   2HG2  THR  88          2HG2      THR  88   0.279   1.632  -3.529
  663   3HG2  THR  88          3HG2      THR  88  -1.162   2.626  -3.159
  664    H    LYS  89           H        LYS  89  -0.757   2.721  -7.138
  665    HA   LYS  89           HA       LYS  89  -0.304   5.204  -6.186
  666   1HB   LYS  89          1HB       LYS  89   0.905   5.573  -8.509
  667   2HB   LYS  89          2HB       LYS  89   1.529   4.551  -7.235
  668   1HG   LYS  89          1HG       LYS  89   1.761   3.355  -9.249
  669   2HG   LYS  89          2HG       LYS  89   0.422   2.613  -8.364
  670   1HD   LYS  89          1HD       LYS  89  -0.180   2.683 -10.507
  671   2HD   LYS  89          2HD       LYS  89  -1.019   3.979  -9.684
  672   1HE   LYS  89          1HE       LYS  89  -0.126   4.825 -11.877
  673   2HE   LYS  89          2HE       LYS  89   0.623   5.623 -10.488
  674   1HZ   LYS  89          1HZ       LYS  89   2.241   5.003 -12.185
  675   2HZ   LYS  89          2HZ       LYS  89   1.823   3.400 -12.038
  676   3HZ   LYS  89          3HZ       LYS  89   2.568   4.205 -10.743
  677    H    GLU  90           H        GLU  90  -2.458   4.052  -8.683
  678    HA   GLU  90           HA       GLU  90  -3.359   6.562  -9.717
  679   1HB   GLU  90          1HB       GLU  90  -5.000   4.065  -9.318
  680   2HB   GLU  90          2HB       GLU  90  -5.518   5.465 -10.232
  681   1HG   GLU  90          1HG       GLU  90  -3.589   5.045 -11.764
  682   2HG   GLU  90          2HG       GLU  90  -3.329   3.528 -10.894
  683    H    TYR  91           H        TYR  91  -4.220   4.757  -6.790
  684    HA   TYR  91           HA       TYR  91  -6.514   6.305  -6.179
  685   1HB   TYR  91          1HB       TYR  91  -6.606   4.215  -5.143
  686   2HB   TYR  91          2HB       TYR  91  -4.891   4.210  -4.770
  687    HD1  TYR  91           1HD      TYR  91  -7.964   6.177  -3.829
  688    HD2  TYR  91           2HD      TYR  91  -4.304   4.404  -2.547
  689    HE1  TYR  91           1HE      TYR  91  -8.453   6.829  -1.498
  690    HE2  TYR  91           2HE      TYR  91  -4.760   5.047  -0.268
  691    HH   TYR  91           HH       TYR  91  -6.089   6.726   0.928
  692    H    ILE  92           H        ILE  92  -3.191   6.041  -5.122
  693    HA   ILE  92           HA       ILE  92  -2.952   8.110  -3.305
  694    HB   ILE  92           HB       ILE  92  -1.014   7.231  -5.441
  695   1HG1  ILE  92          1HG1      ILE  92  -1.928   5.795  -3.435
  696   2HG1  ILE  92          2HG1      ILE  92  -0.230   5.604  -3.959
  697   1HG2  ILE  92          1HG2      ILE  92   0.773   8.340  -4.157
  698   2HG2  ILE  92          2HG2      ILE  92  -0.470   8.957  -3.047
  699   3HG2  ILE  92          3HG2      ILE  92  -0.475   9.474  -4.725
  700   1HD1  ILE  92          1HD1      ILE  92   0.298   7.168  -2.139
  701   2HD1  ILE  92          2HD1      ILE  92  -0.466   5.661  -1.588
  702   3HD1  ILE  92          3HD1      ILE  92  -1.423   7.159  -1.733
  703    H    LYS  93           H        LYS  93  -2.389   8.443  -6.782
  704    HA   LYS  93           HA       LYS  93  -1.950  11.173  -6.748
  705   1HB   LYS  93          1HB       LYS  93  -3.234   9.472  -8.879
  706   2HB   LYS  93          2HB       LYS  93  -2.776  11.154  -9.119
  707   1HG   LYS  93          1HG       LYS  93  -0.440  10.556  -8.700
  708   2HG   LYS  93          2HG       LYS  93  -0.921   8.877  -8.459
  709   1HD   LYS  93          1HD       LYS  93  -1.745   8.766 -10.750
  710   2HD   LYS  93          2HD       LYS  93  -1.319  10.461 -10.996
  711   1HE   LYS  93          1HE       LYS  93   1.032   9.926 -10.596
  712   2HE   LYS  93          2HE       LYS  93   0.599   8.237 -10.337
  713   1HZ   LYS  93          1HZ       LYS  93   0.158   9.710 -12.881
  714   2HZ   LYS  93          2HZ       LYS  93  -0.073   8.058 -12.628
  715   3HZ   LYS  93          3HZ       LYS  93   1.463   8.709 -12.557
  716    H    LYS  94           H        LYS  94  -4.969   9.403  -7.100
  717    HA   LYS  94           HA       LYS  94  -6.415  11.788  -7.591
  718   1HB   LYS  94          1HB       LYS  94  -7.248   9.565  -8.372
  719   2HB   LYS  94          2HB       LYS  94  -7.545   9.119  -6.697
  720   1HG   LYS  94          1HG       LYS  94  -9.624   9.778  -7.687
  721   2HG   LYS  94          2HG       LYS  94  -9.144  11.016  -6.528
  722   1HD   LYS  94          1HD       LYS  94  -8.190  12.329  -8.435
  723   2HD   LYS  94          2HD       LYS  94  -8.868  11.135  -9.535
  724   1HE   LYS  94          1HE       LYS  94 -10.338  13.000  -7.682
  725   2HE   LYS  94          2HE       LYS  94 -10.364  12.990  -9.438
  726   1HZ   LYS  94          1HZ       LYS  94 -12.357  12.005  -8.669
  727   2HZ   LYS  94          2HZ       LYS  94 -11.552  11.024  -7.595
  728   3HZ   LYS  94          3HZ       LYS  94 -11.412  10.716  -9.259
  729    H    TYR  95           H        TYR  95  -5.648   9.862  -4.802
  730    HA   TYR  95           HA       TYR  95  -7.337  11.101  -2.988
  731   1HB   TYR  95          1HB       TYR  95  -6.302   9.017  -2.555
  732   2HB   TYR  95          2HB       TYR  95  -4.706   9.757  -2.791
  733    HD1  TYR  95           1HD      TYR  95  -3.623  10.683  -0.916
  734    HD2  TYR  95           2HD      TYR  95  -7.775   9.881  -0.690
  735    HE1  TYR  95           1HE      TYR  95  -3.638  11.428   1.405
  736    HE2  TYR  95           2HE      TYR  95  -7.809  10.577   1.656
  737    HH   TYR  95           HH       TYR  95  -6.257  10.861   3.555
  738    H    MET  96           H        MET  96  -3.948  11.772  -3.736
  739    HA   MET  96           HA       MET  96  -3.830  13.889  -1.921
  740   1HB   MET  96          1HB       MET  96  -2.113  13.467  -4.307
  741   2HB   MET  96          2HB       MET  96  -1.746  14.479  -2.908
  742   1HG   MET  96          1HG       MET  96  -2.221  12.179  -1.622
  743   2HG   MET  96          2HG       MET  96  -1.707  11.535  -3.188
  744   1HE   MET  96          1HE       MET  96  -0.398  14.789  -1.667
  745   2HE   MET  96          2HE       MET  96   0.808  14.198  -0.495
  746   3HE   MET  96          3HE       MET  96  -0.919  13.812  -0.290
  747    H    GLN  97           H        GLN  97  -5.049  13.723  -5.013
  748    HA   GLN  97           HA       GLN  97  -4.858  16.445  -5.793
  749   1HB   GLN  97          1HB       GLN  97  -7.191  14.691  -6.550
  750   2HB   GLN  97          2HB       GLN  97  -6.649  16.138  -7.379
  751   1HG   GLN  97          1HG       GLN  97  -5.336  13.460  -7.244
  752   2HG   GLN  97          2HG       GLN  97  -5.935  14.293  -8.668
  753   1HE2  GLN  97          1HE2      GLN  97  -3.416  13.858  -6.445
  754   2HE2  GLN  97          2HE2      GLN  97  -2.194  14.815  -7.155
  755    H    LYS  98           H        LYS  98  -6.833  14.976  -3.449
  756    HA   LYS  98           HA       LYS  98  -8.841  16.975  -3.552
  757   1HB   LYS  98          1HB       LYS  98  -9.884  15.858  -1.690
  758   2HB   LYS  98          2HB       LYS  98  -9.343  14.724  -2.906
  759   1HG   LYS  98          1HG       LYS  98  -8.631  13.551  -1.011
  760   2HG   LYS  98          2HG       LYS  98  -7.289  14.505  -1.416
  761   1HD   LYS  98          1HD       LYS  98  -7.933  14.488   1.042
  762   2HD   LYS  98          2HD       LYS  98  -7.476  16.008   0.281
  763   1HE   LYS  98          1HE       LYS  98  -9.340  16.167   1.774
  764   2HE   LYS  98          2HE       LYS  98  -9.793  16.693   0.149
  765   1HZ   LYS  98          1HZ       LYS  98 -10.808  14.310  -0.019
  766   2HZ   LYS  98          2HZ       LYS  98 -11.550  15.454   0.939
  767   3HZ   LYS  98          3HZ       LYS  98 -10.640  14.283   1.688
  768    H    PHE  99           H        PHE  99  -5.833  16.632  -1.916
  769    HA   PHE  99           HA       PHE  99  -6.410  18.395   0.247
  770   1HB   PHE  99          1HB       PHE  99  -3.744  17.522  -0.887
  771   2HB   PHE  99          2HB       PHE  99  -3.925  18.549   0.529
  772    HD1  PHE  99           1HD      PHE  99  -5.713  17.510   2.272
  773    HD2  PHE  99           2HD      PHE  99  -3.275  15.319  -0.439
  774    HE1  PHE  99           1HE      PHE  99  -5.854  15.510   3.753
  775    HE2  PHE  99           2HE      PHE  99  -3.428  13.337   1.062
  776    HZ   PHE  99           HZ       PHE  99  -4.791  13.479   3.111
  777    H    GLY 100           H        GLY 100  -4.980  18.837  -2.928
  778   1HA   GLY 100          1HA       GLY 100  -5.499  20.864  -4.101
  779   2HA   GLY 100          2HA       GLY 100  -5.392  21.711  -2.554
  780    H    ALA 101           H        ALA 101  -3.668  22.823  -2.386
  781    HA   ALA 101           HA       ALA 101  -1.358  22.217  -4.029
  782   1HB   ALA 101          1HB       ALA 101  -2.115  24.540  -3.757
  783   2HB   ALA 101          2HB       ALA 101  -0.457  24.306  -3.192
  784   3HB   ALA 101          3HB       ALA 101  -1.779  24.429  -2.028
  785    H    VAL 102           H        VAL 102  -2.189  22.265  -0.588
  786    HA   VAL 102           HA       VAL 102   0.367  20.883  -0.149
  787    HB   VAL 102           HB       VAL 102  -0.971  22.294   2.106
  788   1HG1  VAL 102          1HG1      VAL 102   1.911  21.894   1.450
  789   2HG1  VAL 102          2HG1      VAL 102   0.932  20.994   2.614
  790   3HG1  VAL 102          3HG1      VAL 102   1.297  22.701   2.894
  791   1HG2  VAL 102          1HG2      VAL 102   0.681  23.807   0.094
  792   2HG2  VAL 102          2HG2      VAL 102   0.163  24.424   1.673
  793   3HG2  VAL 102          3HG2      VAL 102  -1.039  24.016   0.443
  794    H    TYR 103           H        TYR 103   0.370  19.378   1.544
  795    HA   TYR 103           HA       TYR 103  -2.041  17.872   1.561
  796   1HB   TYR 103          1HB       TYR 103  -0.192  16.499   1.085
  797   2HB   TYR 103          2HB       TYR 103   0.817  17.329   2.256
  798    HD1  TYR 103           1HD      TYR 103   1.640  15.496   3.408
  799    HD2  TYR 103           2HD      TYR 103  -2.518  15.877   2.927
  800    HE1  TYR 103           1HE      TYR 103   1.287  13.696   5.079
  801    HE2  TYR 103           2HE      TYR 103  -2.904  14.159   4.562
  802    HH   TYR 103           HH       TYR 103  -0.451  13.081   6.667
  803    H    LYS 104           H        LYS 104  -3.409  18.679   2.846
  804    HA   LYS 104           HA       LYS 104  -2.754  19.224   5.648
  805   1HB   LYS 104          1HB       LYS 104  -5.097  20.007   3.944
  806   2HB   LYS 104          2HB       LYS 104  -4.881  20.482   5.613
  807   1HG   LYS 104          1HG       LYS 104  -2.961  21.841   5.020
  808   2HG   LYS 104          2HG       LYS 104  -3.030  21.260   3.355
  809   1HD   LYS 104          1HD       LYS 104  -5.213  22.836   4.729
  810   2HD   LYS 104          2HD       LYS 104  -4.013  23.525   3.637
  811   1HE   LYS 104          1HE       LYS 104  -4.828  22.125   1.821
  812   2HE   LYS 104          2HE       LYS 104  -5.984  21.351   2.888
  813   1HZ   LYS 104          1HZ       LYS 104  -7.050  23.047   1.576
  814   2HZ   LYS 104          2HZ       LYS 104  -5.997  24.219   2.131
  815   3HZ   LYS 104          3HZ       LYS 104  -7.085  23.496   3.193
  816    HA   PRO 105           HA       PRO 105  -4.975  15.138   5.583
  817   1HB   PRO 105          1HB       PRO 105  -4.206  14.445   8.132
  818   2HB   PRO 105          2HB       PRO 105  -3.279  14.066   6.678
  819   1HG   PRO 105          1HG       PRO 105  -2.955  16.268   8.621
  820   2HG   PRO 105          2HG       PRO 105  -1.704  15.305   7.764
  821   1HD   PRO 105          1HD       PRO 105  -2.362  17.843   7.121
  822   2HD   PRO 105          2HD       PRO 105  -1.824  16.686   5.891
  823    H    LYS 106           H        LYS 106  -5.239  17.682   7.824
  824    HA   LYS 106           HA       LYS 106  -7.633  17.012   9.047
  825   1HB   LYS 106          1HB       LYS 106  -6.801  19.733   8.016
  826   2HB   LYS 106          2HB       LYS 106  -8.251  19.487   8.973
  827   1HG   LYS 106          1HG       LYS 106  -6.527  20.319  10.422
  828   2HG   LYS 106          2HG       LYS 106  -6.822  18.632  10.818
  829   1HD   LYS 106          1HD       LYS 106  -4.816  17.982   9.582
  830   2HD   LYS 106          2HD       LYS 106  -4.520  19.664   9.142
  831   1HE   LYS 106          1HE       LYS 106  -3.120  19.026  11.007
  832   2HE   LYS 106          2HE       LYS 106  -4.318  20.206  11.538
  833   1HZ   LYS 106          1HZ       LYS 106  -4.093  18.444  13.121
  834   2HZ   LYS 106          2HZ       LYS 106  -4.475  17.273  11.952
  835   3HZ   LYS 106          3HZ       LYS 106  -5.630  18.394  12.439
  836    H    GLU 107           H        GLU 107  -7.105  17.571   5.756
  837    HA   GLU 107           HA       GLU 107  -9.945  17.678   5.090
  838   1HB   GLU 107          1HB       GLU 107  -7.510  17.631   3.308
  839   2HB   GLU 107          2HB       GLU 107  -9.162  17.917   2.795
  840   1HG   GLU 107          1HG       GLU 107  -7.535  19.691   4.591
  841   2HG   GLU 107          2HG       GLU 107  -7.897  19.977   2.888
  842    H    ASP 108           H        ASP 108  -7.715  15.303   5.811
  843    HA   ASP 108           HA       ASP 108  -7.947  13.481   3.697
  844   1HB   ASP 108          1HB       ASP 108  -6.170  12.860   4.933
  845   2HB   ASP 108          2HB       ASP 108  -6.883  13.364   6.446
  846    H    THR 109           H        THR 109  -8.948  11.373   3.607
  847    HA   THR 109           HA       THR 109 -11.763  11.802   3.919
  848    HB   THR 109           HB       THR 109 -11.890   9.834   2.390
  849    HG1  THR 109           1HG      THR 109  -9.933   9.189   1.461
  850   1HG2  THR 109          1HG2      THR 109 -10.041  12.058   1.622
  851   2HG2  THR 109          2HG2      THR 109 -11.804  12.130   1.563
  852   3HG2  THR 109          3HG2      THR 109 -10.921  11.049   0.472
  Start of MODEL    6
    1    H    THR  10           H        THR  10  -3.973 -23.018   4.315
    2    HA   THR  10           HA       THR  10  -2.742 -22.145   6.795
    3    HB   THR  10           HB       THR  10  -0.581 -22.377   5.478
    4    HG1  THR  10           1HG      THR  10  -0.611 -23.130   3.561
    5   1HG2  THR  10          1HG2      THR  10  -1.216 -24.029   7.119
    6   2HG2  THR  10          2HG2      THR  10  -0.494 -24.835   5.724
    7   3HG2  THR  10          3HG2      THR  10  -2.244 -24.849   5.947
    8    H    SER  11           H        SER  11  -4.397 -20.822   4.494
    9    HA   SER  11           HA       SER  11  -2.563 -18.732   3.635
   10   1HB   SER  11          1HB       SER  11  -5.469 -19.104   3.166
   11   2HB   SER  11          2HB       SER  11  -4.427 -17.903   2.369
   12    HG   SER  11           HG       SER  11  -3.329 -19.492   1.331
   13    H    SER  12           H        SER  12  -4.265 -19.228   6.310
   14    HA   SER  12           HA       SER  12  -4.713 -16.454   6.741
   15   1HB   SER  12          1HB       SER  12  -5.364 -17.409   9.025
   16   2HB   SER  12          2HB       SER  12  -6.240 -17.971   7.574
   17    HG   SER  12           HG       SER  12  -5.692 -19.846   7.960
   18    H    GLU  13           H        GLU  13  -2.320 -19.112   7.823
   19    HA   GLU  13           HA       GLU  13  -0.911 -17.335   9.367
   20   1HB   GLU  13          1HB       GLU  13   0.519 -19.402   9.647
   21   2HB   GLU  13          2HB       GLU  13  -1.165 -19.593  10.110
   22   1HG   GLU  13          1HG       GLU  13  -1.627 -20.743   7.974
   23   2HG   GLU  13          2HG       GLU  13   0.033 -20.496   7.488
   24    H    LEU  14           H        LEU  14  -0.448 -18.977   6.227
   25    HA   LEU  14           HA       LEU  14   2.183 -18.410   5.578
   26   1HB   LEU  14          1HB       LEU  14   0.539 -19.825   4.331
   27   2HB   LEU  14          2HB       LEU  14  -0.200 -18.362   3.762
   28    HG   LEU  14           HG       LEU  14   1.861 -17.726   2.586
   29   1HD1  LEU  14          1HD1      LEU  14   2.862 -20.424   3.473
   30   2HD1  LEU  14          2HD1      LEU  14   3.505 -18.851   3.954
   31   3HD1  LEU  14          3HD1      LEU  14   3.638 -19.385   2.281
   32   1HD2  LEU  14          1HD2      LEU  14   0.114 -18.927   1.394
   33   2HD2  LEU  14          2HD2      LEU  14   0.807 -20.467   1.900
   34   3HD2  LEU  14          3HD2      LEU  14   1.706 -19.411   0.811
   35    H    ALA  15           H        ALA  15  -0.629 -16.781   5.426
   36    HA   ALA  15           HA       ALA  15   0.290 -14.621   3.759
   37   1HB   ALA  15          1HB       ALA  15  -1.866 -15.292   3.153
   38   2HB   ALA  15          2HB       ALA  15  -1.958 -13.686   3.947
   39   3HB   ALA  15          3HB       ALA  15  -2.408 -15.131   4.828
   40    H    LYS  16           H        LYS  16  -0.015 -15.259   7.044
   41    HA   LYS  16           HA       LYS  16  -0.302 -12.557   7.982
   42   1HB   LYS  16          1HB       LYS  16  -0.645 -14.620   9.386
   43   2HB   LYS  16          2HB       LYS  16   1.077 -14.924   9.269
   44   1HG   LYS  16          1HG       LYS  16   1.544 -12.869  10.476
   45   2HG   LYS  16          2HG       LYS  16  -0.187 -12.515  10.550
   46   1HD   LYS  16          1HD       LYS  16  -0.549 -14.604  11.769
   47   2HD   LYS  16          2HD       LYS  16   1.181 -14.922  11.712
   48   1HE   LYS  16          1HE       LYS  16   1.603 -12.912  13.023
   49   2HE   LYS  16          2HE       LYS  16  -0.127 -12.570  13.062
   50   1HZ   LYS  16          1HZ       LYS  16  -0.494 -14.584  14.290
   51   2HZ   LYS  16          2HZ       LYS  16   0.711 -13.704  15.088
   52   3HZ   LYS  16          3HZ       LYS  16   1.112 -15.026  14.130
   53    H    LYS  17           H        LYS  17   2.264 -14.601   6.904
   54    HA   LYS  17           HA       LYS  17   4.314 -12.663   7.355
   55   1HB   LYS  17          1HB       LYS  17   4.248 -15.212   5.715
   56   2HB   LYS  17          2HB       LYS  17   5.644 -14.155   5.753
   57   1HG   LYS  17          1HG       LYS  17   6.023 -16.012   7.234
   58   2HG   LYS  17          2HG       LYS  17   5.831 -14.554   8.196
   59   1HD   LYS  17          1HD       LYS  17   3.543 -15.196   8.740
   60   2HD   LYS  17          2HD       LYS  17   3.680 -16.619   7.710
   61   1HE   LYS  17          1HE       LYS  17   3.959 -17.197  10.072
   62   2HE   LYS  17          2HE       LYS  17   5.426 -17.519   9.156
   63   1HZ   LYS  17          1HZ       LYS  17   5.859 -16.475  11.302
   64   2HZ   LYS  17          2HZ       LYS  17   4.988 -15.105  10.858
   65   3HZ   LYS  17          3HZ       LYS  17   6.404 -15.512  10.043
   66    H    SER  18           H        SER  18   2.230 -13.683   4.671
   67    HA   SER  18           HA       SER  18   3.406 -12.041   2.772
   68   1HB   SER  18          1HB       SER  18   0.496 -12.861   2.821
   69   2HB   SER  18          2HB       SER  18   1.463 -12.473   1.404
   70    HG   SER  18           HG       SER  18   2.850 -14.324   2.376
   71    H    LYS  19           H        LYS  19   1.031 -11.329   5.268
   72    HA   LYS  19           HA       LYS  19   0.124  -8.734   4.432
   73   1HB   LYS  19          1HB       LYS  19   0.554  -9.851   7.257
   74   2HB   LYS  19          2HB       LYS  19  -0.366  -8.422   6.813
   75   1HG   LYS  19          1HG       LYS  19  -1.215 -11.100   5.851
   76   2HG   LYS  19          2HG       LYS  19  -1.560 -10.563   7.485
   77   1HD   LYS  19          1HD       LYS  19  -2.536  -8.493   6.532
   78   2HD   LYS  19          2HD       LYS  19  -2.335  -9.202   4.925
   79   1HE   LYS  19          1HE       LYS  19  -4.546  -9.624   5.616
   80   2HE   LYS  19          2HE       LYS  19  -3.579 -11.119   5.710
   81   1HZ   LYS  19          1HZ       LYS  19  -3.469 -10.946   8.067
   82   2HZ   LYS  19          2HZ       LYS  19  -5.103 -10.728   7.689
   83   3HZ   LYS  19          3HZ       LYS  19  -4.139  -9.407   8.060
   84    H    GLU  20           H        GLU  20   2.757  -9.682   6.561
   85    HA   GLU  20           HA       GLU  20   3.573  -7.000   6.771
   86   1HB   GLU  20          1HB       GLU  20   5.677  -7.971   7.804
   87   2HB   GLU  20          2HB       GLU  20   4.156  -8.333   8.602
   88   1HG   GLU  20          1HG       GLU  20   4.140 -10.528   7.636
   89   2HG   GLU  20          2HG       GLU  20   5.611 -10.174   6.735
   90    H    VAL  21           H        VAL  21   4.672  -9.619   4.645
   91    HA   VAL  21           HA       VAL  21   6.779  -8.073   3.534
   92    HB   VAL  21           HB       VAL  21   5.292 -10.449   2.352
   93   1HG1  VAL  21          1HG1      VAL  21   7.961  -9.250   1.582
   94   2HG1  VAL  21          2HG1      VAL  21   6.477  -9.124   0.642
   95   3HG1  VAL  21          3HG1      VAL  21   7.244 -10.697   0.875
   96   1HG2  VAL  21          1HG2      VAL  21   6.401 -11.017   4.440
   97   2HG2  VAL  21          2HG2      VAL  21   7.909 -10.327   3.845
   98   3HG2  VAL  21          3HG2      VAL  21   7.236 -11.768   3.080
   99    H    PHE  22           H        PHE  22   3.398  -8.580   2.533
  100    HA   PHE  22           HA       PHE  22   3.485  -7.019   0.193
  101   1HB   PHE  22          1HB       PHE  22   1.563  -8.320   0.347
  102   2HB   PHE  22          2HB       PHE  22   1.354  -7.959   2.060
  103    HD1  PHE  22           1HD      PHE  22   1.300  -6.187  -1.244
  104    HD2  PHE  22           2HD      PHE  22  -0.400  -6.527   2.630
  105    HE1  PHE  22           1HE      PHE  22  -0.290  -4.410  -1.772
  106    HE2  PHE  22           2HE      PHE  22  -1.978  -4.781   2.090
  107    HZ   PHE  22           HZ       PHE  22  -1.975  -3.711  -0.062
  108    H    ARG  23           H        ARG  23   2.419  -6.243   3.444
  109    HA   ARG  23           HA       ARG  23   1.957  -3.537   2.873
  110   1HB   ARG  23          1HB       ARG  23   1.813  -3.073   5.239
  111   2HB   ARG  23          2HB       ARG  23   1.140  -4.663   4.928
  112   1HG   ARG  23          1HG       ARG  23   2.366  -5.193   6.781
  113   2HG   ARG  23          2HG       ARG  23   3.593  -5.394   5.536
  114   1HD   ARG  23          1HD       ARG  23   4.548  -4.143   7.351
  115   2HD   ARG  23          2HD       ARG  23   4.394  -3.114   5.929
  116    HE   ARG  23           HE       ARG  23   2.277  -3.036   7.915
  117   1HH1  ARG  23          1HH1      ARG  23   5.073  -1.420   6.436
  118   2HH1  ARG  23          2HH1      ARG  23   4.804   0.081   7.160
  119   1HH2  ARG  23          1HH2      ARG  23   1.919  -0.960   8.984
  120   2HH2  ARG  23          2HH2      ARG  23   2.972   0.339   8.674
  121    H    LYS  24           H        LYS  24   4.995  -5.133   3.656
  122    HA   LYS  24           HA       LYS  24   6.437  -2.755   4.069
  123   1HB   LYS  24          1HB       LYS  24   7.295  -4.879   4.838
  124   2HB   LYS  24          2HB       LYS  24   7.389  -5.473   3.190
  125   1HG   LYS  24          1HG       LYS  24   9.121  -3.920   2.659
  126   2HG   LYS  24          2HG       LYS  24   8.941  -3.113   4.212
  127   1HD   LYS  24          1HD       LYS  24   9.680  -5.108   5.370
  128   2HD   LYS  24          2HD       LYS  24   9.791  -5.983   3.840
  129   1HE   LYS  24          1HE       LYS  24  11.978  -5.185   4.657
  130   2HE   LYS  24          2HE       LYS  24  11.552  -4.521   3.086
  131   1HZ   LYS  24          1HZ       LYS  24  10.878  -2.453   4.214
  132   2HZ   LYS  24          2HZ       LYS  24  12.478  -2.834   4.543
  133   3HZ   LYS  24          3HZ       LYS  24  11.298  -3.131   5.700
  134    H    GLU  25           H        GLU  25   5.940  -4.792   1.110
  135    HA   GLU  25           HA       GLU  25   7.600  -3.069  -0.402
  136   1HB   GLU  25          1HB       GLU  25   6.308  -4.352  -2.296
  137   2HB   GLU  25          2HB       GLU  25   7.708  -5.060  -1.469
  138   1HG   GLU  25          1HG       GLU  25   6.012  -6.187  -0.011
  139   2HG   GLU  25          2HG       GLU  25   4.772  -5.577  -1.099
  140    H    MET  26           H        MET  26   4.278  -3.165   0.286
  141    HA   MET  26           HA       MET  26   3.705  -1.219  -1.706
  142   1HB   MET  26          1HB       MET  26   2.090  -2.795  -0.867
  143   2HB   MET  26          2HB       MET  26   2.186  -1.984   0.693
  144   1HG   MET  26          1HG       MET  26   0.206  -1.325  -0.899
  145   2HG   MET  26          2HG       MET  26   1.066  -0.088   0.011
  146   1HE   MET  26          1HE       MET  26   0.117  -1.353  -3.590
  147   2HE   MET  26          2HE       MET  26   1.794  -1.961  -3.623
  148   3HE   MET  26          3HE       MET  26   1.312  -0.537  -4.578
  149    H    SER  27           H        SER  27   4.485  -1.095   1.676
  150    HA   SER  27           HA       SER  27   4.059   1.646   2.049
  151   1HB   SER  27          1HB       SER  27   6.057  -0.156   3.437
  152   2HB   SER  27          2HB       SER  27   5.817   1.537   3.871
  153    HG   SER  27           HG       SER  27   3.458   0.572   3.798
  154    H    GLN  28           H        GLN  28   6.800  -0.155   0.783
  155    HA   GLN  28           HA       GLN  28   8.375   2.218   0.541
  156   1HB   GLN  28          1HB       GLN  28   9.782   0.918  -0.991
  157   2HB   GLN  28          2HB       GLN  28   9.574   0.205   0.654
  158   1HG   GLN  28          1HG       GLN  28   8.011  -1.298  -0.334
  159   2HG   GLN  28          2HG       GLN  28   8.284  -0.597  -1.921
  160   1HE2  GLN  28          1HE2      GLN  28  11.180  -0.301  -1.453
  161   2HE2  GLN  28          2HE2      GLN  28  11.827  -1.886  -1.587
  162    H    PHE  29           H        PHE  29   6.611   0.337  -1.671
  163    HA   PHE  29           HA       PHE  29   6.886   1.857  -3.972
  164   1HB   PHE  29          1HB       PHE  29   5.755  -0.324  -4.009
  165   2HB   PHE  29          2HB       PHE  29   4.416   0.339  -3.088
  166    HD1  PHE  29           1HD      PHE  29   6.099   0.292  -6.337
  167    HD2  PHE  29           2HD      PHE  29   2.719   1.592  -4.128
  168    HE1  PHE  29           1HE      PHE  29   4.929   0.822  -8.436
  169    HE2  PHE  29           2HE      PHE  29   1.546   2.123  -6.226
  170    HZ   PHE  29           HZ       PHE  29   2.622   1.732  -8.340
  171    H    ILE  30           H        ILE  30   4.375   2.238  -1.469
  172    HA   ILE  30           HA       ILE  30   3.216   4.574  -2.528
  173    HB   ILE  30           HB       ILE  30   3.243   3.484   0.290
  174   1HG1  ILE  30          1HG1      ILE  30   1.026   3.683  -1.745
  175   2HG1  ILE  30          2HG1      ILE  30   2.049   2.270  -1.533
  176   1HG2  ILE  30          1HG2      ILE  30   1.512   5.140   0.859
  177   2HG2  ILE  30          2HG2      ILE  30   1.671   5.850  -0.754
  178   3HG2  ILE  30          3HG2      ILE  30   3.013   5.943   0.369
  179   1HD1  ILE  30          1HD1      ILE  30  -0.086   2.001  -0.403
  180   2HD1  ILE  30          2HD1      ILE  30   0.226   3.436   0.561
  181   3HD1  ILE  30          3HD1      ILE  30   1.243   2.022   0.733
  182    H    VAL  31           H        VAL  31   5.756   4.160  -0.050
  183    HA   VAL  31           HA       VAL  31   6.274   6.826   0.368
  184    HB   VAL  31           HB       VAL  31   8.063   4.407   0.316
  185   1HG1  VAL  31          1HG1      VAL  31   9.458   6.439  -0.325
  186   2HG1  VAL  31          2HG1      VAL  31   9.936   5.643   1.167
  187   3HG1  VAL  31          3HG1      VAL  31   9.020   7.136   1.245
  188   1HG2  VAL  31          1HG2      VAL  31   7.118   6.255   2.498
  189   2HG2  VAL  31          2HG2      VAL  31   8.129   4.829   2.749
  190   3HG2  VAL  31          3HG2      VAL  31   6.479   4.662   2.135
  191    H    GLN  32           H        GLN  32   7.506   4.802  -2.260
  192    HA   GLN  32           HA       GLN  32   9.051   6.579  -3.542
  193   1HB   GLN  32          1HB       GLN  32   9.010   4.257  -4.048
  194   2HB   GLN  32          2HB       GLN  32   7.348   4.348  -4.589
  195   1HG   GLN  32          1HG       GLN  32   7.999   5.645  -6.481
  196   2HG   GLN  32          2HG       GLN  32   9.681   5.643  -5.929
  197   1HE2  GLN  32          1HE2      GLN  32   7.122   3.735  -7.312
  198   2HE2  GLN  32          2HE2      GLN  32   8.100   2.403  -7.771
  199    H    CYS  33           H        CYS  33   5.625   5.870  -3.832
  200    HA   CYS  33           HA       CYS  33   4.951   7.513  -5.956
  201   1HB   CYS  33          1HB       CYS  33   3.359   6.456  -3.671
  202   2HB   CYS  33          2HB       CYS  33   2.600   7.269  -5.051
  203    HG   CYS  33           HG       CYS  33   4.226   4.303  -4.890
  204    H    LEU  34           H        LEU  34   4.991   8.052  -2.508
  205    HA   LEU  34           HA       LEU  34   3.855  10.683  -2.684
  206   1HB   LEU  34          1HB       LEU  34   5.088   9.252  -0.358
  207   2HB   LEU  34          2HB       LEU  34   4.356  10.837  -0.259
  208    HG   LEU  34           HG       LEU  34   2.940   8.276  -0.976
  209   1HD1  LEU  34          1HD1      LEU  34   3.578   8.425   1.364
  210   2HD1  LEU  34          2HD1      LEU  34   1.834   8.589   1.174
  211   3HD1  LEU  34          3HD1      LEU  34   2.828  10.016   1.480
  212   1HD2  LEU  34          1HD2      LEU  34   0.888   9.627  -0.832
  213   2HD2  LEU  34          2HD2      LEU  34   1.930  10.165  -2.140
  214   3HD2  LEU  34          3HD2      LEU  34   1.863  11.082  -0.633
  215    H    ASN  35           H        ASN  35   7.111   9.427  -2.634
  216    HA   ASN  35           HA       ASN  35   8.687  11.348  -1.982
  217   1HB   ASN  35          1HB       ASN  35   8.826   9.360  -4.008
  218   2HB   ASN  35          2HB       ASN  35   9.829  10.774  -4.418
  219   1HD2  ASN  35          1HD2      ASN  35   8.914   8.658  -1.855
  220   2HD2  ASN  35          2HD2      ASN  35  10.358   8.860  -0.977
  221    HA   PRO  36           HA       PRO  36   8.199  14.195  -5.924
  222   1HB   PRO  36          1HB       PRO  36   5.855  13.960  -7.326
  223   2HB   PRO  36          2HB       PRO  36   7.341  13.146  -7.806
  224   1HG   PRO  36          1HG       PRO  36   4.991  12.074  -6.319
  225   2HG   PRO  36          2HG       PRO  36   5.971  11.302  -7.574
  226   1HD   PRO  36          1HD       PRO  36   6.240  10.754  -4.950
  227   2HD   PRO  36          2HD       PRO  36   7.614  10.673  -6.053
  228    H    TYR  37           H        TYR  37   5.688  13.309  -3.794
  229    HA   TYR  37           HA       TYR  37   4.272  15.817  -4.091
  230   1HB   TYR  37          1HB       TYR  37   3.838  13.496  -2.215
  231   2HB   TYR  37          2HB       TYR  37   2.842  14.944  -2.249
  232    HD1  TYR  37           1HD      TYR  37   3.859  11.979  -4.161
  233    HD2  TYR  37           2HD      TYR  37   1.183  15.235  -3.887
  234    HE1  TYR  37           1HE      TYR  37   2.487  10.956  -5.883
  235    HE2  TYR  37           2HE      TYR  37  -0.222  14.242  -5.622
  236    HH   TYR  37           HH       TYR  37  -0.009  12.705  -7.443
  237    H    ARG  38           H        ARG  38   6.676  14.455  -2.072
  238    HA   ARG  38           HA       ARG  38   6.242  16.514  -0.066
  239   1HB   ARG  38          1HB       ARG  38   8.110  15.533   1.143
  240   2HB   ARG  38          2HB       ARG  38   6.937  14.309   0.684
  241   1HG   ARG  38          1HG       ARG  38   8.315  13.607  -1.133
  242   2HG   ARG  38          2HG       ARG  38   9.485  14.878  -0.783
  243   1HD   ARG  38          1HD       ARG  38   9.823  13.896   1.440
  244   2HD   ARG  38          2HD       ARG  38   8.654  12.635   1.022
  245    HE   ARG  38           HE       ARG  38  10.667  12.651  -0.894
  246   1HH1  ARG  38          1HH1      ARG  38  10.369  11.935   2.581
  247   2HH1  ARG  38          2HH1      ARG  38  11.570  10.730   2.546
  248   1HH2  ARG  38          1HH2      ARG  38  12.274  10.980  -0.892
  249   2HH2  ARG  38          2HH2      ARG  38  12.634  10.162   0.555
  250    H    LYS  39           H        LYS  39   7.598  16.483  -2.964
  251    HA   LYS  39           HA       LYS  39  10.005  17.975  -2.511
  252   1HB   LYS  39          1HB       LYS  39   8.323  17.777  -5.027
  253   2HB   LYS  39          2HB       LYS  39   9.983  18.340  -4.930
  254   1HG   LYS  39          1HG       LYS  39   9.007  15.542  -4.402
  255   2HG   LYS  39          2HG       LYS  39   9.890  16.091  -5.825
  256   1HD   LYS  39          1HD       LYS  39  11.818  16.614  -4.428
  257   2HD   LYS  39          2HD       LYS  39  10.917  16.127  -2.993
  258   1HE   LYS  39          1HE       LYS  39  12.385  14.332  -3.661
  259   2HE   LYS  39          2HE       LYS  39  10.692  13.882  -3.921
  260   1HZ   LYS  39          1HZ       LYS  39  11.010  14.380  -6.297
  261   2HZ   LYS  39          2HZ       LYS  39  12.071  13.203  -5.764
  262   3HZ   LYS  39          3HZ       LYS  39  12.627  14.758  -6.008
  263    HA   PRO  40           HA       PRO  40   7.936  21.791  -1.669
  264   1HB   PRO  40          1HB       PRO  40   9.895  23.535  -2.485
  265   2HB   PRO  40          2HB       PRO  40   9.830  22.757  -0.905
  266   1HG   PRO  40          1HG       PRO  40  11.475  22.062  -3.287
  267   2HG   PRO  40          2HG       PRO  40  11.873  21.915  -1.569
  268   1HD   PRO  40          1HD       PRO  40  11.169  19.806  -3.148
  269   2HD   PRO  40          2HD       PRO  40  10.872  19.857  -1.401
  270    H    ASP  41           H        ASP  41   8.977  20.932  -4.914
  271    HA   ASP  41           HA       ASP  41   7.733  23.228  -6.044
  272   1HB   ASP  41          1HB       ASP  41   8.513  22.237  -8.108
  273   2HB   ASP  41          2HB       ASP  41   9.848  22.526  -6.990
  274    H    CYS  42           H        CYS  42   6.704  20.503  -4.773
  275    HA   CYS  42           HA       CYS  42   4.949  19.458  -6.756
  276   1HB   CYS  42          1HB       CYS  42   5.548  18.132  -4.746
  277   2HB   CYS  42          2HB       CYS  42   4.655  19.266  -3.753
  278    HG   CYS  42           HG       CYS  42   2.905  17.299  -3.771
  279    H    LYS  43           H        LYS  43   3.076  20.134  -7.446
  280    HA   LYS  43           HA       LYS  43   1.975  22.599  -6.342
  281   1HB   LYS  43          1HB       LYS  43   1.477  21.145  -8.908
  282   2HB   LYS  43          2HB       LYS  43   0.586  22.577  -8.421
  283   1HG   LYS  43          1HG       LYS  43   2.715  23.836  -8.362
  284   2HG   LYS  43          2HG       LYS  43   3.547  22.395  -8.956
  285   1HD   LYS  43          1HD       LYS  43   2.311  22.423 -10.989
  286   2HD   LYS  43          2HD       LYS  43   1.235  23.682 -10.397
  287   1HE   LYS  43          1HE       LYS  43   2.796  24.676 -11.901
  288   2HE   LYS  43          2HE       LYS  43   3.184  25.205 -10.272
  289   1HZ   LYS  43          1HZ       LYS  43   4.978  23.533 -10.226
  290   2HZ   LYS  43          2HZ       LYS  43   5.161  24.648 -11.467
  291   3HZ   LYS  43          3HZ       LYS  43   4.598  23.105 -11.817
  292    H    VAL  44           H        VAL  44   1.195  19.234  -6.656
  293    HA   VAL  44           HA       VAL  44  -1.417  19.813  -5.460
  294    HB   VAL  44           HB       VAL  44  -0.904  17.550  -7.400
  295   1HG1  VAL  44          1HG1      VAL  44  -3.348  17.250  -7.337
  296   2HG1  VAL  44          2HG1      VAL  44  -3.452  18.497  -6.094
  297   3HG1  VAL  44          3HG1      VAL  44  -2.590  16.991  -5.770
  298   1HG2  VAL  44          1HG2      VAL  44  -0.904  19.685  -8.599
  299   2HG2  VAL  44          2HG2      VAL  44  -2.449  20.107  -7.859
  300   3HG2  VAL  44          3HG2      VAL  44  -2.352  18.753  -8.981
  301    H    GLY  45           H        GLY  45  -1.512  19.075  -3.544
  302   1HA   GLY  45          1HA       GLY  45  -1.397  17.673  -1.726
  303   2HA   GLY  45          2HA       GLY  45  -0.987  16.358  -2.818
  304    H    ARG  46           H        ARG  46   0.860  19.465  -2.113
  305    HA   ARG  46           HA       ARG  46   3.222  17.993  -1.951
  306   1HB   ARG  46          1HB       ARG  46   3.203  20.327  -2.673
  307   2HB   ARG  46          2HB       ARG  46   2.579  20.803  -1.097
  308   1HG   ARG  46          1HG       ARG  46   4.589  20.081  -0.005
  309   2HG   ARG  46          2HG       ARG  46   5.234  19.464  -1.521
  310   1HD   ARG  46          1HD       ARG  46   6.185  21.628  -0.884
  311   2HD   ARG  46          2HD       ARG  46   5.319  21.681  -2.430
  312    HE   ARG  46           HE       ARG  46   3.890  23.152  -1.550
  313   1HH1  ARG  46          1HH1      ARG  46   5.685  21.735   1.194
  314   2HH1  ARG  46          2HH1      ARG  46   5.074  22.849   2.315
  315   1HH2  ARG  46          1HH2      ARG  46   3.098  24.676   0.026
  316   2HH2  ARG  46          2HH2      ARG  46   3.577  24.543   1.657
  317    H    ILE  47           H        ILE  47   3.965  16.908  -0.368
  318    HA   ILE  47           HA       ILE  47   2.746  16.979   2.219
  319    HB   ILE  47           HB       ILE  47   5.230  15.370   1.444
  320   1HG1  ILE  47          1HG1      ILE  47   2.296  14.577   1.507
  321   2HG1  ILE  47          2HG1      ILE  47   3.222  14.907   0.049
  322   1HG2  ILE  47          1HG2      ILE  47   3.436  15.232   3.818
  323   2HG2  ILE  47          2HG2      ILE  47   5.145  15.639   3.759
  324   3HG2  ILE  47          3HG2      ILE  47   4.605  14.019   3.328
  325   1HD1  ILE  47          1HD1      ILE  47   2.955  12.524   0.502
  326   2HD1  ILE  47          2HD1      ILE  47   3.852  12.724   2.012
  327   3HD1  ILE  47          3HD1      ILE  47   4.637  13.038   0.459
  328    H    THR  48           H        THR  48   3.142  18.205   3.736
  329    HA   THR  48           HA       THR  48   4.928  20.271   3.856
  330    HB   THR  48           HB       THR  48   4.103  20.058   6.326
  331    HG1  THR  48           1HG      THR  48   2.971  18.239   6.544
  332   1HG2  THR  48          1HG2      THR  48   2.023  21.018   5.624
  333   2HG2  THR  48          2HG2      THR  48   2.302  20.328   4.009
  334   3HG2  THR  48          3HG2      THR  48   3.355  21.637   4.605
  335    H    THR  49           H        THR  49   4.837  17.331   5.799
  336    HA   THR  49           HA       THR  49   7.672  17.803   6.566
  337    HB   THR  49           HB       THR  49   5.635  16.823   8.548
  338    HG1  THR  49           1HG      THR  49   4.752  18.643   8.195
  339   1HG2  THR  49          1HG2      THR  49   8.021  16.640   9.119
  340   2HG2  THR  49          2HG2      THR  49   7.189  17.767  10.182
  341   3HG2  THR  49          3HG2      THR  49   8.213  18.379   8.881
  342    H    THR  50           H        THR  50   8.741  15.914   7.345
  343    HA   THR  50           HA       THR  50   8.322  13.493   6.100
  344    HB   THR  50           HB       THR  50  10.330  14.248   6.945
  345    HG1  THR  50           1HG      THR  50  10.443  12.068   8.580
  346   1HG2  THR  50          1HG2      THR  50   9.282  13.797   9.701
  347   2HG2  THR  50          2HG2      THR  50   9.651  15.337   8.948
  348   3HG2  THR  50          3HG2      THR  50  10.969  14.206   9.337
  349    H    GLU  51           H        GLU  51   7.333  14.536   9.368
  350    HA   GLU  51           HA       GLU  51   6.123  12.162  10.244
  351   1HB   GLU  51          1HB       GLU  51   5.662  15.073  10.767
  352   2HB   GLU  51          2HB       GLU  51   4.595  13.861  11.450
  353   1HG   GLU  51          1HG       GLU  51   6.319  14.625  12.983
  354   2HG   GLU  51          2HG       GLU  51   6.372  12.883  12.631
  355    H    ASP  52           H        ASP  52   4.846  14.701   8.037
  356    HA   ASP  52           HA       ASP  52   2.229  13.633   8.027
  357   1HB   ASP  52          1HB       ASP  52   3.799  15.467   6.257
  358   2HB   ASP  52          2HB       ASP  52   2.101  15.117   6.034
  359    H    PHE  53           H        PHE  53   5.107  13.462   6.074
  360    HA   PHE  53           HA       PHE  53   4.106  12.039   3.940
  361   1HB   PHE  53          1HB       PHE  53   6.308  13.150   3.895
  362   2HB   PHE  53          2HB       PHE  53   6.859  12.120   5.199
  363    HD1  PHE  53           1HD      PHE  53   6.120  12.319   1.647
  364    HD2  PHE  53           2HD      PHE  53   7.567   9.877   4.788
  365    HE1  PHE  53           1HE      PHE  53   6.996  10.738  -0.008
  366    HE2  PHE  53           2HE      PHE  53   8.440   8.276   3.159
  367    HZ   PHE  53           HZ       PHE  53   8.155   8.732   0.714
  368    H    LYS  54           H        LYS  54   5.620  10.949   6.897
  369    HA   LYS  54           HA       LYS  54   5.461   8.111   6.479
  370   1HB   LYS  54          1HB       LYS  54   5.708   9.734   9.003
  371   2HB   LYS  54          2HB       LYS  54   5.852   7.980   8.889
  372   1HG   LYS  54          1HG       LYS  54   7.783   8.145   7.509
  373   2HG   LYS  54          2HG       LYS  54   7.586   9.885   7.348
  374   1HD   LYS  54          1HD       LYS  54   9.369   9.490   8.853
  375   2HD   LYS  54          2HD       LYS  54   8.009  10.076   9.797
  376   1HE   LYS  54          1HE       LYS  54   8.717   7.144   9.529
  377   2HE   LYS  54          2HE       LYS  54   9.354   8.159  10.806
  378   1HZ   LYS  54          1HZ       LYS  54   6.483   7.467  10.388
  379   2HZ   LYS  54          2HZ       LYS  54   7.083   8.528  11.576
  380   3HZ   LYS  54          3HZ       LYS  54   7.517   6.923  11.600
  381    H    HIS  55           H        HIS  55   3.270  10.470   8.001
  382    HA   HIS  55           HA       HIS  55   1.405   8.590   9.102
  383   1HB   HIS  55          1HB       HIS  55   1.558  10.998   9.795
  384   2HB   HIS  55          2HB       HIS  55   1.112  11.469   8.178
  385    HD1  HIS  55           1HD      HIS  55  -0.366  10.174  11.352
  386    HD2  HIS  55           2HD      HIS  55  -1.627  11.277   7.554
  387    HE1  HIS  55           1HE      HIS  55  -2.870  10.325  11.495
  388    H    LEU  56           H        LEU  56   1.560  10.386   6.110
  389    HA   LEU  56           HA       LEU  56  -0.812   9.199   5.126
  390   1HB   LEU  56          1HB       LEU  56   0.911  11.234   4.288
  391   2HB   LEU  56          2HB       LEU  56   0.917  10.015   3.036
  392    HG   LEU  56           HG       LEU  56  -1.133  11.848   4.000
  393   1HD1  LEU  56          1HD1      LEU  56   0.144  12.330   2.065
  394   2HD1  LEU  56          2HD1      LEU  56  -1.560  12.223   1.720
  395   3HD1  LEU  56          3HD1      LEU  56  -0.483  10.894   1.253
  396   1HD2  LEU  56          1HD2      LEU  56  -1.901   9.187   2.786
  397   2HD2  LEU  56          2HD2      LEU  56  -2.962  10.592   2.984
  398   3HD2  LEU  56          3HD2      LEU  56  -2.376   9.791   4.381
  399    H    ALA  57           H        ALA  57   2.649   8.405   4.521
  400    HA   ALA  57           HA       ALA  57   2.076   6.464   2.633
  401   1HB   ALA  57          1HB       ALA  57   4.369   7.320   3.077
  402   2HB   ALA  57          2HB       ALA  57   4.306   5.556   3.092
  403   3HB   ALA  57          3HB       ALA  57   4.366   6.450   4.610
  404    H    ARG  58           H        ARG  58   2.131   6.273   6.083
  405    HA   ARG  58           HA       ARG  58   1.746   3.440   6.116
  406   1HB   ARG  58          1HB       ARG  58   1.354   3.546   8.494
  407   2HB   ARG  58          2HB       ARG  58   2.666   4.638   8.092
  408   1HG   ARG  58          1HG       ARG  58   1.144   6.526   8.264
  409   2HG   ARG  58          2HG       ARG  58  -0.173   5.424   8.666
  410   1HD   ARG  58          1HD       ARG  58   2.356   5.822  10.229
  411   2HD   ARG  58          2HD       ARG  58   0.765   6.465  10.656
  412    HE   ARG  58           HE       ARG  58   0.969   3.585  10.355
  413   1HH1  ARG  58          1HH1      ARG  58   0.899   6.302  12.627
  414   2HH1  ARG  58          2HH1      ARG  58   0.603   5.320  13.993
  415   1HH2  ARG  58          1HH2      ARG  58   0.587   2.265  12.189
  416   2HH2  ARG  58          2HH2      ARG  58   0.452   2.953  13.739
  417    H    LYS  59           H        LYS  59  -0.513   6.168   6.402
  418    HA   LYS  59           HA       LYS  59  -2.862   4.731   6.833
  419   1HB   LYS  59          1HB       LYS  59  -2.863   7.149   7.006
  420   2HB   LYS  59          2HB       LYS  59  -2.445   7.310   5.304
  421   1HG   LYS  59          1HG       LYS  59  -4.617   6.116   4.788
  422   2HG   LYS  59          2HG       LYS  59  -5.034   6.339   6.482
  423   1HD   LYS  59          1HD       LYS  59  -4.999   8.720   6.237
  424   2HD   LYS  59          2HD       LYS  59  -4.319   8.592   4.608
  425   1HE   LYS  59          1HE       LYS  59  -6.357   7.365   3.910
  426   2HE   LYS  59          2HE       LYS  59  -7.039   7.654   5.506
  427   1HZ   LYS  59          1HZ       LYS  59  -7.063   9.990   5.090
  428   2HZ   LYS  59          2HZ       LYS  59  -7.752   9.272   3.738
  429   3HZ   LYS  59          3HZ       LYS  59  -6.184   9.852   3.698
  430    H    LEU  60           H        LEU  60  -1.336   5.724   3.791
  431    HA   LEU  60           HA       LEU  60  -3.375   4.839   2.253
  432   1HB   LEU  60          1HB       LEU  60  -0.526   5.332   1.539
  433   2HB   LEU  60          2HB       LEU  60  -1.797   5.189   0.312
  434    HG   LEU  60           HG       LEU  60  -1.985   7.076   2.574
  435   1HD1  LEU  60          1HD1      LEU  60  -0.000   7.795   1.501
  436   2HD1  LEU  60          2HD1      LEU  60  -1.257   8.875   0.869
  437   3HD1  LEU  60          3HD1      LEU  60  -0.654   7.545  -0.102
  438   1HD2  LEU  60          1HD2      LEU  60  -3.327   6.983  -0.119
  439   2HD2  LEU  60          2HD2      LEU  60  -3.570   8.255   1.078
  440   3HD2  LEU  60          3HD2      LEU  60  -4.023   6.582   1.451
  441    H    THR  61           H        THR  61  -0.305   3.393   3.189
  442    HA   THR  61           HA       THR  61  -0.325   0.987   1.727
  443    HB   THR  61           HB       THR  61   0.602   1.353   4.604
  444    HG1  THR  61           1HG      THR  61   1.736   2.741   3.210
  445   1HG2  THR  61          1HG2      THR  61   2.029  -0.602   4.190
  446   2HG2  THR  61          2HG2      THR  61   1.353  -0.755   2.569
  447   3HG2  THR  61          3HG2      THR  61   0.326  -1.010   3.982
  448    H    HIS  62           H        HIS  62  -1.770   1.925   4.688
  449    HA   HIS  62           HA       HIS  62  -2.823  -0.664   5.278
  450   1HB   HIS  62          1HB       HIS  62  -2.248   0.954   7.042
  451   2HB   HIS  62          2HB       HIS  62  -3.469   2.046   6.412
  452    HD1  HIS  62           1HD      HIS  62  -3.001  -0.875   8.663
  453    HD2  HIS  62           2HD      HIS  62  -6.123   1.386   7.131
  454    HE1  HIS  62           1HE      HIS  62  -4.970  -1.420  10.101
  455    H    GLY  63           H        GLY  63  -4.212   2.167   3.705
  456   1HA   GLY  63          1HA       GLY  63  -6.840   1.100   3.786
  457   2HA   GLY  63          2HA       GLY  63  -6.383   2.470   2.827
  458    H    VAL  64           H        VAL  64  -4.298   0.988   1.299
  459    HA   VAL  64           HA       VAL  64  -6.036  -0.185  -0.729
  460    HB   VAL  64           HB       VAL  64  -3.009  -0.397  -0.442
  461   1HG1  VAL  64          1HG1      VAL  64  -3.900  -2.199  -1.908
  462   2HG1  VAL  64          2HG1      VAL  64  -3.000  -1.056  -2.871
  463   3HG1  VAL  64          3HG1      VAL  64  -4.751  -1.008  -2.877
  464   1HG2  VAL  64          1HG2      VAL  64  -3.693   1.922  -0.726
  465   2HG2  VAL  64          2HG2      VAL  64  -4.651   1.481  -2.141
  466   3HG2  VAL  64          3HG2      VAL  64  -2.896   1.336  -2.189
  467    H    MET  65           H        MET  65  -4.061  -1.209   1.704
  468    HA   MET  65           HA       MET  65  -3.988  -4.033   1.291
  469   1HB   MET  65          1HB       MET  65  -2.399  -3.015   2.826
  470   2HB   MET  65          2HB       MET  65  -3.697  -2.405   3.807
  471   1HG   MET  65          1HG       MET  65  -4.289  -4.520   4.569
  472   2HG   MET  65          2HG       MET  65  -3.139  -5.324   3.512
  473   1HE   MET  65          1HE       MET  65  -1.787  -5.609   7.193
  474   2HE   MET  65          2HE       MET  65  -2.479  -6.474   5.792
  475   3HE   MET  65          3HE       MET  65  -3.472  -5.331   6.723
  476    H    ASN  66           H        ASN  66  -5.971  -2.075   3.399
  477    HA   ASN  66           HA       ASN  66  -7.592  -4.231   4.254
  478   1HB   ASN  66          1HB       ASN  66  -7.455  -1.352   4.629
  479   2HB   ASN  66          2HB       ASN  66  -9.048  -1.998   4.915
  480   1HD2  ASN  66          1HD2      ASN  66  -5.790  -1.801   5.839
  481   2HD2  ASN  66          2HD2      ASN  66  -5.903  -2.626   7.361
  482    H    LYS  67           H        LYS  67  -7.924  -1.869   1.732
  483    HA   LYS  67           HA       LYS  67 -10.599  -2.481   1.151
  484   1HB   LYS  67          1HB       LYS  67  -9.410  -0.430   0.374
  485   2HB   LYS  67          2HB       LYS  67  -8.498  -1.424  -0.752
  486   1HG   LYS  67          1HG       LYS  67 -10.539  -2.028  -1.910
  487   2HG   LYS  67          2HG       LYS  67 -11.488  -1.114  -0.746
  488   1HD   LYS  67          1HD       LYS  67  -9.440   0.035  -2.648
  489   2HD   LYS  67          2HD       LYS  67 -11.189   0.121  -2.843
  490   1HE   LYS  67          1HE       LYS  67 -11.287   1.359  -0.663
  491   2HE   LYS  67          2HE       LYS  67  -9.525   1.396  -0.676
  492   1HZ   LYS  67          1HZ       LYS  67 -11.361   2.647  -2.623
  493   2HZ   LYS  67          2HZ       LYS  67  -9.726   2.548  -2.896
  494   3HZ   LYS  67          3HZ       LYS  67 -10.305   3.444  -1.585
  495    H    GLU  68           H        GLU  68  -7.509  -3.821  -0.160
  496    HA   GLU  68           HA       GLU  68  -9.054  -5.495  -1.796
  497   1HB   GLU  68          1HB       GLU  68  -6.959  -6.541  -2.424
  498   2HB   GLU  68          2HB       GLU  68  -7.015  -4.776  -2.584
  499   1HG   GLU  68          1HG       GLU  68  -5.640  -4.528  -0.638
  500   2HG   GLU  68          2HG       GLU  68  -5.497  -6.268  -0.425
  501    H    LEU  69           H        LEU  69  -7.440  -5.941   1.319
  502    HA   LEU  69           HA       LEU  69  -8.078  -8.599   1.558
  503   1HB   LEU  69          1HB       LEU  69  -7.938  -6.425   3.611
  504   2HB   LEU  69          2HB       LEU  69  -8.271  -8.090   4.044
  505    HG   LEU  69           HG       LEU  69  -5.783  -7.158   2.616
  506   1HD1  LEU  69          1HD1      LEU  69  -6.212  -7.933   5.490
  507   2HD1  LEU  69          2HD1      LEU  69  -5.889  -6.304   4.892
  508   3HD1  LEU  69          3HD1      LEU  69  -4.661  -7.559   4.738
  509   1HD2  LEU  69          1HD2      LEU  69  -6.326  -9.459   2.086
  510   2HD2  LEU  69          2HD2      LEU  69  -6.584  -9.813   3.793
  511   3HD2  LEU  69          3HD2      LEU  69  -4.975  -9.415   3.217
  512    H    LYS  70           H        LYS  70 -10.312  -5.861   1.713
  513    HA   LYS  70           HA       LYS  70 -12.514  -7.382   2.739
  514   1HB   LYS  70          1HB       LYS  70 -12.439  -5.002   0.914
  515   2HB   LYS  70          2HB       LYS  70 -13.883  -5.654   1.670
  516   1HG   LYS  70          1HG       LYS  70 -12.929  -5.134   3.830
  517   2HG   LYS  70          2HG       LYS  70 -11.525  -4.443   2.992
  518   1HD   LYS  70          1HD       LYS  70 -12.953  -2.869   1.826
  519   2HD   LYS  70          2HD       LYS  70 -14.378  -3.535   2.611
  520   1HE   LYS  70          1HE       LYS  70 -13.477  -2.883   4.784
  521   2HE   LYS  70          2HE       LYS  70 -12.074  -2.169   3.982
  522   1HZ   LYS  70          1HZ       LYS  70 -14.890  -1.293   3.599
  523   2HZ   LYS  70          2HZ       LYS  70 -13.522  -0.605   2.886
  524   3HZ   LYS  70          3HZ       LYS  70 -13.739  -0.512   4.548
  525    H    TYR  71           H        TYR  71 -11.449  -6.415  -0.437
  526    HA   TYR  71           HA       TYR  71 -13.621  -7.762  -1.773
  527   1HB   TYR  71          1HB       TYR  71 -11.089  -6.636  -2.963
  528   2HB   TYR  71          2HB       TYR  71 -12.567  -7.050  -3.823
  529    HD1  TYR  71           1HD      TYR  71 -13.973  -5.742  -1.028
  530    HD2  TYR  71           2HD      TYR  71 -11.525  -4.439  -4.264
  531    HE1  TYR  71           1HE      TYR  71 -14.748  -3.493  -0.667
  532    HE2  TYR  71           2HE      TYR  71 -12.314  -2.144  -3.909
  533    HH   TYR  71           HH       TYR  71 -14.151  -0.967  -2.922
  534    H    CYS  72           H        CYS  72 -10.437  -8.649  -0.937
  535    HA   CYS  72           HA       CYS  72 -10.541 -11.009  -2.617
  536   1HB   CYS  72          1HB       CYS  72  -8.408  -9.922  -0.784
  537   2HB   CYS  72          2HB       CYS  72  -8.206 -11.401  -1.730
  538    HG   CYS  72           HG       CYS  72  -7.365 -10.195  -3.867
  539    H    LYS  73           H        LYS  73 -10.580 -10.179   0.823
  540    HA   LYS  73           HA       LYS  73 -11.204 -11.197   2.657
  541   1HB   LYS  73          1HB       LYS  73 -12.510 -13.188   0.824
  542   2HB   LYS  73          2HB       LYS  73 -12.609 -13.317   2.572
  543   1HG   LYS  73          1HG       LYS  73 -13.638 -11.053   0.864
  544   2HG   LYS  73          2HG       LYS  73 -14.602 -12.263   1.714
  545   1HD   LYS  73          1HD       LYS  73 -12.874 -10.096   2.949
  546   2HD   LYS  73          2HD       LYS  73 -14.624 -10.187   2.949
  547   1HE   LYS  73          1HE       LYS  73 -14.507 -12.240   4.332
  548   2HE   LYS  73          2HE       LYS  73 -12.753 -12.106   4.341
  549   1HZ   LYS  73          1HZ       LYS  73 -12.979  -9.954   5.467
  550   2HZ   LYS  73          2HZ       LYS  73 -13.664 -11.192   6.346
  551   3HZ   LYS  73          3HZ       LYS  73 -14.655 -10.151   5.490
  552    H    ASN  74           H        ASN  74  -9.566 -13.273   0.461
  553    HA   ASN  74           HA       ASN  74  -8.158 -14.294   2.785
  554   1HB   ASN  74          1HB       ASN  74  -8.665 -15.633   0.136
  555   2HB   ASN  74          2HB       ASN  74  -7.410 -16.189   1.241
  556   1HD2  ASN  74          1HD2      ASN  74 -10.764 -16.168   0.508
  557   2HD2  ASN  74          2HD2      ASN  74 -11.262 -17.155   1.828
  558    HA   PRO  75           HA       PRO  75  -4.913 -11.758   1.196
  559   1HB   PRO  75          1HB       PRO  75  -3.066 -12.798   2.695
  560   2HB   PRO  75          2HB       PRO  75  -4.096 -11.407   3.108
  561   1HG   PRO  75          1HG       PRO  75  -4.150 -14.234   4.121
  562   2HG   PRO  75          2HG       PRO  75  -4.810 -12.792   4.914
  563   1HD   PRO  75          1HD       PRO  75  -6.242 -14.754   3.615
  564   2HD   PRO  75          2HD       PRO  75  -6.828 -13.112   3.961
  565    H    GLU  76           H        GLU  76  -5.189 -14.842   0.595
  566    HA   GLU  76           HA       GLU  76  -2.575 -15.553  -0.212
  567   1HB   GLU  76          1HB       GLU  76  -4.442 -17.165   0.319
  568   2HB   GLU  76          2HB       GLU  76  -5.215 -16.677  -1.178
  569   1HG   GLU  76          1HG       GLU  76  -4.100 -18.780  -1.484
  570   2HG   GLU  76          2HG       GLU  76  -3.289 -17.532  -2.427
  571    H    ASP  77           H        ASP  77  -4.650 -13.338  -1.163
  572    HA   ASP  77           HA       ASP  77  -3.807 -13.179  -4.018
  573   1HB   ASP  77          1HB       ASP  77  -6.283 -13.728  -3.523
  574   2HB   ASP  77          2HB       ASP  77  -6.366 -12.104  -2.854
  575    H    LEU  78           H        LEU  78  -3.163 -12.052  -1.061
  576    HA   LEU  78           HA       LEU  78  -3.229  -9.237  -1.616
  577   1HB   LEU  78          1HB       LEU  78  -4.013 -10.173   0.519
  578   2HB   LEU  78          2HB       LEU  78  -2.414 -10.884   0.730
  579    HG   LEU  78           HG       LEU  78  -1.564  -8.611   0.521
  580   1HD1  LEU  78          1HD1      LEU  78  -3.114  -6.790   1.313
  581   2HD1  LEU  78          2HD1      LEU  78  -4.440  -7.944   1.161
  582   3HD1  LEU  78          3HD1      LEU  78  -3.531  -7.452  -0.265
  583   1HD2  LEU  78          1HD2      LEU  78  -1.396  -9.758   2.573
  584   2HD2  LEU  78          2HD2      LEU  78  -3.088  -9.484   2.945
  585   3HD2  LEU  78          3HD2      LEU  78  -1.953  -8.130   2.960
  586    H    GLU  79           H        GLU  79  -1.574  -8.887  -2.933
  587    HA   GLU  79           HA       GLU  79   1.193  -9.457  -2.143
  588   1HB   GLU  79          1HB       GLU  79   0.341 -11.218  -3.738
  589   2HB   GLU  79          2HB       GLU  79  -0.165  -9.860  -4.745
  590   1HG   GLU  79          1HG       GLU  79   1.716 -10.777  -5.607
  591   2HG   GLU  79          2HG       GLU  79   2.077  -9.164  -5.025
  592    H    CYS  80           H        CYS  80   2.472  -7.783  -2.804
  593    HA   CYS  80           HA       CYS  80   1.045  -5.461  -3.800
  594   1HB   CYS  80          1HB       CYS  80   2.638  -4.930  -2.033
  595   2HB   CYS  80          2HB       CYS  80   3.968  -5.713  -2.826
  596    HG   CYS  80           HG       CYS  80   4.642  -3.160  -3.173
  597    H    ASN  81           H        ASN  81   0.524  -6.604  -5.617
  598    HA   ASN  81           HA       ASN  81   2.732  -7.174  -7.276
  599   1HB   ASN  81          1HB       ASN  81   1.203  -8.446  -8.787
  600   2HB   ASN  81          2HB       ASN  81   0.969  -8.930  -7.108
  601   1HD2  ASN  81          1HD2      ASN  81  -0.969  -8.491  -6.220
  602   2HD2  ASN  81          2HD2      ASN  81  -2.323  -7.887  -7.081
  603    H    GLU  82           H        GLU  82   1.655  -6.870  -9.792
  604    HA   GLU  82           HA       GLU  82   2.047  -4.306 -10.478
  605   1HB   GLU  82          1HB       GLU  82   0.608  -6.566 -11.554
  606   2HB   GLU  82          2HB       GLU  82   0.972  -5.176 -12.620
  607   1HG   GLU  82          1HG       GLU  82   2.885  -6.946 -11.118
  608   2HG   GLU  82          2HG       GLU  82   2.653  -6.989 -12.880
  609    H    ASN  83           H        ASN  83  -0.978  -6.116 -10.343
  610    HA   ASN  83           HA       ASN  83  -2.936  -4.237 -10.949
  611   1HB   ASN  83          1HB       ASN  83  -2.923  -6.644  -9.114
  612   2HB   ASN  83          2HB       ASN  83  -4.387  -5.722  -9.440
  613   1HD2  ASN  83          1HD2      ASN  83  -5.337  -5.872 -11.442
  614   2HD2  ASN  83          2HD2      ASN  83  -4.917  -7.081 -12.599
  615    H    VAL  84           H        VAL  84  -1.612  -5.312  -7.811
  616    HA   VAL  84           HA       VAL  84  -3.135  -3.525  -6.409
  617    HB   VAL  84           HB       VAL  84  -0.578  -4.908  -5.652
  618   1HG1  VAL  84          1HG1      VAL  84  -0.624  -2.992  -4.215
  619   2HG1  VAL  84          2HG1      VAL  84  -1.285  -4.368  -3.295
  620   3HG1  VAL  84          3HG1      VAL  84  -2.365  -3.156  -3.966
  621   1HG2  VAL  84          1HG2      VAL  84  -2.523  -6.257  -6.029
  622   2HG2  VAL  84          2HG2      VAL  84  -3.422  -5.275  -4.850
  623   3HG2  VAL  84          3HG2      VAL  84  -2.046  -6.246  -4.330
  624    H    LYS  85           H        LYS  85   0.158  -3.254  -7.613
  625    HA   LYS  85           HA       LYS  85   0.859  -0.722  -6.625
  626   1HB   LYS  85          1HB       LYS  85   1.556  -1.973  -9.275
  627   2HB   LYS  85          2HB       LYS  85   2.329  -0.537  -8.614
  628   1HG   LYS  85          1HG       LYS  85   3.237  -1.759  -6.819
  629   2HG   LYS  85          2HG       LYS  85   2.280  -3.183  -7.234
  630   1HD   LYS  85          1HD       LYS  85   3.488  -3.139  -9.472
  631   2HD   LYS  85          2HD       LYS  85   4.600  -1.994  -8.714
  632   1HE   LYS  85          1HE       LYS  85   5.122  -3.539  -6.998
  633   2HE   LYS  85          2HE       LYS  85   3.858  -4.624  -7.581
  634   1HZ   LYS  85          1HZ       LYS  85   6.378  -3.939  -9.008
  635   2HZ   LYS  85          2HZ       LYS  85   5.139  -4.878  -9.662
  636   3HZ   LYS  85          3HZ       LYS  85   5.998  -5.427  -8.321
  637    H    HIS  86           H        HIS  86  -0.729  -1.626  -9.535
  638    HA   HIS  86           HA       HIS  86  -1.032   0.844 -10.727
  639   1HB   HIS  86          1HB       HIS  86  -1.613  -1.180 -11.964
  640   2HB   HIS  86          2HB       HIS  86  -2.994  -1.466 -10.913
  641    HD1  HIS  86           1HD      HIS  86  -1.873   0.624 -13.814
  642    HD2  HIS  86           2HD      HIS  86  -5.288   0.087 -11.503
  643    HE1  HIS  86           1HE      HIS  86  -3.687   1.846 -15.021
  644    H    LYS  87           H        LYS  87  -3.254  -0.886  -8.643
  645    HA   LYS  87           HA       LYS  87  -5.317   1.097  -8.285
  646   1HB   LYS  87          1HB       LYS  87  -4.325  -1.133  -6.539
  647   2HB   LYS  87          2HB       LYS  87  -5.707  -0.132  -6.146
  648   1HG   LYS  87          1HG       LYS  87  -7.056  -1.199  -7.612
  649   2HG   LYS  87          2HG       LYS  87  -5.739  -1.537  -8.744
  650   1HD   LYS  87          1HD       LYS  87  -6.600  -3.557  -7.628
  651   2HD   LYS  87          2HD       LYS  87  -4.881  -3.189  -7.382
  652   1HE   LYS  87          1HE       LYS  87  -5.412  -2.270  -5.134
  653   2HE   LYS  87          2HE       LYS  87  -7.105  -2.688  -5.375
  654   1HZ   LYS  87          1HZ       LYS  87  -6.610  -4.982  -5.208
  655   2HZ   LYS  87          2HZ       LYS  87  -5.507  -4.322  -4.062
  656   3HZ   LYS  87          3HZ       LYS  87  -5.016  -4.736  -5.562
  657    H    THR  88           H        THR  88  -2.375   0.611  -6.764
  658    HA   THR  88           HA       THR  88  -3.003   2.265  -4.575
  659    HB   THR  88           HB       THR  88  -0.574   0.984  -5.640
  660    HG1  THR  88           1HG      THR  88  -1.810  -0.458  -4.685
  661   1HG2  THR  88          1HG2      THR  88   0.074   3.016  -4.656
  662   2HG2  THR  88          2HG2      THR  88   0.559   1.682  -3.579
  663   3HG2  THR  88          3HG2      THR  88  -0.853   2.704  -3.180
  664    H    LYS  89           H        LYS  89  -0.663   2.626  -7.192
  665    HA   LYS  89           HA       LYS  89  -0.138   5.151  -6.354
  666   1HB   LYS  89          1HB       LYS  89   0.908   5.445  -8.785
  667   2HB   LYS  89          2HB       LYS  89   1.627   4.415  -7.561
  668   1HG   LYS  89          1HG       LYS  89   1.626   3.227  -9.622
  669   2HG   LYS  89          2HG       LYS  89   0.411   2.513  -8.550
  670   1HD   LYS  89          1HD       LYS  89  -0.820   2.583 -10.323
  671   2HD   LYS  89          2HD       LYS  89  -1.054   4.195  -9.741
  672   1HE   LYS  89          1HE       LYS  89   1.156   3.709 -11.725
  673   2HE   LYS  89          2HE       LYS  89  -0.486   3.968 -12.292
  674   1HZ   LYS  89          1HZ       LYS  89  -0.501   6.113 -11.310
  675   2HZ   LYS  89          2HZ       LYS  89   0.876   5.980 -12.270
  676   3HZ   LYS  89          3HZ       LYS  89   1.028   5.926 -10.606
  677    H    GLU  90           H        GLU  90  -2.467   3.986  -8.677
  678    HA   GLU  90           HA       GLU  90  -3.268   6.569  -9.604
  679   1HB   GLU  90          1HB       GLU  90  -4.716   3.954  -9.637
  680   2HB   GLU  90          2HB       GLU  90  -5.356   5.408 -10.397
  681   1HG   GLU  90          1HG       GLU  90  -2.784   4.002 -11.111
  682   2HG   GLU  90          2HG       GLU  90  -4.265   4.020 -12.064
  683    H    TYR  91           H        TYR  91  -4.141   4.644  -6.830
  684    HA   TYR  91           HA       TYR  91  -6.471   6.127  -6.173
  685   1HB   TYR  91          1HB       TYR  91  -6.489   4.032  -5.130
  686   2HB   TYR  91          2HB       TYR  91  -4.772   4.092  -4.775
  687    HD1  TYR  91           1HD      TYR  91  -7.889   5.972  -3.839
  688    HD2  TYR  91           2HD      TYR  91  -4.193   4.283  -2.585
  689    HE1  TYR  91           1HE      TYR  91  -8.384   6.603  -1.514
  690    HE2  TYR  91           2HE      TYR  91  -4.647   4.911  -0.306
  691    HH   TYR  91           HH       TYR  91  -6.013   6.526   0.905
  692    H    ILE  92           H        ILE  92  -3.126   5.948  -5.080
  693    HA   ILE  92           HA       ILE  92  -2.964   8.028  -3.277
  694    HB   ILE  92           HB       ILE  92  -0.966   7.240  -5.394
  695   1HG1  ILE  92          1HG1      ILE  92  -1.859   5.655  -3.517
  696   2HG1  ILE  92          2HG1      ILE  92  -0.131   5.593  -3.948
  697   1HG2  ILE  92          1HG2      ILE  92   0.759   8.343  -4.017
  698   2HG2  ILE  92          2HG2      ILE  92  -0.525   8.885  -2.918
  699   3HG2  ILE  92          3HG2      ILE  92  -0.504   9.460  -4.576
  700   1HD1  ILE  92          1HD1      ILE  92  -0.475   5.495  -1.602
  701   2HD1  ILE  92          2HD1      ILE  92  -1.555   6.899  -1.697
  702   3HD1  ILE  92          3HD1      ILE  92   0.186   7.087  -2.019
  703    H    LYS  93           H        LYS  93  -2.337   8.375  -6.756
  704    HA   LYS  93           HA       LYS  93  -2.076  11.139  -6.419
  705   1HB   LYS  93          1HB       LYS  93  -2.201  11.377  -8.877
  706   2HB   LYS  93          2HB       LYS  93  -1.083  10.137  -8.391
  707   1HG   LYS  93          1HG       LYS  93  -2.113   9.215 -10.248
  708   2HG   LYS  93          2HG       LYS  93  -2.993   8.492  -8.906
  709   1HD   LYS  93          1HD       LYS  93  -4.543   9.155 -10.638
  710   2HD   LYS  93          2HD       LYS  93  -4.784  10.171  -9.218
  711   1HE   LYS  93          1HE       LYS  93  -4.879  11.518 -11.236
  712   2HE   LYS  93          2HE       LYS  93  -3.455  11.960 -10.313
  713   1HZ   LYS  93          1HZ       LYS  93  -3.496  10.174 -12.685
  714   2HZ   LYS  93          2HZ       LYS  93  -2.103  10.622 -11.863
  715   3HZ   LYS  93          3HZ       LYS  93  -3.030  11.778 -12.669
  716    H    LYS  94           H        LYS  94  -4.929   9.230  -7.110
  717    HA   LYS  94           HA       LYS  94  -6.455  11.543  -7.647
  718   1HB   LYS  94          1HB       LYS  94  -7.170   9.344  -8.456
  719   2HB   LYS  94          2HB       LYS  94  -7.342   8.777  -6.803
  720   1HG   LYS  94          1HG       LYS  94  -9.207  10.274  -6.442
  721   2HG   LYS  94          2HG       LYS  94  -8.975  10.982  -8.038
  722   1HD   LYS  94          1HD       LYS  94 -10.826   9.395  -8.034
  723   2HD   LYS  94          2HD       LYS  94  -9.523   8.852  -9.085
  724   1HE   LYS  94          1HE       LYS  94  -8.768   7.300  -7.350
  725   2HE   LYS  94          2HE       LYS  94 -10.044   7.874  -6.275
  726   1HZ   LYS  94          1HZ       LYS  94 -10.631   5.794  -7.405
  727   2HZ   LYS  94          2HZ       LYS  94 -10.490   6.562  -8.901
  728   3HZ   LYS  94          3HZ       LYS  94 -11.677   7.051  -7.817
  729    H    TYR  95           H        TYR  95  -5.681   9.731  -4.772
  730    HA   TYR  95           HA       TYR  95  -7.389  11.023  -2.995
  731   1HB   TYR  95          1HB       TYR  95  -6.360   9.005  -2.466
  732   2HB   TYR  95          2HB       TYR  95  -4.773   9.677  -2.846
  733    HD1  TYR  95           1HD      TYR  95  -3.476  10.547  -1.084
  734    HD2  TYR  95           2HD      TYR  95  -7.677  10.075  -0.487
  735    HE1  TYR  95           1HE      TYR  95  -3.233  11.163   1.226
  736    HE2  TYR  95           2HE      TYR  95  -7.384  10.682   1.867
  737    HH   TYR  95           HH       TYR  95  -4.468  11.828   3.154
  738    H    MET  96           H        MET  96  -4.007  11.683  -3.786
  739    HA   MET  96           HA       MET  96  -3.764  13.851  -2.065
  740   1HB   MET  96          1HB       MET  96  -2.247  13.507  -4.641
  741   2HB   MET  96          2HB       MET  96  -1.796  14.420  -3.196
  742   1HG   MET  96          1HG       MET  96  -2.068  11.434  -3.332
  743   2HG   MET  96          2HG       MET  96  -0.549  12.322  -3.402
  744   1HE   MET  96          1HE       MET  96  -0.432  13.969   0.081
  745   2HE   MET  96          2HE       MET  96  -1.239  14.636  -1.361
  746   3HE   MET  96          3HE       MET  96   0.308  13.822  -1.536
  747    H    GLN  97           H        GLN  97  -5.151  13.612  -5.097
  748    HA   GLN  97           HA       GLN  97  -5.096  16.350  -5.855
  749   1HB   GLN  97          1HB       GLN  97  -7.311  14.452  -6.564
  750   2HB   GLN  97          2HB       GLN  97  -6.911  15.937  -7.406
  751   1HG   GLN  97          1HG       GLN  97  -5.460  13.329  -7.358
  752   2HG   GLN  97          2HG       GLN  97  -6.090  14.194  -8.747
  753   1HE2  GLN  97          1HE2      GLN  97  -3.566  13.740  -6.579
  754   2HE2  GLN  97          2HE2      GLN  97  -2.363  14.759  -7.258
  755    H    LYS  98           H        LYS  98  -6.934  14.753  -3.470
  756    HA   LYS  98           HA       LYS  98  -9.020  16.699  -3.457
  757   1HB   LYS  98          1HB       LYS  98 -10.026  15.547  -1.631
  758   2HB   LYS  98          2HB       LYS  98  -9.314  14.352  -2.680
  759   1HG   LYS  98          1HG       LYS  98  -7.931  13.548  -1.095
  760   2HG   LYS  98          2HG       LYS  98  -7.497  15.157  -0.539
  761   1HD   LYS  98          1HD       LYS  98 -10.051  13.628   0.103
  762   2HD   LYS  98          2HD       LYS  98  -8.645  13.800   1.164
  763   1HE   LYS  98          1HE       LYS  98  -8.994  16.094   1.462
  764   2HE   LYS  98          2HE       LYS  98 -10.144  16.221   0.143
  765   1HZ   LYS  98          1HZ       LYS  98 -11.141  16.294   2.332
  766   2HZ   LYS  98          2HZ       LYS  98 -10.668  14.717   2.674
  767   3HZ   LYS  98          3HZ       LYS  98 -11.752  15.056   1.411
  768    H    PHE  99           H        PHE  99  -5.900  16.476  -2.041
  769    HA   PHE  99           HA       PHE  99  -6.420  18.255   0.148
  770   1HB   PHE  99          1HB       PHE  99  -3.804  17.299  -1.029
  771   2HB   PHE  99          2HB       PHE  99  -3.933  18.373   0.361
  772    HD1  PHE  99           1HD      PHE  99  -5.749  17.394   2.151
  773    HD2  PHE  99           2HD      PHE  99  -3.297  15.126  -0.491
  774    HE1  PHE  99           1HE      PHE  99  -5.839  15.502   3.695
  775    HE2  PHE  99           2HE      PHE  99  -3.416  13.196   1.105
  776    HZ   PHE  99           HZ       PHE  99  -4.747  13.414   3.132
  777    H    GLY 100           H        GLY 100  -5.223  18.538  -3.106
  778   1HA   GLY 100          1HA       GLY 100  -5.624  20.485  -4.360
  779   2HA   GLY 100          2HA       GLY 100  -5.565  21.413  -2.861
  780    H    ALA 101           H        ALA 101  -3.857  22.511  -2.631
  781    HA   ALA 101           HA       ALA 101  -1.519  22.027  -4.249
  782   1HB   ALA 101          1HB       ALA 101  -2.433  24.283  -3.884
  783   2HB   ALA 101          2HB       ALA 101  -0.747  24.113  -3.387
  784   3HB   ALA 101          3HB       ALA 101  -2.028  24.132  -2.171
  785    H    VAL 102           H        VAL 102  -2.337  21.871  -0.805
  786    HA   VAL 102           HA       VAL 102   0.305  20.621  -0.389
  787    HB   VAL 102           HB       VAL 102  -1.025  22.131   1.805
  788   1HG1  VAL 102          1HG1      VAL 102   0.834  20.812   2.394
  789   2HG1  VAL 102          2HG1      VAL 102   1.225  22.523   2.618
  790   3HG1  VAL 102          3HG1      VAL 102   1.850  21.647   1.216
  791   1HG2  VAL 102          1HG2      VAL 102   0.697  23.514  -0.239
  792   2HG2  VAL 102          2HG2      VAL 102   0.161  24.207   1.301
  793   3HG2  VAL 102          3HG2      VAL 102  -1.025  23.773   0.063
  794    H    TYR 103           H        TYR 103   0.374  19.186   1.306
  795    HA   TYR 103           HA       TYR 103  -1.993  17.628   1.444
  796   1HB   TYR 103          1HB       TYR 103  -0.012  16.332   1.085
  797   2HB   TYR 103          2HB       TYR 103   0.846  17.207   2.343
  798    HD1  TYR 103           1HD      TYR 103   1.613  15.268   3.485
  799    HD2  TYR 103           2HD      TYR 103  -2.509  15.786   2.829
  800    HE1  TYR 103           1HE      TYR 103   1.128  13.474   5.124
  801    HE2  TYR 103           2HE      TYR 103  -3.011  14.056   4.443
  802    HH   TYR 103           HH       TYR 103  -2.055  12.227   5.578
  803    H    LYS 104           H        LYS 104  -3.390  18.526   2.670
  804    HA   LYS 104           HA       LYS 104  -2.696  19.144   5.436
  805   1HB   LYS 104          1HB       LYS 104  -5.021  20.004   3.724
  806   2HB   LYS 104          2HB       LYS 104  -4.826  20.441   5.409
  807   1HG   LYS 104          1HG       LYS 104  -2.810  21.702   4.864
  808   2HG   LYS 104          2HG       LYS 104  -2.917  21.174   3.191
  809   1HD   LYS 104          1HD       LYS 104  -5.003  22.841   4.604
  810   2HD   LYS 104          2HD       LYS 104  -3.747  23.489   3.548
  811   1HE   LYS 104          1HE       LYS 104  -4.647  22.041   1.722
  812   2HE   LYS 104          2HE       LYS 104  -5.970  21.591   2.786
  813   1HZ   LYS 104          1HZ       LYS 104  -6.602  23.402   1.291
  814   2HZ   LYS 104          2HZ       LYS 104  -5.365  24.371   1.930
  815   3HZ   LYS 104          3HZ       LYS 104  -6.649  23.899   2.896
  816    HA   PRO 105           HA       PRO 105  -4.969  15.101   5.611
  817   1HB   PRO 105          1HB       PRO 105  -4.057  14.486   8.141
  818   2HB   PRO 105          2HB       PRO 105  -3.234  14.036   6.646
  819   1HG   PRO 105          1HG       PRO 105  -2.756  16.301   8.478
  820   2HG   PRO 105          2HG       PRO 105  -1.563  15.259   7.620
  821   1HD   PRO 105          1HD       PRO 105  -2.173  17.787   6.882
  822   2HD   PRO 105          2HD       PRO 105  -1.752  16.549   5.687
  823    H    LYS 106           H        LYS 106  -4.671  17.664   7.938
  824    HA   LYS 106           HA       LYS 106  -6.904  17.311   9.487
  825   1HB   LYS 106          1HB       LYS 106  -5.914  19.937   8.374
  826   2HB   LYS 106          2HB       LYS 106  -6.815  19.728   9.874
  827   1HG   LYS 106          1HG       LYS 106  -4.900  18.508  10.825
  828   2HG   LYS 106          2HG       LYS 106  -4.013  18.737   9.318
  829   1HD   LYS 106          1HD       LYS 106  -4.282  21.213   9.645
  830   2HD   LYS 106          2HD       LYS 106  -4.950  20.858  11.237
  831   1HE   LYS 106          1HE       LYS 106  -2.188  20.099  10.284
  832   2HE   LYS 106          2HE       LYS 106  -2.567  21.456  11.337
  833   1HZ   LYS 106          1HZ       LYS 106  -1.776  19.580  12.588
  834   2HZ   LYS 106          2HZ       LYS 106  -2.958  18.574  11.982
  835   3HZ   LYS 106          3HZ       LYS 106  -3.379  19.845  13.003
  836    H    GLU 107           H        GLU 107  -6.736  18.089   6.137
  837    HA   GLU 107           HA       GLU 107  -9.605  18.724   5.990
  838   1HB   GLU 107          1HB       GLU 107  -7.413  19.022   3.927
  839   2HB   GLU 107          2HB       GLU 107  -9.095  19.461   3.695
  840   1HG   GLU 107          1HG       GLU 107  -7.183  20.724   5.647
  841   2HG   GLU 107          2HG       GLU 107  -7.718  21.409   4.115
  842    H    ASP 108           H        ASP 108  -7.857  16.001   6.095
  843    HA   ASP 108           HA       ASP 108  -8.358  14.760   3.633
  844   1HB   ASP 108          1HB       ASP 108  -6.452  14.054   4.824
  845   2HB   ASP 108          2HB       ASP 108  -7.348  13.822   6.321
  846    H    THR 109           H        THR 109  -9.461  12.721   3.621
  847    HA   THR 109           HA       THR 109 -12.216  13.365   4.066
  848    HB   THR 109           HB       THR 109 -11.492  12.693   1.857
  849    HG1  THR 109           1HG      THR 109 -13.527  12.140   2.363
  850   1HG2  THR 109          1HG2      THR 109 -10.697  10.070   3.098
  851   2HG2  THR 109          2HG2      THR 109  -9.620  11.323   2.505
  852   3HG2  THR 109          3HG2      THR 109 -10.655  10.445   1.360
  Start of MODEL    7
    1    H    THR  10           H        THR  10  -2.397 -24.264   4.497
    2    HA   THR  10           HA       THR  10  -3.563 -22.846   5.622
    3    HB   THR  10           HB       THR  10  -2.598 -22.076   7.921
    4    HG1  THR  10           1HG      THR  10  -0.419 -23.001   6.956
    5   1HG2  THR  10          1HG2      THR  10  -3.002 -24.988   7.273
    6   2HG2  THR  10          2HG2      THR  10  -4.270 -23.822   7.657
    7   3HG2  THR  10          3HG2      THR  10  -3.091 -24.285   8.886
    8    H    SER  11           H        SER  11  -4.073 -21.209   4.563
    9    HA   SER  11           HA       SER  11  -2.288 -18.997   3.883
   10   1HB   SER  11          1HB       SER  11  -5.202 -19.290   3.667
   11   2HB   SER  11          2HB       SER  11  -4.117 -18.248   2.701
   12    HG   SER  11           HG       SER  11  -4.220 -19.985   1.327
   13    H    SER  12           H        SER  12  -3.860 -19.775   6.601
   14    HA   SER  12           HA       SER  12  -4.554 -17.160   7.309
   15   1HB   SER  12          1HB       SER  12  -4.707 -18.306   9.565
   16   2HB   SER  12          2HB       SER  12  -5.650 -18.947   8.190
   17    HG   SER  12           HG       SER  12  -4.752 -20.746   8.513
   18    H    GLU  13           H        GLU  13  -1.688 -19.349   8.026
   19    HA   GLU  13           HA       GLU  13  -0.349 -17.260   9.400
   20   1HB   GLU  13          1HB       GLU  13   1.542 -18.884   9.409
   21   2HB   GLU  13          2HB       GLU  13   0.053 -19.558  10.063
   22   1HG   GLU  13          1HG       GLU  13  -0.317 -20.868   8.169
   23   2HG   GLU  13          2HG       GLU  13   0.777 -19.939   7.195
   24    H    LEU  14           H        LEU  14  -0.329 -18.690   6.223
   25    HA   LEU  14           HA       LEU  14   1.959 -17.655   5.018
   26   1HB   LEU  14          1HB       LEU  14   0.057 -19.256   4.187
   27   2HB   LEU  14          2HB       LEU  14  -0.713 -17.782   3.679
   28    HG   LEU  14           HG       LEU  14   1.958 -18.753   2.631
   29   1HD1  LEU  14          1HD1      LEU  14   0.153 -20.219   1.965
   30   2HD1  LEU  14          2HD1      LEU  14   0.729 -19.282   0.591
   31   3HD1  LEU  14          3HD1      LEU  14  -0.779 -18.840   1.387
   32   1HD2  LEU  14          1HD2      LEU  14   1.680 -17.050   0.898
   33   2HD2  LEU  14          2HD2      LEU  14   1.687 -16.295   2.493
   34   3HD2  LEU  14          3HD2      LEU  14   0.166 -16.526   1.634
   35    H    ALA  15           H        ALA  15  -1.092 -16.369   5.694
   36    HA   ALA  15           HA       ALA  15  -0.631 -13.959   4.214
   37   1HB   ALA  15          1HB       ALA  15  -2.774 -14.836   4.094
   38   2HB   ALA  15          2HB       ALA  15  -2.804 -13.283   4.939
   39   3HB   ALA  15          3HB       ALA  15  -2.932 -14.802   5.852
   40    H    LYS  16           H        LYS  16  -0.735 -14.977   7.591
   41    HA   LYS  16           HA       LYS  16  -0.667 -12.486   8.814
   42   1HB   LYS  16          1HB       LYS  16   0.793 -15.025   9.566
   43   2HB   LYS  16          2HB       LYS  16   0.834 -13.585  10.564
   44   1HG   LYS  16          1HG       LYS  16  -1.578 -13.718  10.860
   45   2HG   LYS  16          2HG       LYS  16  -1.629 -15.160   9.836
   46   1HD   LYS  16          1HD       LYS  16  -0.240 -16.367  11.399
   47   2HD   LYS  16          2HD       LYS  16  -0.024 -14.925  12.381
   48   1HE   LYS  16          1HE       LYS  16  -2.645 -16.336  11.885
   49   2HE   LYS  16          2HE       LYS  16  -1.673 -16.472  13.347
   50   1HZ   LYS  16          1HZ       LYS  16  -2.983 -14.013  12.329
   51   2HZ   LYS  16          2HZ       LYS  16  -1.991 -14.072  13.701
   52   3HZ   LYS  16          3HZ       LYS  16  -3.440 -14.925  13.661
   53    H    LYS  17           H        LYS  17   1.862 -14.393   7.373
   54    HA   LYS  17           HA       LYS  17   3.890 -12.408   7.723
   55   1HB   LYS  17          1HB       LYS  17   3.740 -15.138   6.617
   56   2HB   LYS  17          2HB       LYS  17   4.985 -14.087   5.950
   57   1HG   LYS  17          1HG       LYS  17   5.778 -15.477   7.838
   58   2HG   LYS  17          2HG       LYS  17   5.943 -13.747   8.112
   59   1HD   LYS  17          1HD       LYS  17   3.754 -13.862   9.383
   60   2HD   LYS  17          2HD       LYS  17   3.900 -15.618   9.285
   61   1HE   LYS  17          1HE       LYS  17   4.759 -14.624  11.399
   62   2HE   LYS  17          2HE       LYS  17   5.952 -15.581  10.523
   63   1HZ   LYS  17          1HZ       LYS  17   6.757 -13.385  11.402
   64   2HZ   LYS  17          2HZ       LYS  17   5.791 -12.618  10.207
   65   3HZ   LYS  17          3HZ       LYS  17   7.015 -13.661   9.776
   66    H    SER  18           H        SER  18   1.674 -13.346   5.105
   67    HA   SER  18           HA       SER  18   3.132 -11.958   3.141
   68   1HB   SER  18          1HB       SER  18   1.353 -13.773   2.701
   69   2HB   SER  18          2HB       SER  18   0.160 -12.501   2.962
   70    HG   SER  18           HG       SER  18   0.562 -11.768   0.977
   71    H    LYS  19           H        LYS  19   0.660 -10.987   5.436
   72    HA   LYS  19           HA       LYS  19   0.136  -8.507   4.173
   73   1HB   LYS  19          1HB       LYS  19  -0.202  -9.150   7.103
   74   2HB   LYS  19          2HB       LYS  19  -0.972  -7.814   6.253
   75   1HG   LYS  19          1HG       LYS  19  -1.992  -9.747   4.776
   76   2HG   LYS  19          2HG       LYS  19  -1.591 -10.749   6.147
   77   1HD   LYS  19          1HD       LYS  19  -3.467  -8.374   6.105
   78   2HD   LYS  19          2HD       LYS  19  -3.900 -10.069   6.283
   79   1HE   LYS  19          1HE       LYS  19  -2.529 -10.072   8.377
   80   2HE   LYS  19          2HE       LYS  19  -2.413  -8.314   8.151
   81   1HZ   LYS  19          1HZ       LYS  19  -4.871  -8.192   8.274
   82   2HZ   LYS  19          2HZ       LYS  19  -4.223  -8.856   9.677
   83   3HZ   LYS  19          3HZ       LYS  19  -4.929  -9.856   8.544
   84    H    GLU  20           H        GLU  20   2.557  -9.637   6.368
   85    HA   GLU  20           HA       GLU  20   3.565  -7.073   7.153
   86   1HB   GLU  20          1HB       GLU  20   5.223  -9.580   6.923
   87   2HB   GLU  20          2HB       GLU  20   5.465  -8.238   8.026
   88   1HG   GLU  20          1HG       GLU  20   3.364  -8.843   9.126
   89   2HG   GLU  20          2HG       GLU  20   3.279 -10.203   8.002
   90    H    VAL  21           H        VAL  21   4.594  -9.522   4.828
   91    HA   VAL  21           HA       VAL  21   6.696  -8.034   3.612
   92    HB   VAL  21           HB       VAL  21   4.947 -10.200   2.421
   93   1HG1  VAL  21          1HG1      VAL  21   6.245  -8.969   0.747
   94   2HG1  VAL  21          2HG1      VAL  21   6.867 -10.611   0.916
   95   3HG1  VAL  21          3HG1      VAL  21   7.723  -9.262   1.661
   96   1HG2  VAL  21          1HG2      VAL  21   7.562 -10.489   3.894
   97   2HG2  VAL  21          2HG2      VAL  21   6.715 -11.789   3.054
   98   3HG2  VAL  21          3HG2      VAL  21   5.980 -11.019   4.462
   99    H    PHE  22           H        PHE  22   3.290  -8.334   2.940
  100    HA   PHE  22           HA       PHE  22   3.345  -6.849   0.507
  101   1HB   PHE  22          1HB       PHE  22   1.448  -8.152   0.706
  102   2HB   PHE  22          2HB       PHE  22   1.230  -7.728   2.404
  103    HD1  PHE  22           1HD      PHE  22   1.142  -6.154  -1.004
  104    HD2  PHE  22           2HD      PHE  22  -0.406  -6.220   2.952
  105    HE1  PHE  22           1HE      PHE  22  -0.461  -4.390  -1.587
  106    HE2  PHE  22           2HE      PHE  22  -1.994  -4.492   2.361
  107    HZ   PHE  22           HZ       PHE  22  -2.057  -3.564   0.137
  108    H    ARG  23           H        ARG  23   2.396  -5.980   3.746
  109    HA   ARG  23           HA       ARG  23   1.969  -3.285   3.063
  110   1HB   ARG  23          1HB       ARG  23   1.726  -2.722   5.367
  111   2HB   ARG  23          2HB       ARG  23   1.093  -4.336   5.137
  112   1HG   ARG  23          1HG       ARG  23   2.241  -4.773   7.035
  113   2HG   ARG  23          2HG       ARG  23   3.579  -4.934   5.909
  114   1HD   ARG  23          1HD       ARG  23   4.357  -2.732   6.310
  115   2HD   ARG  23          2HD       ARG  23   2.916  -2.320   7.237
  116    HE   ARG  23           HE       ARG  23   4.405  -4.520   8.328
  117   1HH1  ARG  23          1HH1      ARG  23   4.164  -0.976   8.280
  118   2HH1  ARG  23          2HH1      ARG  23   4.849  -0.779   9.820
  119   1HH2  ARG  23          1HH2      ARG  23   5.331  -4.224  10.446
  120   2HH2  ARG  23          2HH2      ARG  23   5.509  -2.658  11.092
  121    H    LYS  24           H        LYS  24   4.934  -4.917   3.844
  122    HA   LYS  24           HA       LYS  24   6.459  -2.542   4.137
  123   1HB   LYS  24          1HB       LYS  24   7.294  -5.335   3.414
  124   2HB   LYS  24          2HB       LYS  24   8.421  -4.008   3.672
  125   1HG   LYS  24          1HG       LYS  24   7.623  -3.745   5.941
  126   2HG   LYS  24          2HG       LYS  24   6.455  -5.042   5.691
  127   1HD   LYS  24          1HD       LYS  24   8.319  -6.583   5.244
  128   2HD   LYS  24          2HD       LYS  24   9.451  -5.274   5.596
  129   1HE   LYS  24          1HE       LYS  24   8.495  -5.065   7.835
  130   2HE   LYS  24          2HE       LYS  24   7.400  -6.398   7.485
  131   1HZ   LYS  24          1HZ       LYS  24   9.334  -7.807   7.151
  132   2HZ   LYS  24          2HZ       LYS  24   9.232  -7.213   8.707
  133   3HZ   LYS  24          3HZ       LYS  24  10.356  -6.543   7.612
  134    H    GLU  25           H        GLU  25   5.851  -4.715   1.310
  135    HA   GLU  25           HA       GLU  25   7.498  -3.175  -0.390
  136   1HB   GLU  25          1HB       GLU  25   6.097  -4.487  -2.173
  137   2HB   GLU  25          2HB       GLU  25   7.382  -5.286  -1.261
  138   1HG   GLU  25          1HG       GLU  25   5.611  -6.134   0.265
  139   2HG   GLU  25          2HG       GLU  25   4.397  -5.431  -0.791
  140    H    MET  26           H        MET  26   4.162  -3.117   0.395
  141    HA   MET  26           HA       MET  26   3.595  -1.203  -1.622
  142   1HB   MET  26          1HB       MET  26   1.956  -2.735  -0.730
  143   2HB   MET  26          2HB       MET  26   2.086  -1.904   0.806
  144   1HG   MET  26          1HG       MET  26   0.097  -1.209  -0.747
  145   2HG   MET  26          2HG       MET  26   1.021   0.012   0.121
  146   1HE   MET  26          1HE       MET  26   1.133  -0.507  -4.476
  147   2HE   MET  26          2HE       MET  26  -0.119  -1.170  -3.450
  148   3HE   MET  26          3HE       MET  26   1.491  -1.940  -3.479
  149    H    SER  27           H        SER  27   4.342  -0.980   1.770
  150    HA   SER  27           HA       SER  27   3.933   1.787   1.967
  151   1HB   SER  27          1HB       SER  27   5.776   0.047   3.618
  152   2HB   SER  27          2HB       SER  27   5.632   1.781   3.888
  153    HG   SER  27           HG       SER  27   3.207   0.911   3.740
  154    H    GLN  28           H        GLN  28   6.689  -0.106   0.864
  155    HA   GLN  28           HA       GLN  28   8.301   2.216   0.621
  156   1HB   GLN  28          1HB       GLN  28   9.716   0.843  -0.812
  157   2HB   GLN  28          2HB       GLN  28   9.449   0.177   0.840
  158   1HG   GLN  28          1HG       GLN  28   7.851  -1.312  -0.218
  159   2HG   GLN  28          2HG       GLN  28   8.303  -0.663  -1.791
  160   1HE2  GLN  28          1HE2      GLN  28  10.339  -1.133  -2.626
  161   2HE2  GLN  28          2HE2      GLN  28  11.299  -2.431  -2.004
  162    H    PHE  29           H        PHE  29   6.546   0.321  -1.606
  163    HA   PHE  29           HA       PHE  29   6.872   1.809  -3.944
  164   1HB   PHE  29          1HB       PHE  29   5.669  -0.326  -4.010
  165   2HB   PHE  29          2HB       PHE  29   4.377   0.337  -3.023
  166    HD1  PHE  29           1HD      PHE  29   2.583   1.545  -4.006
  167    HD2  PHE  29           2HD      PHE  29   5.970   0.435  -6.336
  168    HE1  PHE  29           1HE      PHE  29   1.363   2.125  -6.075
  169    HE2  PHE  29           2HE      PHE  29   4.731   1.021  -8.379
  170    HZ   PHE  29           HZ       PHE  29   2.402   1.855  -8.196
  171    H    ILE  30           H        ILE  30   4.350   2.266  -1.472
  172    HA   ILE  30           HA       ILE  30   3.239   4.583  -2.565
  173    HB   ILE  30           HB       ILE  30   3.235   3.551   0.277
  174   1HG1  ILE  30          1HG1      ILE  30   1.044   3.730  -1.788
  175   2HG1  ILE  30          2HG1      ILE  30   2.034   2.304  -1.510
  176   1HG2  ILE  30          1HG2      ILE  30   1.492   5.221   0.782
  177   2HG2  ILE  30          2HG2      ILE  30   1.717   5.918  -0.830
  178   3HG2  ILE  30          3HG2      ILE  30   3.022   5.994   0.339
  179   1HD1  ILE  30          1HD1      ILE  30   0.179   3.566   0.505
  180   2HD1  ILE  30          2HD1      ILE  30   1.173   2.146   0.758
  181   3HD1  ILE  30          3HD1      ILE  30  -0.119   2.095  -0.408
  182    H    VAL  31           H        VAL  31   5.748   4.199  -0.050
  183    HA   VAL  31           HA       VAL  31   6.316   6.841   0.349
  184    HB   VAL  31           HB       VAL  31   8.065   4.387   0.322
  185   1HG1  VAL  31          1HG1      VAL  31   9.978   5.603   1.153
  186   2HG1  VAL  31          2HG1      VAL  31   9.079   7.093   1.221
  187   3HG1  VAL  31          3HG1      VAL  31   9.501   6.396  -0.355
  188   1HG2  VAL  31          1HG2      VAL  31   6.495   4.710   2.154
  189   2HG2  VAL  31          2HG2      VAL  31   7.176   6.286   2.491
  190   3HG2  VAL  31          3HG2      VAL  31   8.153   4.834   2.748
  191    H    GLN  32           H        GLN  32   7.581   4.783  -2.260
  192    HA   GLN  32           HA       GLN  32   9.152   6.601  -3.503
  193   1HB   GLN  32          1HB       GLN  32   8.945   4.129  -3.882
  194   2HB   GLN  32          2HB       GLN  32   7.518   4.435  -4.832
  195   1HG   GLN  32          1HG       GLN  32  10.182   5.597  -5.514
  196   2HG   GLN  32          2HG       GLN  32   9.677   4.004  -6.063
  197   1HE2  GLN  32          1HE2      GLN  32  10.312   6.429  -7.556
  198   2HE2  GLN  32          2HE2      GLN  32   8.937   6.763  -8.541
  199    H    CYS  33           H        CYS  33   5.750   5.829  -3.935
  200    HA   CYS  33           HA       CYS  33   5.108   7.535  -6.055
  201   1HB   CYS  33          1HB       CYS  33   3.488   6.306  -3.885
  202   2HB   CYS  33          2HB       CYS  33   2.755   7.167  -5.249
  203    HG   CYS  33           HG       CYS  33   4.611   4.320  -5.289
  204    H    LEU  34           H        LEU  34   5.032   8.000  -2.587
  205    HA   LEU  34           HA       LEU  34   3.862  10.608  -2.755
  206   1HB   LEU  34          1HB       LEU  34   5.187   9.246  -0.437
  207   2HB   LEU  34          2HB       LEU  34   4.349  10.779  -0.349
  208    HG   LEU  34           HG       LEU  34   3.141   8.101  -0.975
  209   1HD1  LEU  34          1HD1      LEU  34   2.815   9.983   1.356
  210   2HD1  LEU  34          2HD1      LEU  34   3.734   8.483   1.357
  211   3HD1  LEU  34          3HD1      LEU  34   1.984   8.440   1.144
  212   1HD2  LEU  34          1HD2      LEU  34   2.007   9.807  -2.258
  213   2HD2  LEU  34          2HD2      LEU  34   1.854  10.816  -0.822
  214   3HD2  LEU  34          3HD2      LEU  34   0.990   9.284  -0.917
  215    H    ASN  35           H        ASN  35   7.124   9.394  -2.768
  216    HA   ASN  35           HA       ASN  35   8.625  11.365  -2.055
  217   1HB   ASN  35          1HB       ASN  35   8.945   9.379  -4.065
  218   2HB   ASN  35          2HB       ASN  35   9.927  10.829  -4.404
  219   1HD2  ASN  35          1HD2      ASN  35   8.918   8.666  -1.927
  220   2HD2  ASN  35          2HD2      ASN  35  10.272   8.907  -0.935
  221    HA   PRO  36           HA       PRO  36   8.163  14.179  -5.973
  222   1HB   PRO  36          1HB       PRO  36   5.797  13.958  -7.357
  223   2HB   PRO  36          2HB       PRO  36   7.286  13.154  -7.854
  224   1HG   PRO  36          1HG       PRO  36   4.948  12.053  -6.367
  225   2HG   PRO  36          2HG       PRO  36   5.925  11.300  -7.637
  226   1HD   PRO  36          1HD       PRO  36   6.212  10.725  -5.019
  227   2HD   PRO  36          2HD       PRO  36   7.577  10.662  -6.135
  228    H    TYR  37           H        TYR  37   5.686  13.285  -3.783
  229    HA   TYR  37           HA       TYR  37   4.274  15.785  -4.052
  230   1HB   TYR  37          1HB       TYR  37   3.858  13.468  -2.165
  231   2HB   TYR  37          2HB       TYR  37   2.859  14.915  -2.196
  232    HD1  TYR  37           1HD      TYR  37   3.882  11.971  -4.122
  233    HD2  TYR  37           2HD      TYR  37   1.111  15.156  -3.801
  234    HE1  TYR  37           1HE      TYR  37   2.518  10.913  -5.804
  235    HE2  TYR  37           2HE      TYR  37  -0.276  14.171  -5.504
  236    HH   TYR  37           HH       TYR  37   0.195  10.941  -6.556
  237    H    ARG  38           H        ARG  38   6.744  14.418  -2.093
  238    HA   ARG  38           HA       ARG  38   6.395  16.463  -0.054
  239   1HB   ARG  38          1HB       ARG  38   8.280  15.442   1.087
  240   2HB   ARG  38          2HB       ARG  38   7.088  14.222   0.655
  241   1HG   ARG  38          1HG       ARG  38   8.447  13.526  -1.209
  242   2HG   ARG  38          2HG       ARG  38   9.608  14.804  -0.873
  243   1HD   ARG  38          1HD       ARG  38  10.004  13.773   1.358
  244   2HD   ARG  38          2HD       ARG  38   8.862  12.505   0.893
  245    HE   ARG  38           HE       ARG  38  10.431  11.886  -0.893
  246   1HH1  ARG  38          1HH1      ARG  38  11.817  13.739   1.825
  247   2HH1  ARG  38          2HH1      ARG  38  13.375  13.091   1.588
  248   1HH2  ARG  38          1HH2      ARG  38  12.554  11.048  -1.147
  249   2HH2  ARG  38          2HH2      ARG  38  13.807  11.530  -0.089
  250    H    LYS  39           H        LYS  39   7.686  16.421  -2.997
  251    HA   LYS  39           HA       LYS  39  10.088  17.932  -2.485
  252   1HB   LYS  39          1HB       LYS  39   8.632  17.513  -5.102
  253   2HB   LYS  39          2HB       LYS  39  10.278  18.085  -4.905
  254   1HG   LYS  39          1HG       LYS  39   9.224  15.326  -4.319
  255   2HG   LYS  39          2HG       LYS  39  10.378  15.789  -5.570
  256   1HD   LYS  39          1HD       LYS  39  12.011  16.388  -3.862
  257   2HD   LYS  39          2HD       LYS  39  10.820  16.035  -2.606
  258   1HE   LYS  39          1HE       LYS  39  12.331  14.165  -2.773
  259   2HE   LYS  39          2HE       LYS  39  10.749  13.694  -3.374
  260   1HZ   LYS  39          1HZ       LYS  39  11.584  13.993  -5.652
  261   2HZ   LYS  39          2HZ       LYS  39  12.487  12.879  -4.803
  262   3HZ   LYS  39          3HZ       LYS  39  13.094  14.419  -5.033
  263    HA   PRO  40           HA       PRO  40   8.047  21.801  -2.155
  264   1HB   PRO  40          1HB       PRO  40   9.985  23.499  -2.898
  265   2HB   PRO  40          2HB       PRO  40   9.948  22.682  -1.334
  266   1HG   PRO  40          1HG       PRO  40  11.527  21.978  -3.788
  267   2HG   PRO  40          2HG       PRO  40  12.040  21.947  -2.092
  268   1HD   PRO  40          1HD       PRO  40  11.318  19.717  -3.444
  269   2HD   PRO  40          2HD       PRO  40  11.047  19.907  -1.699
  270    H    ASP  41           H        ASP  41   9.027  20.589  -5.201
  271    HA   ASP  41           HA       ASP  41   7.899  22.793  -6.630
  272   1HB   ASP  41          1HB       ASP  41   8.649  21.422  -8.538
  273   2HB   ASP  41          2HB       ASP  41   9.969  21.967  -7.501
  274    H    CYS  42           H        CYS  42   6.786  20.293  -4.993
  275    HA   CYS  42           HA       CYS  42   5.027  19.029  -6.829
  276   1HB   CYS  42          1HB       CYS  42   5.597  18.003  -4.629
  277   2HB   CYS  42          2HB       CYS  42   4.664  19.269  -3.847
  278    HG   CYS  42           HG       CYS  42   2.836  17.338  -3.688
  279    H    LYS  43           H        LYS  43   3.270  19.711  -7.707
  280    HA   LYS  43           HA       LYS  43   2.199  22.291  -6.967
  281   1HB   LYS  43          1HB       LYS  43   2.676  21.823  -9.299
  282   2HB   LYS  43          2HB       LYS  43   1.620  20.424  -9.249
  283   1HG   LYS  43          1HG       LYS  43   0.639  22.350 -10.420
  284   2HG   LYS  43          2HG       LYS  43  -0.307  21.831  -9.026
  285   1HD   LYS  43          1HD       LYS  43   0.506  23.659  -7.712
  286   2HD   LYS  43          2HD       LYS  43   1.662  24.117  -8.964
  287   1HE   LYS  43          1HE       LYS  43  -0.358  25.555  -8.911
  288   2HE   LYS  43          2HE       LYS  43  -0.112  24.743 -10.452
  289   1HZ   LYS  43          1HZ       LYS  43  -2.013  23.877  -8.332
  290   2HZ   LYS  43          2HZ       LYS  43  -1.821  23.129  -9.832
  291   3HZ   LYS  43          3HZ       LYS  43  -2.423  24.688  -9.739
  292    H    VAL  44           H        VAL  44   1.300  18.916  -6.780
  293    HA   VAL  44           HA       VAL  44  -1.200  19.763  -5.568
  294    HB   VAL  44           HB       VAL  44  -1.737  19.059  -7.847
  295   1HG1  VAL  44          1HG1      VAL  44  -0.550  16.395  -7.156
  296   2HG1  VAL  44          2HG1      VAL  44   0.049  17.548  -8.349
  297   3HG1  VAL  44          3HG1      VAL  44  -1.503  16.747  -8.596
  298   1HG2  VAL  44          1HG2      VAL  44  -2.701  17.115  -5.763
  299   2HG2  VAL  44          2HG2      VAL  44  -3.468  17.393  -7.327
  300   3HG2  VAL  44          3HG2      VAL  44  -3.405  18.690  -6.133
  301    H    GLY  45           H        GLY  45  -1.433  19.045  -3.660
  302   1HA   GLY  45          1HA       GLY  45  -1.344  17.734  -1.799
  303   2HA   GLY  45          2HA       GLY  45  -0.916  16.369  -2.824
  304    H    ARG  46           H        ARG  46   0.886  19.545  -2.152
  305    HA   ARG  46           HA       ARG  46   3.263  18.100  -1.944
  306   1HB   ARG  46          1HB       ARG  46   3.195  20.452  -2.721
  307   2HB   ARG  46          2HB       ARG  46   2.571  20.886  -1.117
  308   1HG   ARG  46          1HG       ARG  46   4.553  20.635  -0.076
  309   2HG   ARG  46          2HG       ARG  46   5.144  19.450  -1.233
  310   1HD   ARG  46          1HD       ARG  46   6.357  21.547  -1.340
  311   2HD   ARG  46          2HD       ARG  46   5.539  21.164  -2.855
  312    HE   ARG  46           HE       ARG  46   3.951  22.884  -2.327
  313   1HH1  ARG  46          1HH1      ARG  46   6.803  22.896  -0.231
  314   2HH1  ARG  46          2HH1      ARG  46   6.829  24.576  -0.033
  315   1HH2  ARG  46          1HH2      ARG  46   4.058  25.273  -2.089
  316   2HH2  ARG  46          2HH2      ARG  46   5.283  25.927  -1.113
  317    H    ILE  47           H        ILE  47   3.978  17.088  -0.341
  318    HA   ILE  47           HA       ILE  47   2.564  16.985   2.108
  319    HB   ILE  47           HB       ILE  47   5.213  15.600   1.477
  320   1HG1  ILE  47          1HG1      ILE  47   2.341  14.589   1.328
  321   2HG1  ILE  47          2HG1      ILE  47   3.317  15.037  -0.052
  322   1HG2  ILE  47          1HG2      ILE  47   4.511  14.119   3.290
  323   2HG2  ILE  47          2HG2      ILE  47   3.346  15.353   3.794
  324   3HG2  ILE  47          3HG2      ILE  47   5.058  15.714   3.752
  325   1HD1  ILE  47          1HD1      ILE  47   3.177  12.630   0.321
  326   2HD1  ILE  47          2HD1      ILE  47   4.005  12.832   1.870
  327   3HD1  ILE  47          3HD1      ILE  47   4.818  13.254   0.354
  328    H    THR  48           H        THR  48   2.668  18.106   3.715
  329    HA   THR  48           HA       THR  48   4.154  20.318   4.160
  330    HB   THR  48           HB       THR  48   3.299  19.887   6.556
  331    HG1  THR  48           1HG      THR  48   2.166  18.056   6.812
  332   1HG2  THR  48          1HG2      THR  48   1.053  20.441   5.857
  333   2HG2  THR  48          2HG2      THR  48   1.453  19.858   4.232
  334   3HG2  THR  48          3HG2      THR  48   2.237  21.325   4.861
  335    H    THR  49           H        THR  49   4.331  17.277   5.894
  336    HA   THR  49           HA       THR  49   7.042  18.028   6.830
  337    HB   THR  49           HB       THR  49   5.215  16.465   8.595
  338    HG1  THR  49           1HG      THR  49   3.844  18.036   8.465
  339   1HG2  THR  49          1HG2      THR  49   7.290  18.606   9.117
  340   2HG2  THR  49          2HG2      THR  49   7.549  16.868   9.245
  341   3HG2  THR  49          3HG2      THR  49   6.435  17.677  10.349
  342    H    THR  50           H        THR  50   8.393  16.277   7.208
  343    HA   THR  50           HA       THR  50   8.216  13.941   5.721
  344    HB   THR  50           HB       THR  50  10.208  14.914   6.550
  345    HG1  THR  50           1HG      THR  50  10.042  12.601   6.136
  346   1HG2  THR  50          1HG2      THR  50   9.500  15.658   8.729
  347   2HG2  THR  50          2HG2      THR  50  10.969  14.683   8.889
  348   3HG2  THR  50          3HG2      THR  50   9.387  13.995   9.298
  349    H    GLU  51           H        GLU  51   7.401  14.536   9.079
  350    HA   GLU  51           HA       GLU  51   6.569  11.918   9.714
  351   1HB   GLU  51          1HB       GLU  51   5.570  14.506  10.895
  352   2HB   GLU  51          2HB       GLU  51   5.450  12.910  11.628
  353   1HG   GLU  51          1HG       GLU  51   7.977  14.438  11.063
  354   2HG   GLU  51          2HG       GLU  51   7.245  14.135  12.637
  355    H    ASP  52           H        ASP  52   4.854  14.543   8.060
  356    HA   ASP  52           HA       ASP  52   2.307  13.231   8.157
  357   1HB   ASP  52          1HB       ASP  52   3.510  15.547   6.720
  358   2HB   ASP  52          2HB       ASP  52   1.912  14.936   6.339
  359    H    PHE  53           H        PHE  53   5.020  13.483   6.004
  360    HA   PHE  53           HA       PHE  53   4.002  12.094   3.793
  361   1HB   PHE  53          1HB       PHE  53   6.195  13.249   3.702
  362   2HB   PHE  53          2HB       PHE  53   6.765  12.279   5.032
  363    HD1  PHE  53           1HD      PHE  53   7.482   9.995   4.735
  364    HD2  PHE  53           2HD      PHE  53   6.161  12.321   1.446
  365    HE1  PHE  53           1HE      PHE  53   8.448   8.363   3.236
  366    HE2  PHE  53           2HE      PHE  53   7.132  10.677  -0.105
  367    HZ   PHE  53           HZ       PHE  53   8.274   8.719   0.749
  368    H    LYS  54           H        LYS  54   5.707  10.982   6.588
  369    HA   LYS  54           HA       LYS  54   5.603   8.148   6.150
  370   1HB   LYS  54          1HB       LYS  54   5.804   9.694   8.720
  371   2HB   LYS  54          2HB       LYS  54   6.126   7.972   8.528
  372   1HG   LYS  54          1HG       LYS  54   7.996   8.406   7.104
  373   2HG   LYS  54          2HG       LYS  54   7.601  10.122   7.029
  374   1HD   LYS  54          1HD       LYS  54   7.961  10.220   9.491
  375   2HD   LYS  54          2HD       LYS  54   8.546   8.547   9.384
  376   1HE   LYS  54          1HE       LYS  54  10.345   9.196   7.960
  377   2HE   LYS  54          2HE       LYS  54   9.704  10.829   7.800
  378   1HZ   LYS  54          1HZ       LYS  54  10.090  11.172  10.144
  379   2HZ   LYS  54          2HZ       LYS  54  11.537  10.769   9.356
  380   3HZ   LYS  54          3HZ       LYS  54  10.736   9.626  10.307
  381    H    HIS  55           H        HIS  55   3.389  10.371   7.844
  382    HA   HIS  55           HA       HIS  55   1.617   8.409   8.960
  383   1HB   HIS  55          1HB       HIS  55   1.701  10.788   9.714
  384   2HB   HIS  55          2HB       HIS  55   1.240  11.292   8.113
  385    HD1  HIS  55           1HD      HIS  55  -0.261   9.759  11.238
  386    HD2  HIS  55           2HD      HIS  55  -1.482  11.227   7.538
  387    HE1  HIS  55           1HE      HIS  55  -2.731  10.021  11.407
  388    H    LEU  56           H        LEU  56   1.580  10.270   6.018
  389    HA   LEU  56           HA       LEU  56  -0.807   9.052   5.075
  390   1HB   LEU  56          1HB       LEU  56   0.885  11.138   4.239
  391   2HB   LEU  56          2HB       LEU  56   0.814   9.979   2.938
  392    HG   LEU  56           HG       LEU  56  -1.127  11.842   4.068
  393   1HD1  LEU  56          1HD1      LEU  56  -0.024  12.299   2.020
  394   2HD1  LEU  56          2HD1      LEU  56  -1.754  12.233   1.812
  395   3HD1  LEU  56          3HD1      LEU  56  -0.749  10.882   1.261
  396   1HD2  LEU  56          1HD2      LEU  56  -2.391   9.814   4.556
  397   2HD2  LEU  56          2HD2      LEU  56  -2.121   9.220   2.916
  398   3HD2  LEU  56          3HD2      LEU  56  -3.093  10.659   3.208
  399    H    ALA  57           H        ALA  57   2.651   8.376   4.337
  400    HA   ALA  57           HA       ALA  57   2.090   6.469   2.405
  401   1HB   ALA  57          1HB       ALA  57   4.384   7.362   2.893
  402   2HB   ALA  57          2HB       ALA  57   4.337   5.604   2.791
  403   3HB   ALA  57          3HB       ALA  57   4.396   6.394   4.366
  404    H    ARG  58           H        ARG  58   2.272   6.173   5.801
  405    HA   ARG  58           HA       ARG  58   1.986   3.322   5.914
  406   1HB   ARG  58          1HB       ARG  58   1.367   5.403   7.994
  407   2HB   ARG  58          2HB       ARG  58   1.352   3.670   8.287
  408   1HG   ARG  58          1HG       ARG  58   3.691   3.516   7.848
  409   2HG   ARG  58          2HG       ARG  58   3.742   5.204   7.331
  410   1HD   ARG  58          1HD       ARG  58   3.019   5.882   9.549
  411   2HD   ARG  58          2HD       ARG  58   3.052   4.201  10.072
  412    HE   ARG  58           HE       ARG  58   5.517   4.573   9.040
  413   1HH1  ARG  58          1HH1      ARG  58   3.751   6.325  11.537
  414   2HH1  ARG  58          2HH1      ARG  58   5.142   6.796  12.391
  415   1HH2  ARG  58          1HH2      ARG  58   7.421   5.241  10.164
  416   2HH2  ARG  58          2HH2      ARG  58   7.292   6.184  11.587
  417    H    LYS  59           H        LYS  59  -0.310   5.988   6.335
  418    HA   LYS  59           HA       LYS  59  -2.428   4.366   6.935
  419   1HB   LYS  59          1HB       LYS  59  -2.519   6.724   7.423
  420   2HB   LYS  59          2HB       LYS  59  -2.478   7.123   5.709
  421   1HG   LYS  59          1HG       LYS  59  -4.624   6.003   5.397
  422   2HG   LYS  59          2HG       LYS  59  -4.670   5.625   7.113
  423   1HD   LYS  59          1HD       LYS  59  -4.689   8.006   7.626
  424   2HD   LYS  59          2HD       LYS  59  -4.661   8.376   5.896
  425   1HE   LYS  59          1HE       LYS  59  -6.754   7.213   5.581
  426   2HE   LYS  59          2HE       LYS  59  -6.764   6.730   7.273
  427   1HZ   LYS  59          1HZ       LYS  59  -6.817   9.106   7.821
  428   2HZ   LYS  59          2HZ       LYS  59  -8.191   8.548   7.074
  429   3HZ   LYS  59          3HZ       LYS  59  -7.084   9.496   6.207
  430    H    LEU  60           H        LEU  60  -1.318   5.697   3.844
  431    HA   LEU  60           HA       LEU  60  -3.429   4.879   2.337
  432   1HB   LEU  60          1HB       LEU  60  -0.585   5.393   1.566
  433   2HB   LEU  60          2HB       LEU  60  -1.886   5.263   0.375
  434    HG   LEU  60           HG       LEU  60  -2.020   7.128   2.661
  435   1HD1  LEU  60          1HD1      LEU  60  -0.698   7.631  -0.016
  436   2HD1  LEU  60          2HD1      LEU  60  -0.066   7.917   1.598
  437   3HD1  LEU  60          3HD1      LEU  60  -1.359   8.926   0.964
  438   1HD2  LEU  60          1HD2      LEU  60  -4.087   6.672   1.579
  439   2HD2  LEU  60          2HD2      LEU  60  -3.401   7.056  -0.003
  440   3HD2  LEU  60          3HD2      LEU  60  -3.615   8.332   1.202
  441    H    THR  61           H        THR  61  -0.380   3.396   3.112
  442    HA   THR  61           HA       THR  61  -0.469   0.989   1.641
  443    HB   THR  61           HB       THR  61   0.515   1.320   4.497
  444    HG1  THR  61           1HG      THR  61   1.592   2.702   2.997
  445   1HG2  THR  61          1HG2      THR  61   0.202  -1.030   3.887
  446   2HG2  THR  61          2HG2      THR  61   1.918  -0.641   4.024
  447   3HG2  THR  61          3HG2      THR  61   1.171  -0.787   2.433
  448    H    HIS  62           H        HIS  62  -1.820   1.944   4.643
  449    HA   HIS  62           HA       HIS  62  -2.884  -0.599   5.284
  450   1HB   HIS  62          1HB       HIS  62  -2.246   0.960   7.058
  451   2HB   HIS  62          2HB       HIS  62  -3.385   2.142   6.437
  452    HD1  HIS  62           1HD      HIS  62  -3.072  -0.608   8.887
  453    HD2  HIS  62           2HD      HIS  62  -6.151   1.462   7.000
  454    HE1  HIS  62           1HE      HIS  62  -5.090  -0.998  10.290
  455    H    GLY  63           H        GLY  63  -4.239   2.263   3.700
  456   1HA   GLY  63          1HA       GLY  63  -6.887   1.334   3.781
  457   2HA   GLY  63          2HA       GLY  63  -6.289   2.603   2.744
  458    H    VAL  64           H        VAL  64  -4.320   1.076   1.324
  459    HA   VAL  64           HA       VAL  64  -6.047  -0.136  -0.686
  460    HB   VAL  64           HB       VAL  64  -3.016  -0.278  -0.413
  461   1HG1  VAL  64          1HG1      VAL  64  -4.759  -1.028  -2.807
  462   2HG1  VAL  64          2HG1      VAL  64  -3.876  -2.163  -1.803
  463   3HG1  VAL  64          3HG1      VAL  64  -3.003  -1.029  -2.806
  464   1HG2  VAL  64          1HG2      VAL  64  -2.978   1.399  -2.208
  465   2HG2  VAL  64          2HG2      VAL  64  -3.809   2.000  -0.771
  466   3HG2  VAL  64          3HG2      VAL  64  -4.738   1.467  -2.173
  467    H    MET  65           H        MET  65  -4.167  -1.144   1.802
  468    HA   MET  65           HA       MET  65  -4.076  -3.963   1.433
  469   1HB   MET  65          1HB       MET  65  -2.636  -2.855   3.084
  470   2HB   MET  65          2HB       MET  65  -4.032  -2.322   3.954
  471   1HG   MET  65          1HG       MET  65  -4.586  -4.530   4.613
  472   2HG   MET  65          2HG       MET  65  -3.218  -5.189   3.719
  473   1HE   MET  65          1HE       MET  65  -2.352  -5.242   7.626
  474   2HE   MET  65          2HE       MET  65  -2.770  -6.247   6.215
  475   3HE   MET  65          3HE       MET  65  -3.982  -5.170   6.942
  476    H    ASN  66           H        ASN  66  -6.228  -1.919   3.338
  477    HA   ASN  66           HA       ASN  66  -8.022  -3.954   4.129
  478   1HB   ASN  66          1HB       ASN  66  -7.840  -1.036   4.265
  479   2HB   ASN  66          2HB       ASN  66  -9.472  -1.666   4.359
  480   1HD2  ASN  66          1HD2      ASN  66  -6.370  -1.417   5.764
  481   2HD2  ASN  66          2HD2      ASN  66  -6.766  -2.060   7.321
  482    H    LYS  67           H        LYS  67  -8.014  -1.701   1.405
  483    HA   LYS  67           HA       LYS  67 -10.542  -2.260   0.451
  484   1HB   LYS  67          1HB       LYS  67  -8.038  -1.544  -1.068
  485   2HB   LYS  67          2HB       LYS  67  -9.658  -1.525  -1.750
  486   1HG   LYS  67          1HG       LYS  67 -10.304   0.215  -0.183
  487   2HG   LYS  67          2HG       LYS  67  -8.694   0.170   0.540
  488   1HD   LYS  67          1HD       LYS  67  -7.734   0.805  -1.644
  489   2HD   LYS  67          2HD       LYS  67  -9.362   0.926  -2.304
  490   1HE   LYS  67          1HE       LYS  67  -8.174   2.577  -0.078
  491   2HE   LYS  67          2HE       LYS  67  -8.589   3.123  -1.700
  492   1HZ   LYS  67          1HZ       LYS  67 -10.924   2.628  -1.197
  493   2HZ   LYS  67          2HZ       LYS  67 -10.296   3.768  -0.139
  494   3HZ   LYS  67          3HZ       LYS  67 -10.500   2.192   0.376
  495    H    GLU  68           H        GLU  68  -7.422  -3.844  -0.316
  496    HA   GLU  68           HA       GLU  68  -8.908  -5.624  -1.882
  497   1HB   GLU  68          1HB       GLU  68  -6.757  -6.763  -2.277
  498   2HB   GLU  68          2HB       GLU  68  -6.888  -5.026  -2.648
  499   1HG   GLU  68          1HG       GLU  68  -5.642  -4.513  -0.658
  500   2HG   GLU  68          2HG       GLU  68  -5.380  -6.235  -0.355
  501    H    LEU  69           H        LEU  69  -7.584  -5.821   1.371
  502    HA   LEU  69           HA       LEU  69  -8.331  -8.454   1.701
  503   1HB   LEU  69          1HB       LEU  69  -8.093  -6.122   3.551
  504   2HB   LEU  69          2HB       LEU  69  -8.952  -7.515   4.151
  505    HG   LEU  69           HG       LEU  69  -6.559  -7.281   4.815
  506   1HD1  LEU  69          1HD1      LEU  69  -7.734  -9.433   4.966
  507   2HD1  LEU  69          2HD1      LEU  69  -6.052  -9.694   4.504
  508   3HD1  LEU  69          3HD1      LEU  69  -7.326  -9.791   3.288
  509   1HD2  LEU  69          1HD2      LEU  69  -4.847  -8.022   3.264
  510   2HD2  LEU  69          2HD2      LEU  69  -5.643  -6.549   2.707
  511   3HD2  LEU  69          3HD2      LEU  69  -6.050  -8.105   1.977
  512    H    LYS  70           H        LYS  70 -10.488  -5.621   1.375
  513    HA   LYS  70           HA       LYS  70 -12.681  -7.227   2.291
  514   1HB   LYS  70          1HB       LYS  70 -13.974  -5.200   2.283
  515   2HB   LYS  70          2HB       LYS  70 -12.409  -4.898   3.026
  516   1HG   LYS  70          1HG       LYS  70 -11.617  -3.851   1.055
  517   2HG   LYS  70          2HG       LYS  70 -13.142  -4.161   0.243
  518   1HD   LYS  70          1HD       LYS  70 -13.209  -1.900   0.949
  519   2HD   LYS  70          2HD       LYS  70 -14.260  -2.797   2.034
  520   1HE   LYS  70          1HE       LYS  70 -11.408  -2.149   2.718
  521   2HE   LYS  70          2HE       LYS  70 -12.726  -1.037   3.073
  522   1HZ   LYS  70          1HZ       LYS  70 -12.277  -2.250   5.000
  523   2HZ   LYS  70          2HZ       LYS  70 -12.229  -3.734   4.258
  524   3HZ   LYS  70          3HZ       LYS  70 -13.699  -2.909   4.428
  525    H    TYR  71           H        TYR  71 -11.206  -6.329  -0.699
  526    HA   TYR  71           HA       TYR  71 -13.607  -7.185  -2.195
  527   1HB   TYR  71          1HB       TYR  71 -10.964  -6.135  -3.275
  528   2HB   TYR  71          2HB       TYR  71 -12.398  -6.476  -4.227
  529    HD1  TYR  71           1HD      TYR  71 -13.818  -5.171  -1.481
  530    HD2  TYR  71           2HD      TYR  71 -11.275  -3.902  -4.620
  531    HE1  TYR  71           1HE      TYR  71 -14.537  -2.954  -1.072
  532    HE2  TYR  71           2HE      TYR  71 -11.995  -1.572  -4.257
  533    HH   TYR  71           HH       TYR  71 -13.997  -0.440  -3.312
  534    H    CYS  72           H        CYS  72 -10.418  -8.232  -1.422
  535    HA   CYS  72           HA       CYS  72 -10.443 -10.423  -3.332
  536   1HB   CYS  72          1HB       CYS  72  -8.473  -9.263  -1.435
  537   2HB   CYS  72          2HB       CYS  72  -8.092 -10.804  -2.087
  538    HG   CYS  72           HG       CYS  72  -7.032  -9.832  -4.266
  539    H    LYS  73           H        LYS  73 -10.174  -9.807   0.124
  540    HA   LYS  73           HA       LYS  73 -10.863 -10.880   1.944
  541   1HB   LYS  73          1HB       LYS  73 -12.344 -12.650   0.005
  542   2HB   LYS  73          2HB       LYS  73 -12.564 -12.684   1.753
  543   1HG   LYS  73          1HG       LYS  73 -13.630 -10.645   1.801
  544   2HG   LYS  73          2HG       LYS  73 -12.869 -10.098   0.306
  545   1HD   LYS  73          1HD       LYS  73 -14.170 -11.574  -0.966
  546   2HD   LYS  73          2HD       LYS  73 -14.953 -12.276   0.469
  547   1HE   LYS  73          1HE       LYS  73 -15.872 -10.012   0.948
  548   2HE   LYS  73          2HE       LYS  73 -15.140  -9.431  -0.546
  549   1HZ   LYS  73          1HZ       LYS  73 -16.489 -11.056  -1.756
  550   2HZ   LYS  73          2HZ       LYS  73 -17.412  -9.924  -0.930
  551   3HZ   LYS  73          3HZ       LYS  73 -17.274 -11.486  -0.314
  552    H    ASN  74           H        ASN  74  -9.577 -12.917  -0.568
  553    HA   ASN  74           HA       ASN  74  -8.347 -14.659   1.430
  554   1HB   ASN  74          1HB       ASN  74  -8.166 -14.863  -1.595
  555   2HB   ASN  74          2HB       ASN  74  -7.591 -16.046  -0.436
  556   1HD2  ASN  74          1HD2      ASN  74 -10.287 -14.849  -2.188
  557   2HD2  ASN  74          2HD2      ASN  74 -11.417 -16.026  -1.642
  558    HA   PRO  75           HA       PRO  75  -4.830 -11.876   0.955
  559   1HB   PRO  75          1HB       PRO  75  -3.346 -12.982   2.785
  560   2HB   PRO  75          2HB       PRO  75  -4.521 -11.684   3.043
  561   1HG   PRO  75          1HG       PRO  75  -4.732 -14.691   3.634
  562   2HG   PRO  75          2HG       PRO  75  -5.483 -13.392   4.560
  563   1HD   PRO  75          1HD       PRO  75  -6.775 -14.977   2.762
  564   2HD   PRO  75          2HD       PRO  75  -7.305 -13.334   3.173
  565    H    GLU  76           H        GLU  76  -5.026 -15.059   0.583
  566    HA   GLU  76           HA       GLU  76  -2.427 -15.812  -0.141
  567   1HB   GLU  76          1HB       GLU  76  -4.417 -17.290   0.305
  568   2HB   GLU  76          2HB       GLU  76  -5.054 -16.811  -1.252
  569   1HG   GLU  76          1HG       GLU  76  -3.141 -17.859  -2.345
  570   2HG   GLU  76          2HG       GLU  76  -2.519 -18.348  -0.763
  571    H    ASP  77           H        ASP  77  -4.422 -13.583  -1.293
  572    HA   ASP  77           HA       ASP  77  -3.357 -13.441  -4.080
  573   1HB   ASP  77          1HB       ASP  77  -5.837 -13.799  -3.894
  574   2HB   ASP  77          2HB       ASP  77  -5.940 -12.310  -2.969
  575    H    LEU  78           H        LEU  78  -3.036 -12.182  -0.980
  576    HA   LEU  78           HA       LEU  78  -2.999  -9.412  -1.624
  577   1HB   LEU  78          1HB       LEU  78  -3.943 -10.219   0.439
  578   2HB   LEU  78          2HB       LEU  78  -2.441 -11.086   0.756
  579    HG   LEU  78           HG       LEU  78  -1.343  -8.961   0.889
  580   1HD1  LEU  78          1HD1      LEU  78  -4.158  -7.903   0.949
  581   2HD1  LEU  78          2HD1      LEU  78  -2.894  -7.452  -0.212
  582   3HD1  LEU  78          3HD1      LEU  78  -2.762  -7.004   1.503
  583   1HD2  LEU  78          1HD2      LEU  78  -1.826 -10.160   2.804
  584   2HD2  LEU  78          2HD2      LEU  78  -3.476  -9.515   2.878
  585   3HD2  LEU  78          3HD2      LEU  78  -2.075  -8.443   3.120
  586    H    GLU  79           H        GLU  79  -1.366  -9.048  -2.866
  587    HA   GLU  79           HA       GLU  79   1.458  -9.406  -2.068
  588   1HB   GLU  79          1HB       GLU  79   0.751 -11.153  -3.728
  589   2HB   GLU  79          2HB       GLU  79   0.041  -9.821  -4.641
  590   1HG   GLU  79          1HG       GLU  79   1.963 -10.503  -5.708
  591   2HG   GLU  79          2HG       GLU  79   2.218  -8.902  -5.050
  592    H    CYS  80           H        CYS  80   2.585  -7.622  -2.742
  593    HA   CYS  80           HA       CYS  80   0.953  -5.397  -3.664
  594   1HB   CYS  80          1HB       CYS  80   2.434  -4.733  -1.897
  595   2HB   CYS  80          2HB       CYS  80   3.843  -5.452  -2.621
  596    HG   CYS  80           HG       CYS  80   4.623  -3.224  -3.605
  597    H    ASN  81           H        ASN  81   0.516  -6.497  -5.505
  598    HA   ASN  81           HA       ASN  81   2.743  -6.941  -7.199
  599   1HB   ASN  81          1HB       ASN  81   1.248  -8.283  -8.657
  600   2HB   ASN  81          2HB       ASN  81   1.100  -8.781  -6.969
  601   1HD2  ASN  81          1HD2      ASN  81  -0.834  -8.408  -5.993
  602   2HD2  ASN  81          2HD2      ASN  81  -2.249  -7.896  -6.823
  603    H    GLU  82           H        GLU  82   1.802  -6.716  -9.640
  604    HA   GLU  82           HA       GLU  82   1.876  -4.246 -10.446
  605   1HB   GLU  82          1HB       GLU  82   0.587  -6.627 -11.404
  606   2HB   GLU  82          2HB       GLU  82   0.718  -5.250 -12.534
  607   1HG   GLU  82          1HG       GLU  82   2.930  -6.681 -11.096
  608   2HG   GLU  82          2HG       GLU  82   2.574  -6.903 -12.825
  609    H    ASN  83           H        ASN  83  -1.094  -6.195 -10.247
  610    HA   ASN  83           HA       ASN  83  -3.187  -4.449 -10.821
  611   1HB   ASN  83          1HB       ASN  83  -3.050  -6.604  -8.676
  612   2HB   ASN  83          2HB       ASN  83  -4.553  -5.824  -9.170
  613   1HD2  ASN  83          1HD2      ASN  83  -3.891  -8.583  -9.137
  614   2HD2  ASN  83          2HD2      ASN  83  -3.975  -9.174 -10.748
  615    H    VAL  84           H        VAL  84  -1.601  -5.239  -7.738
  616    HA   VAL  84           HA       VAL  84  -3.210  -3.507  -6.328
  617    HB   VAL  84           HB       VAL  84  -0.580  -4.762  -5.596
  618   1HG1  VAL  84          1HG1      VAL  84  -1.065  -4.182  -3.297
  619   2HG1  VAL  84          2HG1      VAL  84  -2.505  -3.280  -3.788
  620   3HG1  VAL  84          3HG1      VAL  84  -0.893  -2.719  -4.261
  621   1HG2  VAL  84          1HG2      VAL  84  -1.991  -6.186  -4.273
  622   2HG2  VAL  84          2HG2      VAL  84  -2.446  -6.220  -5.981
  623   3HG2  VAL  84          3HG2      VAL  84  -3.412  -5.302  -4.820
  624    H    LYS  85           H        LYS  85   0.035  -3.155  -7.550
  625    HA   LYS  85           HA       LYS  85   0.690  -0.555  -6.669
  626   1HB   LYS  85          1HB       LYS  85   1.288  -1.780  -9.343
  627   2HB   LYS  85          2HB       LYS  85   2.064  -0.355  -8.673
  628   1HG   LYS  85          1HG       LYS  85   3.030  -1.646  -6.929
  629   2HG   LYS  85          2HG       LYS  85   2.147  -3.082  -7.464
  630   1HD   LYS  85          1HD       LYS  85   3.272  -2.826  -9.676
  631   2HD   LYS  85          2HD       LYS  85   4.283  -1.584  -8.930
  632   1HE   LYS  85          1HE       LYS  85   5.045  -3.116  -7.310
  633   2HE   LYS  85          2HE       LYS  85   3.931  -4.344  -7.935
  634   1HZ   LYS  85          1HZ       LYS  85   5.127  -4.303 -10.031
  635   2HZ   LYS  85          2HZ       LYS  85   6.184  -4.714  -8.783
  636   3HZ   LYS  85          3HZ       LYS  85   6.219  -3.157  -9.430
  637    H    HIS  86           H        HIS  86  -0.966  -1.612  -9.495
  638    HA   HIS  86           HA       HIS  86  -1.387   0.738 -10.863
  639   1HB   HIS  86          1HB       HIS  86  -1.971  -1.476 -11.760
  640   2HB   HIS  86          2HB       HIS  86  -3.306  -1.596 -10.630
  641    HD1  HIS  86           1HD      HIS  86  -5.393  -1.409 -11.942
  642    HD2  HIS  86           2HD      HIS  86  -2.466   1.193 -13.261
  643    HE1  HIS  86           1HE      HIS  86  -6.444  -0.191 -13.848
  644    H    LYS  87           H        LYS  87  -3.493  -0.833  -8.637
  645    HA   LYS  87           HA       LYS  87  -5.512   1.218  -8.342
  646   1HB   LYS  87          1HB       LYS  87  -4.681  -0.838  -6.337
  647   2HB   LYS  87          2HB       LYS  87  -6.204   0.023  -6.378
  648   1HG   LYS  87          1HG       LYS  87  -6.802  -1.178  -8.449
  649   2HG   LYS  87          2HG       LYS  87  -5.283  -2.077  -8.333
  650   1HD   LYS  87          1HD       LYS  87  -7.392  -1.977  -6.227
  651   2HD   LYS  87          2HD       LYS  87  -7.244  -3.297  -7.398
  652   1HE   LYS  87          1HE       LYS  87  -5.097  -3.923  -6.513
  653   2HE   LYS  87          2HE       LYS  87  -5.016  -2.510  -5.460
  654   1HZ   LYS  87          1HZ       LYS  87  -5.536  -4.391  -4.178
  655   2HZ   LYS  87          2HZ       LYS  87  -6.779  -4.885  -5.200
  656   3HZ   LYS  87          3HZ       LYS  87  -6.944  -3.467  -4.269
  657    H    THR  88           H        THR  88  -2.553   0.653  -6.765
  658    HA   THR  88           HA       THR  88  -3.161   2.299  -4.576
  659    HB   THR  88           HB       THR  88  -0.732   1.006  -5.642
  660    HG1  THR  88           1HG      THR  88  -2.000  -0.451  -4.744
  661   1HG2  THR  88          1HG2      THR  88   0.356   1.651  -3.538
  662   2HG2  THR  88          2HG2      THR  88  -1.074   2.654  -3.149
  663   3HG2  THR  88          3HG2      THR  88  -0.086   3.005  -4.588
  664    H    LYS  89           H        LYS  89  -0.812   2.658  -7.188
  665    HA   LYS  89           HA       LYS  89  -0.301   5.164  -6.307
  666   1HB   LYS  89          1HB       LYS  89   0.764   5.509  -8.685
  667   2HB   LYS  89          2HB       LYS  89   1.472   4.463  -7.471
  668   1HG   LYS  89          1HG       LYS  89   1.542   3.327  -9.597
  669   2HG   LYS  89          2HG       LYS  89   0.335   2.567  -8.532
  670   1HD   LYS  89          1HD       LYS  89  -1.290   3.181  -9.632
  671   2HD   LYS  89          2HD       LYS  89  -0.589   4.647 -10.375
  672   1HE   LYS  89          1HE       LYS  89   0.109   1.778 -11.031
  673   2HE   LYS  89          2HE       LYS  89  -0.978   2.767 -12.042
  674   1HZ   LYS  89          1HZ       LYS  89   1.912   3.125 -11.488
  675   2HZ   LYS  89          2HZ       LYS  89   0.987   4.223 -12.371
  676   3HZ   LYS  89          3HZ       LYS  89   1.216   2.652 -12.940
  677    H    GLU  90           H        GLU  90  -2.582   4.028  -8.697
  678    HA   GLU  90           HA       GLU  90  -3.452   6.592  -9.579
  679   1HB   GLU  90          1HB       GLU  90  -5.051   4.060  -9.405
  680   2HB   GLU  90          2HB       GLU  90  -5.607   5.522 -10.200
  681   1HG   GLU  90          1HG       GLU  90  -3.625   5.329 -11.724
  682   2HG   GLU  90          2HG       GLU  90  -3.324   3.744 -11.006
  683    H    TYR  91           H        TYR  91  -4.213   4.710  -6.706
  684    HA   TYR  91           HA       TYR  91  -6.526   6.195  -5.999
  685   1HB   TYR  91          1HB       TYR  91  -6.488   4.076  -4.998
  686   2HB   TYR  91          2HB       TYR  91  -4.781   4.187  -4.605
  687    HD1  TYR  91           1HD      TYR  91  -4.261   4.408  -2.409
  688    HD2  TYR  91           2HD      TYR  91  -7.987   5.944  -3.745
  689    HE1  TYR  91           1HE      TYR  91  -4.790   5.002  -0.132
  690    HE2  TYR  91           2HE      TYR  91  -8.562   6.557  -1.434
  691    HH   TYR  91           HH       TYR  91  -6.276   6.581   1.066
  692    H    ILE  92           H        ILE  92  -3.182   5.973  -5.009
  693    HA   ILE  92           HA       ILE  92  -2.945   8.011  -3.166
  694    HB   ILE  92           HB       ILE  92  -1.008   7.125  -5.295
  695   1HG1  ILE  92          1HG1      ILE  92  -1.961   5.703  -3.310
  696   2HG1  ILE  92          2HG1      ILE  92  -0.255   5.471  -3.805
  697   1HG2  ILE  92          1HG2      ILE  92  -0.444   9.351  -4.581
  698   2HG2  ILE  92          2HG2      ILE  92   0.781   8.212  -3.981
  699   3HG2  ILE  92          3HG2      ILE  92  -0.468   8.854  -2.895
  700   1HD1  ILE  92          1HD1      ILE  92   0.224   7.051  -1.948
  701   2HD1  ILE  92          2HD1      ILE  92  -0.509   5.507  -1.460
  702   3HD1  ILE  92          3HD1      ILE  92  -1.511   6.976  -1.591
  703    H    LYS  93           H        LYS  93  -2.371   8.381  -6.654
  704    HA   LYS  93           HA       LYS  93  -2.000  11.157  -6.374
  705   1HB   LYS  93          1HB       LYS  93  -2.283  11.366  -8.775
  706   2HB   LYS  93          2HB       LYS  93  -1.282   9.969  -8.438
  707   1HG   LYS  93          1HG       LYS  93  -3.113   8.492  -8.917
  708   2HG   LYS  93          2HG       LYS  93  -4.214   9.856  -9.104
  709   1HD   LYS  93          1HD       LYS  93  -2.782  10.666 -10.983
  710   2HD   LYS  93          2HD       LYS  93  -1.842   9.181 -10.845
  711   1HE   LYS  93          1HE       LYS  93  -3.789   7.848 -11.363
  712   2HE   LYS  93          2HE       LYS  93  -4.810   9.280 -11.359
  713   1HZ   LYS  93          1HZ       LYS  93  -3.575  10.112 -13.268
  714   2HZ   LYS  93          2HZ       LYS  93  -4.256   8.605 -13.591
  715   3HZ   LYS  93          3HZ       LYS  93  -2.610   8.726 -13.277
  716    H    LYS  94           H        LYS  94  -4.915   9.277  -6.923
  717    HA   LYS  94           HA       LYS  94  -6.415  11.610  -7.464
  718   1HB   LYS  94          1HB       LYS  94  -7.091   9.362  -8.233
  719   2HB   LYS  94          2HB       LYS  94  -7.371   8.886  -6.566
  720   1HG   LYS  94          1HG       LYS  94  -9.118  10.614  -6.406
  721   2HG   LYS  94          2HG       LYS  94  -8.875  10.970  -8.116
  722   1HD   LYS  94          1HD       LYS  94  -9.408   8.606  -8.631
  723   2HD   LYS  94          2HD       LYS  94  -9.769   8.356  -6.925
  724   1HE   LYS  94          1HE       LYS  94 -11.813   8.759  -8.143
  725   2HE   LYS  94          2HE       LYS  94 -11.485  10.099  -7.051
  726   1HZ   LYS  94          1HZ       LYS  94 -10.721  11.433  -8.862
  727   2HZ   LYS  94          2HZ       LYS  94 -12.198  10.765  -9.335
  728   3HZ   LYS  94          3HZ       LYS  94 -10.772  10.129  -9.917
  729    H    TYR  95           H        TYR  95  -5.641   9.746  -4.640
  730    HA   TYR  95           HA       TYR  95  -7.362  10.987  -2.826
  731   1HB   TYR  95          1HB       TYR  95  -6.317   8.917  -2.342
  732   2HB   TYR  95          2HB       TYR  95  -4.724   9.640  -2.615
  733    HD1  TYR  95           1HD      TYR  95  -7.747   9.760  -0.432
  734    HD2  TYR  95           2HD      TYR  95  -3.616  10.638  -0.780
  735    HE1  TYR  95           1HE      TYR  95  -7.718  10.484   1.931
  736    HE2  TYR  95           2HE      TYR  95  -3.588  11.392   1.558
  737    HH   TYR  95           HH       TYR  95  -6.165  10.895   3.791
  738    H    MET  96           H        MET  96  -3.979  11.680  -3.584
  739    HA   MET  96           HA       MET  96  -3.873  13.833  -1.816
  740   1HB   MET  96          1HB       MET  96  -2.114  13.373  -4.184
  741   2HB   MET  96          2HB       MET  96  -1.775  14.396  -2.788
  742   1HG   MET  96          1HG       MET  96  -2.230  12.163  -1.456
  743   2HG   MET  96          2HG       MET  96  -1.811  11.444  -3.020
  744   1HE   MET  96          1HE       MET  96  -0.378  14.678  -1.559
  745   2HE   MET  96          2HE       MET  96   0.902  14.054  -0.490
  746   3HE   MET  96          3HE       MET  96  -0.813  13.674  -0.170
  747    H    GLN  97           H        GLN  97  -5.038  13.616  -4.970
  748    HA   GLN  97           HA       GLN  97  -4.918  16.377  -5.681
  749   1HB   GLN  97          1HB       GLN  97  -7.187  14.601  -6.591
  750   2HB   GLN  97          2HB       GLN  97  -6.563  16.029  -7.390
  751   1HG   GLN  97          1HG       GLN  97  -5.318  13.318  -7.178
  752   2HG   GLN  97          2HG       GLN  97  -5.850  14.148  -8.630
  753   1HE2  GLN  97          1HE2      GLN  97  -3.419  13.714  -6.307
  754   2HE2  GLN  97          2HE2      GLN  97  -2.149  14.618  -7.008
  755    H    LYS  98           H        LYS  98  -6.846  14.770  -3.399
  756    HA   LYS  98           HA       LYS  98  -8.967  16.673  -3.406
  757   1HB   LYS  98          1HB       LYS  98  -9.947  15.546  -1.567
  758   2HB   LYS  98          2HB       LYS  98  -9.181  14.300  -2.523
  759   1HG   LYS  98          1HG       LYS  98  -8.107  13.562  -0.704
  760   2HG   LYS  98          2HG       LYS  98  -7.304  15.124  -0.540
  761   1HD   LYS  98          1HD       LYS  98 -10.045  14.453   0.587
  762   2HD   LYS  98          2HD       LYS  98  -8.537  14.451   1.496
  763   1HE   LYS  98          1HE       LYS  98  -8.243  16.742   1.309
  764   2HE   LYS  98          2HE       LYS  98  -9.378  16.899  -0.021
  765   1HZ   LYS  98          1HZ       LYS  98 -11.179  16.495   1.544
  766   2HZ   LYS  98          2HZ       LYS  98 -10.205  17.800   2.019
  767   3HZ   LYS  98          3HZ       LYS  98 -10.074  16.323   2.819
  768    H    PHE  99           H        PHE  99  -5.885  16.471  -1.835
  769    HA   PHE  99           HA       PHE  99  -6.524  18.312   0.254
  770   1HB   PHE  99          1HB       PHE  99  -3.818  17.472  -0.814
  771   2HB   PHE  99          2HB       PHE  99  -4.071  18.523   0.572
  772    HD1  PHE  99           1HD      PHE  99  -5.657  17.491   2.457
  773    HD2  PHE  99           2HD      PHE  99  -3.425  15.259  -0.418
  774    HE1  PHE  99           1HE      PHE  99  -5.623  15.556   3.973
  775    HE2  PHE  99           2HE      PHE  99  -3.424  13.308   1.138
  776    HZ   PHE  99           HZ       PHE  99  -4.559  13.470   3.272
  777    H    GLY 100           H        GLY 100  -5.143  18.537  -2.956
  778   1HA   GLY 100          1HA       GLY 100  -5.635  20.410  -4.298
  779   2HA   GLY 100          2HA       GLY 100  -5.581  21.405  -2.841
  780    H    ALA 101           H        ALA 101  -3.900  22.590  -2.770
  781    HA   ALA 101           HA       ALA 101  -1.559  21.990  -4.331
  782   1HB   ALA 101          1HB       ALA 101  -2.384  24.271  -4.108
  783   2HB   ALA 101          2HB       ALA 101  -0.722  24.116  -3.525
  784   3HB   ALA 101          3HB       ALA 101  -2.062  24.212  -2.374
  785    H    VAL 102           H        VAL 102  -2.357  22.047  -0.874
  786    HA   VAL 102           HA       VAL 102   0.243  20.789  -0.439
  787    HB   VAL 102           HB       VAL 102  -1.103  22.170   1.812
  788   1HG1  VAL 102          1HG1      VAL 102   1.139  22.709   2.569
  789   2HG1  VAL 102          2HG1      VAL 102   1.782  21.932   1.120
  790   3HG1  VAL 102          3HG1      VAL 102   0.875  20.982   2.301
  791   1HG2  VAL 102          1HG2      VAL 102   0.388  23.754  -0.267
  792   2HG2  VAL 102          2HG2      VAL 102  -0.086  24.364   1.326
  793   3HG2  VAL 102          3HG2      VAL 102  -1.321  23.883   0.156
  794    H    TYR 103           H        TYR 103   0.290  19.271   1.203
  795    HA   TYR 103           HA       TYR 103  -2.144  17.788   1.409
  796   1HB   TYR 103          1HB       TYR 103  -0.401  16.349   0.837
  797   2HB   TYR 103          2HB       TYR 103   0.750  17.213   1.837
  798    HD1  TYR 103           1HD      TYR 103  -2.487  15.832   2.985
  799    HD2  TYR 103           2HD      TYR 103   1.688  15.369   2.952
  800    HE1  TYR 103           1HE      TYR 103  -2.693  14.130   4.671
  801    HE2  TYR 103           2HE      TYR 103   1.507  13.595   4.679
  802    HH   TYR 103           HH       TYR 103   0.055  12.973   6.402
  803    H    LYS 104           H        LYS 104  -3.370  18.580   2.806
  804    HA   LYS 104           HA       LYS 104  -2.429  19.141   5.529
  805   1HB   LYS 104          1HB       LYS 104  -4.867  20.089   4.053
  806   2HB   LYS 104          2HB       LYS 104  -4.571  20.436   5.745
  807   1HG   LYS 104          1HG       LYS 104  -2.565  21.699   5.160
  808   2HG   LYS 104          2HG       LYS 104  -2.778  21.277   3.462
  809   1HD   LYS 104          1HD       LYS 104  -4.755  22.866   5.100
  810   2HD   LYS 104          2HD       LYS 104  -3.557  23.571   4.018
  811   1HE   LYS 104          1HE       LYS 104  -4.555  22.404   2.128
  812   2HE   LYS 104          2HE       LYS 104  -5.728  21.640   3.190
  813   1HZ   LYS 104          1HZ       LYS 104  -5.513  24.564   2.705
  814   2HZ   LYS 104          2HZ       LYS 104  -6.657  23.802   3.694
  815   3HZ   LYS 104          3HZ       LYS 104  -6.661  23.529   2.040
  816    HA   PRO 105           HA       PRO 105  -4.622  15.100   5.825
  817   1HB   PRO 105          1HB       PRO 105  -3.578  14.497   8.305
  818   2HB   PRO 105          2HB       PRO 105  -2.830  14.070   6.768
  819   1HG   PRO 105          1HG       PRO 105  -2.298  16.322   8.587
  820   2HG   PRO 105          2HG       PRO 105  -1.129  15.344   7.633
  821   1HD   PRO 105          1HD       PRO 105  -1.897  17.870   7.031
  822   2HD   PRO 105          2HD       PRO 105  -1.468  16.695   5.770
  823    H    LYS 106           H        LYS 106  -4.463  17.654   8.172
  824    HA   LYS 106           HA       LYS 106  -6.622  17.199   9.791
  825   1HB   LYS 106          1HB       LYS 106  -5.967  19.792   8.407
  826   2HB   LYS 106          2HB       LYS 106  -6.975  19.656   9.844
  827   1HG   LYS 106          1HG       LYS 106  -5.028  18.923  11.117
  828   2HG   LYS 106          2HG       LYS 106  -4.045  18.996   9.650
  829   1HD   LYS 106          1HD       LYS 106  -4.482  21.380   9.463
  830   2HD   LYS 106          2HD       LYS 106  -5.480  21.328  10.923
  831   1HE   LYS 106          1HE       LYS 106  -3.499  20.605  12.204
  832   2HE   LYS 106          2HE       LYS 106  -2.538  20.702  10.727
  833   1HZ   LYS 106          1HZ       LYS 106  -3.918  22.978  12.038
  834   2HZ   LYS 106          2HZ       LYS 106  -2.993  23.078  10.640
  835   3HZ   LYS 106          3HZ       LYS 106  -2.264  22.661  12.101
  836    H    GLU 107           H        GLU 107  -6.768  17.744   6.427
  837    HA   GLU 107           HA       GLU 107  -9.695  17.676   6.689
  838   1HB   GLU 107          1HB       GLU 107  -9.920  18.833   4.653
  839   2HB   GLU 107          2HB       GLU 107  -8.625  19.586   5.607
  840   1HG   GLU 107          1HG       GLU 107  -6.973  18.767   4.257
  841   2HG   GLU 107          2HG       GLU 107  -8.087  17.633   3.474
  842    H    ASP 108           H        ASP 108  -7.593  15.474   6.540
  843    HA   ASP 108           HA       ASP 108  -8.005  14.085   4.157
  844   1HB   ASP 108          1HB       ASP 108  -6.148  13.176   5.062
  845   2HB   ASP 108          2HB       ASP 108  -6.603  13.663   6.679
  846    H    THR 109           H        THR 109  -8.873  11.833   4.210
  847    HA   THR 109           HA       THR 109 -11.623  12.138   3.883
  848    HB   THR 109           HB       THR 109 -10.142  10.821   2.481
  849    HG1  THR 109           1HG      THR 109 -11.524   9.203   2.047
  850   1HG2  THR 109          1HG2      THR 109  -9.305   8.629   3.192
  851   2HG2  THR 109          2HG2      THR 109 -10.026   8.896   4.788
  852   3HG2  THR 109          3HG2      THR 109  -8.730   9.947   4.231
  Start of MODEL    8
    1    H    THR  10           H        THR  10  -2.779 -23.360   2.662
    2    HA   THR  10           HA       THR  10  -2.564 -22.822   5.486
    3    HB   THR  10           HB       THR  10  -0.153 -22.410   4.800
    4    HG1  THR  10           1HG      THR  10  -0.985 -22.154   2.450
    5   1HG2  THR  10          1HG2      THR  10  -0.903 -24.551   5.748
    6   2HG2  THR  10          2HG2      THR  10   0.296 -24.820   4.481
    7   3HG2  THR  10          3HG2      THR  10  -1.415 -25.081   4.147
    8    H    SER  11           H        SER  11  -4.183 -20.889   3.801
    9    HA   SER  11           HA       SER  11  -2.439 -18.610   3.349
   10   1HB   SER  11          1HB       SER  11  -5.383 -18.671   3.409
   11   2HB   SER  11          2HB       SER  11  -4.340 -17.545   2.519
   12    HG   SER  11           HG       SER  11  -5.248 -20.037   1.900
   13    H    SER  12           H        SER  12  -4.207 -19.801   5.927
   14    HA   SER  12           HA       SER  12  -4.611 -17.419   7.244
   15   1HB   SER  12          1HB       SER  12  -4.619 -18.975   9.210
   16   2HB   SER  12          2HB       SER  12  -5.682 -19.375   7.846
   17    HG   SER  12           HG       SER  12  -4.432 -21.178   8.707
   18    H    GLU  13           H        GLU  13  -1.788 -19.838   7.421
   19    HA   GLU  13           HA       GLU  13  -0.470 -18.120   9.053
   20   1HB   GLU  13          1HB       GLU  13   1.315 -19.952   8.789
   21   2HB   GLU  13          2HB       GLU  13  -0.235 -20.433   9.469
   22   1HG   GLU  13          1HG       GLU  13  -0.926 -21.411   7.382
   23   2HG   GLU  13          2HG       GLU  13   0.460 -20.751   6.555
   24    H    LEU  14           H        LEU  14  -0.371 -18.992   5.663
   25    HA   LEU  14           HA       LEU  14   2.092 -18.006   4.810
   26   1HB   LEU  14          1HB       LEU  14   0.322 -19.294   3.554
   27   2HB   LEU  14          2HB       LEU  14  -0.522 -17.792   3.378
   28    HG   LEU  14           HG       LEU  14   1.350 -16.827   2.103
   29   1HD1  LEU  14          1HD1      LEU  14   2.511 -19.598   2.281
   30   2HD1  LEU  14          2HD1      LEU  14   3.191 -18.130   2.985
   31   3HD1  LEU  14          3HD1      LEU  14   3.101 -18.312   1.235
   32   1HD2  LEU  14          1HD2      LEU  14  -0.528 -17.854   0.937
   33   2HD2  LEU  14          2HD2      LEU  14   0.282 -19.421   0.992
   34   3HD2  LEU  14          3HD2      LEU  14   0.975 -18.101   0.050
   35    H    ALA  15           H        ALA  15  -0.807 -16.600   5.509
   36    HA   ALA  15           HA       ALA  15  -0.016 -14.051   4.417
   37   1HB   ALA  15          1HB       ALA  15  -2.204 -14.705   3.780
   38   2HB   ALA  15          2HB       ALA  15  -2.251 -13.222   4.740
   39   3HB   ALA  15          3HB       ALA  15  -2.699 -14.767   5.465
   40    H    LYS  16           H        LYS  16   0.108 -15.536   7.400
   41    HA   LYS  16           HA       LYS  16  -0.099 -13.189   8.974
   42   1HB   LYS  16          1HB       LYS  16  -0.047 -15.304  10.172
   43   2HB   LYS  16          2HB       LYS  16   1.460 -15.771   9.398
   44   1HG   LYS  16          1HG       LYS  16   1.864 -15.167  11.713
   45   2HG   LYS  16          2HG       LYS  16   2.636 -14.004  10.646
   46   1HD   LYS  16          1HD       LYS  16   1.697 -12.548  12.141
   47   2HD   LYS  16          2HD       LYS  16   0.341 -12.703  11.035
   48   1HE   LYS  16          1HE       LYS  16   0.698 -14.258  13.606
   49   2HE   LYS  16          2HE       LYS  16  -0.319 -12.842  13.408
   50   1HZ   LYS  16          1HZ       LYS  16  -0.714 -15.495  12.107
   51   2HZ   LYS  16          2HZ       LYS  16  -1.660 -14.147  11.811
   52   3HZ   LYS  16          3HZ       LYS  16  -1.621 -14.826  13.342
   53    H    LYS  17           H        LYS  17   2.355 -14.770   7.091
   54    HA   LYS  17           HA       LYS  17   4.280 -12.697   7.561
   55   1HB   LYS  17          1HB       LYS  17   4.356 -15.002   5.596
   56   2HB   LYS  17          2HB       LYS  17   5.665 -13.864   5.843
   57   1HG   LYS  17          1HG       LYS  17   6.283 -15.787   7.042
   58   2HG   LYS  17          2HG       LYS  17   5.698 -14.668   8.267
   59   1HD   LYS  17          1HD       LYS  17   3.539 -15.842   8.283
   60   2HD   LYS  17          2HD       LYS  17   4.141 -16.959   7.057
   61   1HE   LYS  17          1HE       LYS  17   5.958 -17.597   8.655
   62   2HE   LYS  17          2HE       LYS  17   5.169 -16.595   9.865
   63   1HZ   LYS  17          1HZ       LYS  17   3.979 -18.950   8.526
   64   2HZ   LYS  17          2HZ       LYS  17   3.195 -18.001   9.686
   65   3HZ   LYS  17          3HZ       LYS  17   4.551 -18.897  10.100
   66    H    SER  18           H        SER  18   2.139 -13.677   4.856
   67    HA   SER  18           HA       SER  18   3.282 -11.975   3.007
   68   1HB   SER  18          1HB       SER  18   1.771 -13.896   2.410
   69   2HB   SER  18          2HB       SER  18   0.402 -12.894   2.893
   70    HG   SER  18           HG       SER  18   0.494 -11.925   1.018
   71    H    LYS  19           H        LYS  19   0.714 -11.143   5.328
   72    HA   LYS  19           HA       LYS  19   0.032  -8.646   4.010
   73   1HB   LYS  19          1HB       LYS  19  -0.208  -9.127   6.966
   74   2HB   LYS  19          2HB       LYS  19  -1.132  -8.024   5.976
   75   1HG   LYS  19          1HG       LYS  19  -2.142 -10.064   4.909
   76   2HG   LYS  19          2HG       LYS  19  -1.370 -10.989   6.194
   77   1HD   LYS  19          1HD       LYS  19  -2.452  -9.051   7.679
   78   2HD   LYS  19          2HD       LYS  19  -3.579  -9.045   6.319
   79   1HE   LYS  19          1HE       LYS  19  -4.367 -10.470   8.033
   80   2HE   LYS  19          2HE       LYS  19  -3.915 -11.417   6.597
   81   1HZ   LYS  19          1HZ       LYS  19  -1.821 -11.991   7.699
   82   2HZ   LYS  19          2HZ       LYS  19  -3.109 -12.477   8.670
   83   3HZ   LYS  19          3HZ       LYS  19  -2.250 -11.085   9.046
   84    H    GLU  20           H        GLU  20   2.482  -9.664   6.161
   85    HA   GLU  20           HA       GLU  20   3.237  -7.010   6.951
   86   1HB   GLU  20          1HB       GLU  20   4.954  -9.473   7.049
   87   2HB   GLU  20          2HB       GLU  20   5.046  -8.042   8.070
   88   1HG   GLU  20          1HG       GLU  20   2.801  -9.925   7.918
   89   2HG   GLU  20          2HG       GLU  20   4.039 -10.013   9.193
   90    H    VAL  21           H        VAL  21   4.493  -9.521   4.818
   91    HA   VAL  21           HA       VAL  21   6.599  -7.971   3.686
   92    HB   VAL  21           HB       VAL  21   5.014 -10.249   2.458
   93   1HG1  VAL  21          1HG1      VAL  21   7.000 -10.573   1.014
   94   2HG1  VAL  21          2HG1      VAL  21   7.759  -9.169   1.761
   95   3HG1  VAL  21          3HG1      VAL  21   6.297  -8.970   0.794
   96   1HG2  VAL  21          1HG2      VAL  21   6.027 -10.960   4.545
   97   2HG2  VAL  21          2HG2      VAL  21   7.595 -10.346   4.017
   98   3HG2  VAL  21          3HG2      VAL  21   6.858 -11.710   3.182
   99    H    PHE  22           H        PHE  22   3.222  -8.395   2.868
  100    HA   PHE  22           HA       PHE  22   3.249  -6.890   0.452
  101   1HB   PHE  22          1HB       PHE  22   1.330  -8.178   0.687
  102   2HB   PHE  22          2HB       PHE  22   1.153  -7.775   2.388
  103    HD1  PHE  22           1HD      PHE  22  -0.654  -6.462   2.908
  104    HD2  PHE  22           2HD      PHE  22   1.181  -5.988  -0.873
  105    HE1  PHE  22           1HE      PHE  22  -2.255  -4.720   2.373
  106    HE2  PHE  22           2HE      PHE  22  -0.454  -4.201  -1.425
  107    HZ   PHE  22           HZ       PHE  22  -2.203  -3.588   0.250
  108    H    ARG  23           H        ARG  23   2.290  -6.028   3.691
  109    HA   ARG  23           HA       ARG  23   1.854  -3.315   3.065
  110   1HB   ARG  23          1HB       ARG  23   1.671  -2.804   5.405
  111   2HB   ARG  23          2HB       ARG  23   1.039  -4.422   5.158
  112   1HG   ARG  23          1HG       ARG  23   2.256  -4.868   7.003
  113   2HG   ARG  23          2HG       ARG  23   3.545  -5.038   5.825
  114   1HD   ARG  23          1HD       ARG  23   4.361  -3.658   7.613
  115   2HD   ARG  23          2HD       ARG  23   4.146  -2.652   6.181
  116    HE   ARG  23           HE       ARG  23   1.896  -2.712   7.975
  117   1HH1  ARG  23          1HH1      ARG  23   4.859  -0.950   7.024
  118   2HH1  ARG  23          2HH1      ARG  23   4.474   0.417   7.948
  119   1HH2  ARG  23          1HH2      ARG  23   1.400  -0.763   9.210
  120   2HH2  ARG  23          2HH2      ARG  23   2.503   0.540   9.210
  121    H    LYS  24           H        LYS  24   4.846  -4.927   3.784
  122    HA   LYS  24           HA       LYS  24   6.382  -2.570   4.250
  123   1HB   LYS  24          1HB       LYS  24   7.208  -5.352   3.524
  124   2HB   LYS  24          2HB       LYS  24   8.334  -4.051   3.913
  125   1HG   LYS  24          1HG       LYS  24   7.410  -3.832   6.112
  126   2HG   LYS  24          2HG       LYS  24   6.147  -5.006   5.746
  127   1HD   LYS  24          1HD       LYS  24   7.695  -6.215   6.947
  128   2HD   LYS  24          2HD       LYS  24   8.045  -6.579   5.248
  129   1HE   LYS  24          1HE       LYS  24  10.128  -6.223   6.411
  130   2HE   LYS  24          2HE       LYS  24   9.848  -4.883   5.299
  131   1HZ   LYS  24          1HZ       LYS  24   9.350  -4.850   8.229
  132   2HZ   LYS  24          2HZ       LYS  24   9.074  -3.543   7.204
  133   3HZ   LYS  24          3HZ       LYS  24  10.637  -4.109   7.448
  134    H    GLU  25           H        GLU  25   5.846  -4.681   1.417
  135    HA   GLU  25           HA       GLU  25   7.620  -3.550  -0.398
  136   1HB   GLU  25          1HB       GLU  25   4.836  -4.465  -0.988
  137   2HB   GLU  25          2HB       GLU  25   6.192  -4.437  -2.091
  138   1HG   GLU  25          1HG       GLU  25   6.276  -6.037   0.352
  139   2HG   GLU  25          2HG       GLU  25   5.294  -6.500  -1.039
  140    H    MET  26           H        MET  26   4.248  -3.168   0.232
  141    HA   MET  26           HA       MET  26   3.758  -1.101  -1.596
  142   1HB   MET  26          1HB       MET  26   2.121  -2.695  -0.742
  143   2HB   MET  26          2HB       MET  26   2.228  -1.866   0.798
  144   1HG   MET  26          1HG       MET  26   0.252  -1.216  -0.773
  145   2HG   MET  26          2HG       MET  26   1.131   0.035   0.098
  146   1HE   MET  26          1HE       MET  26   0.047  -1.281  -3.401
  147   2HE   MET  26          2HE       MET  26   1.709  -1.904  -3.546
  148   3HE   MET  26          3HE       MET  26   1.170  -0.484  -4.484
  149    H    SER  27           H        SER  27   4.620  -1.027   1.753
  150    HA   SER  27           HA       SER  27   4.236   1.724   2.186
  151   1HB   SER  27          1HB       SER  27   6.325  -0.101   3.416
  152   2HB   SER  27          2HB       SER  27   6.090   1.572   3.918
  153    HG   SER  27           HG       SER  27   4.210  -0.536   4.012
  154    H    GLN  28           H        GLN  28   6.866  -0.143   0.847
  155    HA   GLN  28           HA       GLN  28   8.601   2.134   0.376
  156   1HB   GLN  28          1HB       GLN  28   8.533  -0.513  -1.096
  157   2HB   GLN  28          2HB       GLN  28   9.824   0.662  -1.174
  158   1HG   GLN  28          1HG       GLN  28  10.405   0.216   1.124
  159   2HG   GLN  28          2HG       GLN  28   9.036  -0.896   1.274
  160   1HE2  GLN  28          1HE2      GLN  28  10.367  -2.624   1.738
  161   2HE2  GLN  28          2HE2      GLN  28  11.351  -3.387   0.553
  162    H    PHE  29           H        PHE  29   6.394   0.383  -1.651
  163    HA   PHE  29           HA       PHE  29   6.787   1.869  -3.951
  164   1HB   PHE  29          1HB       PHE  29   5.642  -0.303  -3.930
  165   2HB   PHE  29          2HB       PHE  29   4.310   0.398  -3.026
  166    HD1  PHE  29           1HD      PHE  29   5.972   0.200  -6.270
  167    HD2  PHE  29           2HD      PHE  29   2.656   1.702  -4.096
  168    HE1  PHE  29           1HE      PHE  29   4.805   0.691  -8.376
  169    HE2  PHE  29           2HE      PHE  29   1.494   2.195  -6.208
  170    HZ   PHE  29           HZ       PHE  29   2.539   1.684  -8.304
  171    H    ILE  30           H        ILE  30   4.346   2.292  -1.408
  172    HA   ILE  30           HA       ILE  30   3.198   4.620  -2.477
  173    HB   ILE  30           HB       ILE  30   3.225   3.534   0.337
  174   1HG1  ILE  30          1HG1      ILE  30   1.002   3.782  -1.678
  175   2HG1  ILE  30          2HG1      ILE  30   2.027   2.364  -1.522
  176   1HG2  ILE  30          1HG2      ILE  30   1.510   5.204   0.909
  177   2HG2  ILE  30          2HG2      ILE  30   1.689   5.926  -0.696
  178   3HG2  ILE  30          3HG2      ILE  30   3.023   5.994   0.438
  179   1HD1  ILE  30          1HD1      ILE  30   0.225   3.465   0.620
  180   2HD1  ILE  30          2HD1      ILE  30   1.282   2.073   0.749
  181   3HD1  ILE  30          3HD1      ILE  30  -0.065   2.034  -0.368
  182    H    VAL  31           H        VAL  31   5.759   4.213  -0.036
  183    HA   VAL  31           HA       VAL  31   6.275   6.891   0.359
  184    HB   VAL  31           HB       VAL  31   8.051   4.462   0.347
  185   1HG1  VAL  31          1HG1      VAL  31   9.005   7.229   1.170
  186   2HG1  VAL  31          2HG1      VAL  31   9.470   6.438  -0.332
  187   3HG1  VAL  31          3HG1      VAL  31   9.940   5.733   1.214
  188   1HG2  VAL  31          1HG2      VAL  31   7.144   6.351   2.517
  189   2HG2  VAL  31          2HG2      VAL  31   8.086   4.878   2.776
  190   3HG2  VAL  31          3HG2      VAL  31   6.434   4.792   2.153
  191    H    GLN  32           H        GLN  32   7.503   4.817  -2.244
  192    HA   GLN  32           HA       GLN  32   9.071   6.555  -3.565
  193   1HB   GLN  32          1HB       GLN  32   8.840   4.165  -4.013
  194   2HB   GLN  32          2HB       GLN  32   7.255   4.436  -4.695
  195   1HG   GLN  32          1HG       GLN  32   8.344   5.862  -6.415
  196   2HG   GLN  32          2HG       GLN  32   9.895   5.286  -5.787
  197   1HE2  GLN  32          1HE2      GLN  32  10.440   3.100  -6.064
  198   2HE2  GLN  32          2HE2      GLN  32   9.629   2.087  -7.196
  199    H    CYS  33           H        CYS  33   5.629   5.872  -3.881
  200    HA   CYS  33           HA       CYS  33   4.947   7.596  -5.996
  201   1HB   CYS  33          1HB       CYS  33   3.377   6.347  -3.803
  202   2HB   CYS  33          2HB       CYS  33   2.615   7.216  -5.152
  203    HG   CYS  33           HG       CYS  33   4.329   4.303  -5.102
  204    H    LEU  34           H        LEU  34   4.953   8.041  -2.547
  205    HA   LEU  34           HA       LEU  34   3.768  10.656  -2.668
  206   1HB   LEU  34          1HB       LEU  34   5.171   9.293  -0.402
  207   2HB   LEU  34          2HB       LEU  34   4.363  10.837  -0.279
  208    HG   LEU  34           HG       LEU  34   3.090   8.183  -0.858
  209   1HD1  LEU  34          1HD1      LEU  34   3.787   8.519   1.450
  210   2HD1  LEU  34          2HD1      LEU  34   2.028   8.564   1.326
  211   3HD1  LEU  34          3HD1      LEU  34   2.940  10.061   1.501
  212   1HD2  LEU  34          1HD2      LEU  34   0.962   9.400  -0.698
  213   2HD2  LEU  34          2HD2      LEU  34   1.923   9.908  -2.079
  214   3HD2  LEU  34          3HD2      LEU  34   1.850  10.922  -0.637
  215    H    ASN  35           H        ASN  35   7.033   9.467  -2.730
  216    HA   ASN  35           HA       ASN  35   8.547  11.443  -2.088
  217   1HB   ASN  35          1HB       ASN  35   8.805   9.438  -4.077
  218   2HB   ASN  35          2HB       ASN  35   9.778  10.883  -4.456
  219   1HD2  ASN  35          1HD2      ASN  35   8.860   8.708  -1.950
  220   2HD2  ASN  35          2HD2      ASN  35  10.239   8.994  -0.998
  221    HA   PRO  36           HA       PRO  36   8.022  14.214  -6.043
  222   1HB   PRO  36          1HB       PRO  36   5.628  14.012  -7.364
  223   2HB   PRO  36          2HB       PRO  36   7.068  13.133  -7.876
  224   1HG   PRO  36          1HG       PRO  36   4.767  12.184  -6.233
  225   2HG   PRO  36          2HG       PRO  36   5.611  11.363  -7.560
  226   1HD   PRO  36          1HD       PRO  36   6.079  10.775  -4.991
  227   2HD   PRO  36          2HD       PRO  36   7.386  10.727  -6.179
  228    H    TYR  37           H        TYR  37   5.568  13.350  -3.819
  229    HA   TYR  37           HA       TYR  37   4.198  15.875  -4.039
  230   1HB   TYR  37          1HB       TYR  37   3.785  13.547  -2.169
  231   2HB   TYR  37          2HB       TYR  37   2.802  15.004  -2.186
  232    HD1  TYR  37           1HD      TYR  37   3.709  11.995  -4.047
  233    HD2  TYR  37           2HD      TYR  37   1.109  15.326  -3.845
  234    HE1  TYR  37           1HE      TYR  37   2.300  10.944  -5.684
  235    HE2  TYR  37           2HE      TYR  37  -0.337  14.358  -5.498
  236    HH   TYR  37           HH       TYR  37  -0.023  11.055  -6.396
  237    H    ARG  38           H        ARG  38   6.654  14.404  -2.118
  238    HA   ARG  38           HA       ARG  38   6.328  16.348   0.018
  239   1HB   ARG  38          1HB       ARG  38   8.194  15.274   1.117
  240   2HB   ARG  38          2HB       ARG  38   7.070  14.055   0.542
  241   1HG   ARG  38          1HG       ARG  38   8.496  13.552  -1.319
  242   2HG   ARG  38          2HG       ARG  38   9.599  14.851  -0.873
  243   1HD   ARG  38          1HD       ARG  38   9.973  13.668   1.305
  244   2HD   ARG  38          2HD       ARG  38   8.924  12.386   0.686
  245    HE   ARG  38           HE       ARG  38  10.582  11.901  -1.003
  246   1HH1  ARG  38          1HH1      ARG  38  11.763  13.973   1.632
  247   2HH1  ARG  38          2HH1      ARG  38  13.392  13.588   1.369
  248   1HH2  ARG  38          1HH2      ARG  38  12.790  11.329  -1.292
  249   2HH2  ARG  38          2HH2      ARG  38  14.002  12.022  -0.328
  250    H    LYS  39           H        LYS  39   7.626  16.478  -2.939
  251    HA   LYS  39           HA       LYS  39   9.936  18.094  -2.276
  252   1HB   LYS  39          1HB       LYS  39   8.686  17.487  -4.943
  253   2HB   LYS  39          2HB       LYS  39  10.271  18.208  -4.679
  254   1HG   LYS  39          1HG       LYS  39  11.002  16.221  -3.487
  255   2HG   LYS  39          2HG       LYS  39   9.437  15.478  -3.775
  256   1HD   LYS  39          1HD       LYS  39   9.875  15.638  -6.198
  257   2HD   LYS  39          2HD       LYS  39  11.489  16.260  -5.803
  258   1HE   LYS  39          1HE       LYS  39  11.940  14.275  -4.477
  259   2HE   LYS  39          2HE       LYS  39  10.327  13.690  -4.870
  260   1HZ   LYS  39          1HZ       LYS  39  10.961  13.449  -7.168
  261   2HZ   LYS  39          2HZ       LYS  39  12.141  12.686  -6.246
  262   3HZ   LYS  39          3HZ       LYS  39  12.441  14.197  -6.900
  263    HA   PRO  40           HA       PRO  40   7.736  21.869  -2.267
  264   1HB   PRO  40          1HB       PRO  40   9.631  23.629  -3.073
  265   2HB   PRO  40          2HB       PRO  40   9.619  22.873  -1.477
  266   1HG   PRO  40          1HG       PRO  40  11.259  22.201  -3.876
  267   2HG   PRO  40          2HG       PRO  40  11.719  22.188  -2.167
  268   1HD   PRO  40          1HD       PRO  40  11.074  19.949  -3.609
  269   2HD   PRO  40          2HD       PRO  40  10.908  20.047  -1.853
  270    H    ASP  41           H        ASP  41   8.626  20.437  -5.133
  271    HA   ASP  41           HA       ASP  41   7.668  22.619  -6.809
  272   1HB   ASP  41          1HB       ASP  41   9.784  21.563  -7.513
  273   2HB   ASP  41          2HB       ASP  41   9.006  19.987  -7.523
  274    H    CYS  42           H        CYS  42   6.564  20.098  -5.128
  275    HA   CYS  42           HA       CYS  42   4.685  18.882  -6.838
  276   1HB   CYS  42          1HB       CYS  42   5.268  17.903  -4.671
  277   2HB   CYS  42          2HB       CYS  42   4.523  19.270  -3.847
  278    HG   CYS  42           HG       CYS  42   2.711  17.279  -3.490
  279    H    LYS  43           H        LYS  43   2.886  19.616  -7.666
  280    HA   LYS  43           HA       LYS  43   1.990  22.263  -7.003
  281   1HB   LYS  43          1HB       LYS  43   1.164  20.324  -9.119
  282   2HB   LYS  43          2HB       LYS  43   0.479  21.933  -8.914
  283   1HG   LYS  43          1HG       LYS  43   2.641  22.940  -9.286
  284   2HG   LYS  43          2HG       LYS  43   3.387  21.345  -9.399
  285   1HD   LYS  43          1HD       LYS  43   3.034  22.265 -11.580
  286   2HD   LYS  43          2HD       LYS  43   2.003  20.845 -11.312
  287   1HE   LYS  43          1HE       LYS  43   0.094  22.338 -10.867
  288   2HE   LYS  43          2HE       LYS  43   1.137  23.734 -11.125
  289   1HZ   LYS  43          1HZ       LYS  43   1.442  23.036 -13.402
  290   2HZ   LYS  43          2HZ       LYS  43  -0.196  23.231 -13.053
  291   3HZ   LYS  43          3HZ       LYS  43   0.464  21.683 -13.155
  292    H    VAL  44           H        VAL  44   0.931  18.943  -6.710
  293    HA   VAL  44           HA       VAL  44  -1.456  19.877  -5.340
  294    HB   VAL  44           HB       VAL  44  -2.189  19.255  -7.574
  295   1HG1  VAL  44          1HG1      VAL  44  -0.455  17.788  -8.290
  296   2HG1  VAL  44          2HG1      VAL  44  -2.020  16.987  -8.455
  297   3HG1  VAL  44          3HG1      VAL  44  -0.954  16.571  -7.114
  298   1HG2  VAL  44          1HG2      VAL  44  -2.995  17.203  -5.529
  299   2HG2  VAL  44          2HG2      VAL  44  -3.865  17.541  -7.023
  300   3HG2  VAL  44          3HG2      VAL  44  -3.736  18.786  -5.778
  301    H    GLY  45           H        GLY  45  -1.651  19.115  -3.458
  302   1HA   GLY  45          1HA       GLY  45  -1.483  17.762  -1.603
  303   2HA   GLY  45          2HA       GLY  45  -1.133  16.415  -2.684
  304    H    ARG  46           H        ARG  46   0.727  19.517  -1.955
  305    HA   ARG  46           HA       ARG  46   3.105  18.015  -1.928
  306   1HB   ARG  46          1HB       ARG  46   3.066  20.344  -2.669
  307   2HB   ARG  46          2HB       ARG  46   2.556  20.844  -1.059
  308   1HG   ARG  46          1HG       ARG  46   4.612  20.077  -0.098
  309   2HG   ARG  46          2HG       ARG  46   5.142  19.434  -1.649
  310   1HD   ARG  46          1HD       ARG  46   6.196  21.561  -1.136
  311   2HD   ARG  46          2HD       ARG  46   5.169  21.649  -2.578
  312    HE   ARG  46           HE       ARG  46   3.715  23.007  -1.448
  313   1HH1  ARG  46          1HH1      ARG  46   6.276  21.956   0.752
  314   2HH1  ARG  46          2HH1      ARG  46   6.001  23.185   1.892
  315   1HH2  ARG  46          1HH2      ARG  46   3.305  24.652   0.105
  316   2HH2  ARG  46          2HH2      ARG  46   4.254  24.778   1.517
  317    H    ILE  47           H        ILE  47   3.884  16.928  -0.383
  318    HA   ILE  47           HA       ILE  47   2.786  17.022   2.273
  319    HB   ILE  47           HB       ILE  47   5.209  15.367   1.387
  320   1HG1  ILE  47          1HG1      ILE  47   2.264  14.632   1.508
  321   2HG1  ILE  47          2HG1      ILE  47   3.198  14.914   0.039
  322   1HG2  ILE  47          1HG2      ILE  47   3.471  15.141   3.795
  323   2HG2  ILE  47          2HG2      ILE  47   5.134  15.701   3.717
  324   3HG2  ILE  47          3HG2      ILE  47   4.739  14.047   3.267
  325   1HD1  ILE  47          1HD1      ILE  47   3.759  12.750   2.038
  326   2HD1  ILE  47          2HD1      ILE  47   4.567  13.004   0.485
  327   3HD1  ILE  47          3HD1      ILE  47   2.865  12.543   0.532
  328    H    THR  48           H        THR  48   3.362  18.279   3.752
  329    HA   THR  48           HA       THR  48   5.260  20.250   3.588
  330    HB   THR  48           HB       THR  48   4.793  20.332   6.117
  331    HG1  THR  48           1HG      THR  48   3.695  18.580   6.820
  332   1HG2  THR  48          1HG2      THR  48   2.608  20.369   4.125
  333   2HG2  THR  48          2HG2      THR  48   3.764  21.697   4.379
  334   3HG2  THR  48          3HG2      THR  48   2.599  21.256   5.656
  335    H    THR  49           H        THR  49   5.260  17.443   5.600
  336    HA   THR  49           HA       THR  49   8.174  17.704   5.834
  337    HB   THR  49           HB       THR  49   6.867  17.300   8.472
  338    HG1  THR  49           1HG      THR  49   6.833  19.728   6.959
  339   1HG2  THR  49          1HG2      THR  49   8.677  18.821   9.145
  340   2HG2  THR  49          2HG2      THR  49   9.087  19.084   7.452
  341   3HG2  THR  49          3HG2      THR  49   9.301  17.490   8.174
  342    H    THR  50           H        THR  50   9.100  15.924   7.188
  343    HA   THR  50           HA       THR  50   8.592  13.519   5.948
  344    HB   THR  50           HB       THR  50  10.628  14.314   6.806
  345    HG1  THR  50           1HG      THR  50  10.678  12.141   6.472
  346   1HG2  THR  50          1HG2      THR  50  11.266  14.066   9.206
  347   2HG2  THR  50          2HG2      THR  50   9.568  13.652   9.521
  348   3HG2  THR  50          3HG2      THR  50   9.970  15.241   8.882
  349    H    GLU  51           H        GLU  51   7.692  14.559   9.237
  350    HA   GLU  51           HA       GLU  51   6.612  12.077   9.951
  351   1HB   GLU  51          1HB       GLU  51   5.323  13.349  11.720
  352   2HB   GLU  51          2HB       GLU  51   7.070  13.545  11.713
  353   1HG   GLU  51          1HG       GLU  51   5.414  15.572  10.310
  354   2HG   GLU  51          2HG       GLU  51   5.471  15.591  12.070
  355    H    ASP  52           H        ASP  52   5.165  14.765   8.085
  356    HA   ASP  52           HA       ASP  52   2.547  13.731   8.143
  357   1HB   ASP  52          1HB       ASP  52   4.106  15.740   6.551
  358   2HB   ASP  52          2HB       ASP  52   2.469  15.324   6.110
  359    H    PHE  53           H        PHE  53   5.352  13.558   6.055
  360    HA   PHE  53           HA       PHE  53   4.238  12.166   3.941
  361   1HB   PHE  53          1HB       PHE  53   6.471  13.228   3.851
  362   2HB   PHE  53          2HB       PHE  53   7.020  12.172   5.134
  363    HD1  PHE  53           1HD      PHE  53   6.212  12.443   1.617
  364    HD2  PHE  53           2HD      PHE  53   7.597   9.888   4.689
  365    HE1  PHE  53           1HE      PHE  53   6.976  10.844  -0.077
  366    HE2  PHE  53           2HE      PHE  53   8.354   8.272   3.039
  367    HZ   PHE  53           HZ       PHE  53   8.049   8.771   0.599
  368    H    LYS  54           H        LYS  54   5.805  11.051   6.819
  369    HA   LYS  54           HA       LYS  54   5.611   8.232   6.358
  370   1HB   LYS  54          1HB       LYS  54   5.911   9.777   8.914
  371   2HB   LYS  54          2HB       LYS  54   6.051   8.027   8.758
  372   1HG   LYS  54          1HG       LYS  54   7.925   8.307   7.211
  373   2HG   LYS  54          2HG       LYS  54   7.783  10.055   7.356
  374   1HD   LYS  54          1HD       LYS  54   9.574   9.237   8.723
  375   2HD   LYS  54          2HD       LYS  54   8.277   9.883   9.741
  376   1HE   LYS  54          1HE       LYS  54   7.488   7.624  10.201
  377   2HE   LYS  54          2HE       LYS  54   8.685   6.962   9.089
  378   1HZ   LYS  54          1HZ       LYS  54   9.352   6.713  11.375
  379   2HZ   LYS  54          2HZ       LYS  54   9.286   8.377  11.634
  380   3HZ   LYS  54          3HZ       LYS  54  10.420   7.727  10.570
  381    H    HIS  55           H        HIS  55   3.462  10.553   8.005
  382    HA   HIS  55           HA       HIS  55   1.643   8.655   9.122
  383   1HB   HIS  55          1HB       HIS  55   1.800  11.067   9.824
  384   2HB   HIS  55          2HB       HIS  55   1.302  11.528   8.223
  385    HD1  HIS  55           1HD      HIS  55  -0.132   9.866  11.305
  386    HD2  HIS  55           2HD      HIS  55  -1.415  11.582   7.755
  387    HE1  HIS  55           1HE      HIS  55  -2.602  10.112  11.551
  388    H    LEU  56           H        LEU  56   1.609  10.475   6.152
  389    HA   LEU  56           HA       LEU  56  -0.855   9.254   5.272
  390   1HB   LEU  56          1HB       LEU  56   0.253  11.457   4.568
  391   2HB   LEU  56          2HB       LEU  56   1.117  10.450   3.459
  392    HG   LEU  56           HG       LEU  56  -1.008   9.467   2.676
  393   1HD1  LEU  56          1HD1      LEU  56  -2.250  11.748   4.176
  394   2HD1  LEU  56          2HD1      LEU  56  -2.504  10.024   4.457
  395   3HD1  LEU  56          3HD1      LEU  56  -3.061  10.764   2.963
  396   1HD2  LEU  56          1HD2      LEU  56   0.217  11.016   1.431
  397   2HD2  LEU  56          2HD2      LEU  56  -0.562  12.383   2.267
  398   3HD2  LEU  56          3HD2      LEU  56  -1.516  11.297   1.211
  399    H    ALA  57           H        ALA  57   2.590   8.593   4.556
  400    HA   ALA  57           HA       ALA  57   2.043   6.635   2.623
  401   1HB   ALA  57          1HB       ALA  57   4.303   6.611   4.651
  402   2HB   ALA  57          2HB       ALA  57   4.364   7.470   3.117
  403   3HB   ALA  57          3HB       ALA  57   4.273   5.707   3.138
  404    H    ARG  58           H        ARG  58   2.097   6.441   6.068
  405    HA   ARG  58           HA       ARG  58   1.638   3.622   6.321
  406   1HB   ARG  58          1HB       ARG  58   0.899   5.892   8.153
  407   2HB   ARG  58          2HB       ARG  58   0.689   4.201   8.561
  408   1HG   ARG  58          1HG       ARG  58   3.042   3.843   8.541
  409   2HG   ARG  58          2HG       ARG  58   3.325   5.464   7.891
  410   1HD   ARG  58          1HD       ARG  58   2.356   6.444   9.859
  411   2HD   ARG  58          2HD       ARG  58   2.048   4.850  10.540
  412    HE   ARG  58           HE       ARG  58   4.644   4.701  10.132
  413   1HH1  ARG  58          1HH1      ARG  58   2.795   7.359  11.560
  414   2HH1  ARG  58          2HH1      ARG  58   4.051   7.886  12.576
  415   1HH2  ARG  58          1HH2      ARG  58   6.372   5.390  11.569
  416   2HH2  ARG  58          2HH2      ARG  58   6.131   6.704  12.617
  417    H    LYS  59           H        LYS  59  -0.519   6.442   6.151
  418    HA   LYS  59           HA       LYS  59  -2.849   5.015   6.776
  419   1HB   LYS  59          1HB       LYS  59  -2.628   7.440   7.031
  420   2HB   LYS  59          2HB       LYS  59  -2.503   7.617   5.290
  421   1HG   LYS  59          1HG       LYS  59  -4.759   6.969   4.980
  422   2HG   LYS  59          2HG       LYS  59  -4.923   6.476   6.665
  423   1HD   LYS  59          1HD       LYS  59  -4.518   8.825   7.343
  424   2HD   LYS  59          2HD       LYS  59  -4.469   9.275   5.638
  425   1HE   LYS  59          1HE       LYS  59  -6.816   7.966   7.006
  426   2HE   LYS  59          2HE       LYS  59  -6.662   9.696   6.706
  427   1HZ   LYS  59          1HZ       LYS  59  -6.715   7.601   4.598
  428   2HZ   LYS  59          2HZ       LYS  59  -6.586   9.271   4.375
  429   3HZ   LYS  59          3HZ       LYS  59  -7.990   8.630   5.026
  430    H    LEU  60           H        LEU  60  -1.373   5.935   3.715
  431    HA   LEU  60           HA       LEU  60  -3.409   5.074   2.192
  432   1HB   LEU  60          1HB       LEU  60  -0.527   5.402   1.509
  433   2HB   LEU  60          2HB       LEU  60  -1.791   5.261   0.274
  434    HG   LEU  60           HG       LEU  60  -1.967   7.226   2.450
  435   1HD1  LEU  60          1HD1      LEU  60  -0.564   7.573  -0.221
  436   2HD1  LEU  60          2HD1      LEU  60   0.103   7.828   1.386
  437   3HD1  LEU  60          3HD1      LEU  60  -1.124   8.922   0.751
  438   1HD2  LEU  60          1HD2      LEU  60  -3.945   6.766   1.313
  439   2HD2  LEU  60          2HD2      LEU  60  -3.188   7.002  -0.260
  440   3HD2  LEU  60          3HD2      LEU  60  -3.417   8.378   0.835
  441    H    THR  61           H        THR  61  -0.406   3.551   3.223
  442    HA   THR  61           HA       THR  61  -0.454   1.158   1.747
  443    HB   THR  61           HB       THR  61   0.553   1.500   4.598
  444    HG1  THR  61           1HG      THR  61   1.465   2.990   2.966
  445   1HG2  THR  61          1HG2      THR  61   2.069  -0.355   4.046
  446   2HG2  THR  61          2HG2      THR  61   1.370  -0.471   2.440
  447   3HG2  THR  61          3HG2      THR  61   0.388  -0.854   3.856
  448    H    HIS  62           H        HIS  62  -1.875   2.125   4.724
  449    HA   HIS  62           HA       HIS  62  -2.969  -0.471   5.257
  450   1HB   HIS  62          1HB       HIS  62  -2.356   1.134   7.071
  451   2HB   HIS  62          2HB       HIS  62  -3.657   2.181   6.526
  452    HD1  HIS  62           1HD      HIS  62  -3.189  -1.293   8.015
  453    HD2  HIS  62           2HD      HIS  62  -6.038   1.717   7.737
  454    HE1  HIS  62           1HE      HIS  62  -5.097  -2.052   9.448
  455    H    GLY  63           H        GLY  63  -4.276   2.405   3.657
  456   1HA   GLY  63          1HA       GLY  63  -6.903   1.347   3.708
  457   2HA   GLY  63          2HA       GLY  63  -6.427   2.714   2.742
  458    H    VAL  64           H        VAL  64  -4.289   1.209   1.341
  459    HA   VAL  64           HA       VAL  64  -5.841   0.011  -0.798
  460    HB   VAL  64           HB       VAL  64  -2.867  -0.306  -0.149
  461   1HG1  VAL  64          1HG1      VAL  64  -3.683  -2.147  -1.624
  462   2HG1  VAL  64          2HG1      VAL  64  -2.566  -1.107  -2.474
  463   3HG1  VAL  64          3HG1      VAL  64  -4.278  -0.953  -2.772
  464   1HG2  VAL  64          1HG2      VAL  64  -2.485   1.329  -1.940
  465   2HG2  VAL  64          2HG2      VAL  64  -3.441   2.014  -0.620
  466   3HG2  VAL  64          3HG2      VAL  64  -4.228   1.526  -2.124
  467    H    MET  65           H        MET  65  -4.201  -1.024   1.860
  468    HA   MET  65           HA       MET  65  -4.228  -3.842   1.498
  469   1HB   MET  65          1HB       MET  65  -2.674  -2.874   3.084
  470   2HB   MET  65          2HB       MET  65  -3.986  -2.187   4.004
  471   1HG   MET  65          1HG       MET  65  -4.699  -4.272   4.754
  472   2HG   MET  65          2HG       MET  65  -3.518  -5.126   3.771
  473   1HE   MET  65          1HE       MET  65  -2.371  -5.322   7.553
  474   2HE   MET  65          2HE       MET  65  -2.926  -6.267   6.149
  475   3HE   MET  65          3HE       MET  65  -4.014  -5.090   6.937
  476    H    ASN  66           H        ASN  66  -6.326  -1.712   3.472
  477    HA   ASN  66           HA       ASN  66  -8.130  -3.705   4.281
  478   1HB   ASN  66          1HB       ASN  66  -8.133  -0.750   4.054
  479   2HB   ASN  66          2HB       ASN  66  -9.603  -1.533   4.542
  480   1HD2  ASN  66          1HD2      ASN  66  -8.149   0.306   6.010
  481   2HD2  ASN  66          2HD2      ASN  66  -7.469  -0.514   7.366
  482    H    LYS  67           H        LYS  67  -8.195  -1.537   1.529
  483    HA   LYS  67           HA       LYS  67 -10.794  -2.274   0.762
  484   1HB   LYS  67          1HB       LYS  67  -8.555  -1.178  -0.937
  485   2HB   LYS  67          2HB       LYS  67 -10.221  -1.368  -1.472
  486   1HG   LYS  67          1HG       LYS  67 -10.951   0.183   0.285
  487   2HG   LYS  67          2HG       LYS  67  -9.278   0.385   0.792
  488   1HD   LYS  67          1HD       LYS  67  -9.947   2.246  -0.606
  489   2HD   LYS  67          2HD       LYS  67  -8.738   1.279  -1.449
  490   1HE   LYS  67          1HE       LYS  67 -10.496   0.187  -2.742
  491   2HE   LYS  67          2HE       LYS  67 -11.723   1.105  -1.873
  492   1HZ   LYS  67          1HZ       LYS  67  -9.621   2.289  -3.620
  493   2HZ   LYS  67          2HZ       LYS  67 -10.875   3.120  -2.846
  494   3HZ   LYS  67          3HZ       LYS  67 -11.225   2.011  -4.050
  495    H    GLU  68           H        GLU  68  -7.621  -3.645  -0.189
  496    HA   GLU  68           HA       GLU  68  -9.061  -5.382  -1.851
  497   1HB   GLU  68          1HB       GLU  68  -6.930  -6.399  -2.372
  498   2HB   GLU  68          2HB       GLU  68  -7.071  -4.648  -2.596
  499   1HG   GLU  68          1HG       GLU  68  -5.782  -4.258  -0.618
  500   2HG   GLU  68          2HG       GLU  68  -5.550  -5.993  -0.381
  501    H    LEU  69           H        LEU  69  -7.580  -5.725   1.372
  502    HA   LEU  69           HA       LEU  69  -8.147  -8.382   1.658
  503   1HB   LEU  69          1HB       LEU  69  -8.345  -6.094   3.593
  504   2HB   LEU  69          2HB       LEU  69  -8.767  -7.719   4.086
  505    HG   LEU  69           HG       LEU  69  -6.056  -6.954   2.999
  506   1HD1  LEU  69          1HD1      LEU  69  -5.296  -7.074   5.306
  507   2HD1  LEU  69          2HD1      LEU  69  -6.957  -7.315   5.861
  508   3HD1  LEU  69          3HD1      LEU  69  -6.483  -5.792   5.097
  509   1HD2  LEU  69          1HD2      LEU  69  -6.507  -9.286   2.694
  510   2HD2  LEU  69          2HD2      LEU  69  -7.183  -9.410   4.313
  511   3HD2  LEU  69          3HD2      LEU  69  -5.462  -9.130   4.115
  512    H    LYS  70           H        LYS  70 -10.487  -5.705   1.571
  513    HA   LYS  70           HA       LYS  70 -12.713  -7.250   2.384
  514   1HB   LYS  70          1HB       LYS  70 -12.527  -4.866   0.577
  515   2HB   LYS  70          2HB       LYS  70 -14.007  -5.511   1.259
  516   1HG   LYS  70          1HG       LYS  70 -13.206  -4.996   3.458
  517   2HG   LYS  70          2HG       LYS  70 -11.704  -4.374   2.751
  518   1HD   LYS  70          1HD       LYS  70 -13.004  -2.743   1.463
  519   2HD   LYS  70          2HD       LYS  70 -14.478  -3.333   2.211
  520   1HE   LYS  70          1HE       LYS  70 -12.149  -2.152   3.706
  521   2HE   LYS  70          2HE       LYS  70 -13.625  -1.270   3.301
  522   1HZ   LYS  70          1HZ       LYS  70 -13.435  -3.662   5.075
  523   2HZ   LYS  70          2HZ       LYS  70 -14.860  -2.884   4.656
  524   3HZ   LYS  70          3HZ       LYS  70 -13.701  -2.077   5.558
  525    H    TYR  71           H        TYR  71 -11.479  -6.219  -0.742
  526    HA   TYR  71           HA       TYR  71 -13.573  -7.605  -2.156
  527   1HB   TYR  71          1HB       TYR  71 -11.105  -6.334  -3.342
  528   2HB   TYR  71          2HB       TYR  71 -12.609  -6.713  -4.170
  529    HD1  TYR  71           1HD      TYR  71 -11.353  -4.052  -4.284
  530    HD2  TYR  71           2HD      TYR  71 -14.159  -5.585  -1.468
  531    HE1  TYR  71           1HE      TYR  71 -12.102  -1.770  -3.784
  532    HE2  TYR  71           2HE      TYR  71 -14.919  -3.322  -0.976
  533    HH   TYR  71           HH       TYR  71 -14.110  -0.658  -2.905
  534    H    CYS  72           H        CYS  72 -10.412  -8.432  -1.209
  535    HA   CYS  72           HA       CYS  72 -10.201 -10.639  -3.101
  536   1HB   CYS  72          1HB       CYS  72  -8.393  -9.571  -0.966
  537   2HB   CYS  72          2HB       CYS  72  -7.982 -11.039  -1.819
  538    HG   CYS  72           HG       CYS  72  -7.059  -9.923  -3.939
  539    H    LYS  73           H        LYS  73 -10.710 -10.057   0.317
  540    HA   LYS  73           HA       LYS  73 -11.573 -11.244   1.978
  541   1HB   LYS  73          1HB       LYS  73 -12.207 -13.297  -0.147
  542   2HB   LYS  73          2HB       LYS  73 -12.719 -13.436   1.529
  543   1HG   LYS  73          1HG       LYS  73 -13.478 -11.150  -0.294
  544   2HG   LYS  73          2HG       LYS  73 -14.495 -12.563   0.014
  545   1HD   LYS  73          1HD       LYS  73 -14.458 -11.967   2.428
  546   2HD   LYS  73          2HD       LYS  73 -13.520 -10.528   2.001
  547   1HE   LYS  73          1HE       LYS  73 -15.304  -9.717   0.617
  548   2HE   LYS  73          2HE       LYS  73 -16.247 -11.175   0.923
  549   1HZ   LYS  73          1HZ       LYS  73 -15.428  -9.221   2.993
  550   2HZ   LYS  73          2HZ       LYS  73 -16.407 -10.573   3.216
  551   3HZ   LYS  73          3HZ       LYS  73 -16.940  -9.284   2.257
  552    H    ASN  74           H        ASN  74  -9.669 -13.265  -0.118
  553    HA   ASN  74           HA       ASN  74  -8.429 -14.443   2.252
  554   1HB   ASN  74          1HB       ASN  74  -7.611 -16.246   0.847
  555   2HB   ASN  74          2HB       ASN  74  -9.314 -16.021   0.487
  556   1HD2  ASN  74          1HD2      ASN  74  -9.895 -15.144  -1.544
  557   2HD2  ASN  74          2HD2      ASN  74  -8.782 -15.073  -2.850
  558    HA   PRO  75           HA       PRO  75  -5.026 -11.690   1.425
  559   1HB   PRO  75          1HB       PRO  75  -3.367 -12.706   3.101
  560   2HB   PRO  75          2HB       PRO  75  -4.570 -11.436   3.415
  561   1HG   PRO  75          1HG       PRO  75  -4.588 -14.385   4.207
  562   2HG   PRO  75          2HG       PRO  75  -5.403 -13.066   5.053
  563   1HD   PRO  75          1HD       PRO  75  -6.587 -14.896   3.361
  564   2HD   PRO  75          2HD       PRO  75  -7.274 -13.314   3.785
  565    H    GLU  76           H        GLU  76  -5.045 -14.895   0.805
  566    HA   GLU  76           HA       GLU  76  -2.325 -15.273   0.104
  567   1HB   GLU  76          1HB       GLU  76  -3.862 -17.181   0.441
  568   2HB   GLU  76          2HB       GLU  76  -4.816 -16.647  -0.932
  569   1HG   GLU  76          1HG       GLU  76  -2.900 -17.052  -2.404
  570   2HG   GLU  76          2HG       GLU  76  -1.967 -17.614  -1.019
  571    H    ASP  77           H        ASP  77  -4.636 -13.323  -0.966
  572    HA   ASP  77           HA       ASP  77  -3.451 -13.013  -3.669
  573   1HB   ASP  77          1HB       ASP  77  -5.864 -13.786  -3.648
  574   2HB   ASP  77          2HB       ASP  77  -6.256 -12.297  -2.797
  575    H    LEU  78           H        LEU  78  -3.318 -11.855  -0.668
  576    HA   LEU  78           HA       LEU  78  -3.420  -9.062  -1.302
  577   1HB   LEU  78          1HB       LEU  78  -4.385  -9.977   0.776
  578   2HB   LEU  78          2HB       LEU  78  -2.788 -10.624   1.156
  579    HG   LEU  78           HG       LEU  78  -1.982  -8.375   1.033
  580   1HD1  LEU  78          1HD1      LEU  78  -3.802  -7.228  -0.051
  581   2HD1  LEU  78          2HD1      LEU  78  -3.628  -6.532   1.560
  582   3HD1  LEU  78          3HD1      LEU  78  -4.918  -7.692   1.233
  583   1HD2  LEU  78          1HD2      LEU  78  -2.759  -7.790   3.365
  584   2HD2  LEU  78          2HD2      LEU  78  -2.021  -9.352   3.072
  585   3HD2  LEU  78          3HD2      LEU  78  -3.778  -9.240   3.242
  586    H    GLU  79           H        GLU  79  -1.681  -8.757  -2.530
  587    HA   GLU  79           HA       GLU  79   1.025  -9.194  -1.524
  588   1HB   GLU  79          1HB       GLU  79   0.423 -11.099  -2.999
  589   2HB   GLU  79          2HB       GLU  79  -0.179  -9.896  -4.147
  590   1HG   GLU  79          1HG       GLU  79   1.832 -10.721  -4.855
  591   2HG   GLU  79          2HG       GLU  79   1.971  -9.024  -4.488
  592    H    CYS  80           H        CYS  80   2.325  -7.644  -2.331
  593    HA   CYS  80           HA       CYS  80   0.972  -5.344  -3.496
  594   1HB   CYS  80          1HB       CYS  80   2.448  -4.767  -1.722
  595   2HB   CYS  80          2HB       CYS  80   3.814  -5.632  -2.399
  596    HG   CYS  80           HG       CYS  80   4.428  -3.839  -4.262
  597    H    ASN  81           H        ASN  81   0.520  -6.678  -5.280
  598    HA   ASN  81           HA       ASN  81   2.776  -7.282  -6.908
  599   1HB   ASN  81          1HB       ASN  81   1.241  -8.604  -8.360
  600   2HB   ASN  81          2HB       ASN  81   1.019  -9.037  -6.666
  601   1HD2  ASN  81          1HD2      ASN  81  -0.893  -8.545  -5.770
  602   2HD2  ASN  81          2HD2      ASN  81  -2.267  -7.986  -6.636
  603    H    GLU  82           H        GLU  82   1.645  -7.080  -9.473
  604    HA   GLU  82           HA       GLU  82   2.006  -4.536 -10.192
  605   1HB   GLU  82          1HB       GLU  82   0.689  -6.863 -11.203
  606   2HB   GLU  82          2HB       GLU  82   0.803  -5.453 -12.294
  607   1HG   GLU  82          1HG       GLU  82   2.992  -7.006 -10.963
  608   2HG   GLU  82          2HG       GLU  82   2.711  -6.949 -12.725
  609    H    ASN  83           H        ASN  83  -1.009  -6.379 -10.083
  610    HA   ASN  83           HA       ASN  83  -3.000  -4.577 -10.694
  611   1HB   ASN  83          1HB       ASN  83  -2.947  -6.772  -8.601
  612   2HB   ASN  83          2HB       ASN  83  -4.424  -5.956  -9.110
  613   1HD2  ASN  83          1HD2      ASN  83  -5.311  -7.839  -9.785
  614   2HD2  ASN  83          2HD2      ASN  83  -4.802  -8.708 -11.186
  615    H    VAL  84           H        VAL  84  -1.540  -5.411  -7.566
  616    HA   VAL  84           HA       VAL  84  -3.086  -3.552  -6.241
  617    HB   VAL  84           HB       VAL  84  -0.571  -4.958  -5.404
  618   1HG1  VAL  84          1HG1      VAL  84  -1.127  -4.290  -3.130
  619   2HG1  VAL  84          2HG1      VAL  84  -2.383  -3.199  -3.733
  620   3HG1  VAL  84          3HG1      VAL  84  -0.676  -2.901  -4.112
  621   1HG2  VAL  84          1HG2      VAL  84  -2.126  -6.208  -4.083
  622   2HG2  VAL  84          2HG2      VAL  84  -2.544  -6.256  -5.805
  623   3HG2  VAL  84          3HG2      VAL  84  -3.450  -5.218  -4.692
  624    H    LYS  85           H        LYS  85   0.210  -3.354  -7.409
  625    HA   LYS  85           HA       LYS  85   0.907  -0.761  -6.561
  626   1HB   LYS  85          1HB       LYS  85   1.548  -2.090  -9.183
  627   2HB   LYS  85          2HB       LYS  85   2.339  -0.643  -8.578
  628   1HG   LYS  85          1HG       LYS  85   3.263  -1.841  -6.753
  629   2HG   LYS  85          2HG       LYS  85   2.327  -3.278  -7.170
  630   1HD   LYS  85          1HD       LYS  85   3.509  -3.234  -9.396
  631   2HD   LYS  85          2HD       LYS  85   4.589  -2.025  -8.689
  632   1HE   LYS  85          1HE       LYS  85   5.171  -3.502  -6.937
  633   2HE   LYS  85          2HE       LYS  85   3.977  -4.669  -7.513
  634   1HZ   LYS  85          1HZ       LYS  85   5.263  -4.878  -9.569
  635   2HZ   LYS  85          2HZ       LYS  85   6.188  -5.341  -8.229
  636   3HZ   LYS  85          3HZ       LYS  85   6.454  -3.846  -8.971
  637    H    HIS  86           H        HIS  86  -0.743  -1.827  -9.376
  638    HA   HIS  86           HA       HIS  86  -1.069   0.460 -10.855
  639   1HB   HIS  86          1HB       HIS  86  -1.627  -1.834 -11.602
  640   2HB   HIS  86          2HB       HIS  86  -3.005  -1.857 -10.530
  641    HD1  HIS  86           1HD      HIS  86  -2.660  -2.076 -13.838
  642    HD2  HIS  86           2HD      HIS  86  -4.534   0.867 -11.570
  643    HE1  HIS  86           1HE      HIS  86  -4.346  -1.049 -15.357
  644    H    LYS  87           H        LYS  87  -3.306  -1.023  -8.618
  645    HA   LYS  87           HA       LYS  87  -5.288   1.083  -8.433
  646   1HB   LYS  87          1HB       LYS  87  -4.544  -0.971  -6.383
  647   2HB   LYS  87          2HB       LYS  87  -6.036  -0.053  -6.444
  648   1HG   LYS  87          1HG       LYS  87  -6.688  -1.202  -8.455
  649   2HG   LYS  87          2HG       LYS  87  -5.178  -2.128  -8.447
  650   1HD   LYS  87          1HD       LYS  87  -7.217  -2.082  -6.281
  651   2HD   LYS  87          2HD       LYS  87  -7.133  -3.362  -7.509
  652   1HE   LYS  87          1HE       LYS  87  -4.907  -3.959  -6.719
  653   2HE   LYS  87          2HE       LYS  87  -4.937  -2.669  -5.510
  654   1HZ   LYS  87          1HZ       LYS  87  -5.422  -4.592  -4.377
  655   2HZ   LYS  87          2HZ       LYS  87  -6.434  -5.218  -5.562
  656   3HZ   LYS  87          3HZ       LYS  87  -6.951  -3.917  -4.601
  657    H    THR  88           H        THR  88  -2.393   0.568  -6.847
  658    HA   THR  88           HA       THR  88  -3.006   2.286  -4.699
  659    HB   THR  88           HB       THR  88  -0.586   0.948  -5.715
  660    HG1  THR  88           1HG      THR  88  -1.886  -0.434  -4.727
  661   1HG2  THR  88          1HG2      THR  88   0.070   2.998  -4.803
  662   2HG2  THR  88          2HG2      THR  88   0.546   1.701  -3.677
  663   3HG2  THR  88          3HG2      THR  88  -0.859   2.754  -3.315
  664    H    LYS  89           H        LYS  89  -0.661   2.569  -7.326
  665    HA   LYS  89           HA       LYS  89  -0.158   5.099  -6.565
  666   1HB   LYS  89          1HB       LYS  89   0.833   5.343  -9.034
  667   2HB   LYS  89          2HB       LYS  89   1.588   4.416  -7.748
  668   1HG   LYS  89          1HG       LYS  89   1.659   3.071  -9.678
  669   2HG   LYS  89          2HG       LYS  89   0.404   2.401  -8.632
  670   1HD   LYS  89          1HD       LYS  89  -0.398   2.293 -10.704
  671   2HD   LYS  89          2HD       LYS  89  -1.154   3.668  -9.929
  672   1HE   LYS  89          1HE       LYS  89   0.258   5.269 -11.095
  673   2HE   LYS  89          2HE       LYS  89   1.285   3.984 -11.712
  674   1HZ   LYS  89          1HZ       LYS  89  -1.516   4.558 -12.566
  675   2HZ   LYS  89          2HZ       LYS  89  -0.593   3.255 -13.095
  676   3HZ   LYS  89          3HZ       LYS  89  -0.098   4.812 -13.438
  677    H    GLU  90           H        GLU  90  -2.497   3.854  -8.860
  678    HA   GLU  90           HA       GLU  90  -3.512   6.279  -9.968
  679   1HB   GLU  90          1HB       GLU  90  -4.947   3.718  -9.257
  680   2HB   GLU  90          2HB       GLU  90  -5.726   5.041 -10.103
  681   1HG   GLU  90          1HG       GLU  90  -3.386   3.430 -11.092
  682   2HG   GLU  90          2HG       GLU  90  -5.062   3.227 -11.585
  683    H    TYR  91           H        TYR  91  -4.133   4.611  -6.895
  684    HA   TYR  91           HA       TYR  91  -6.410   6.108  -6.167
  685   1HB   TYR  91          1HB       TYR  91  -6.273   3.984  -5.207
  686   2HB   TYR  91          2HB       TYR  91  -4.577   4.172  -4.815
  687    HD1  TYR  91           1HD      TYR  91  -7.820   5.832  -3.938
  688    HD2  TYR  91           2HD      TYR  91  -4.068   4.365  -2.614
  689    HE1  TYR  91           1HE      TYR  91  -8.465   6.284  -1.596
  690    HE2  TYR  91           2HE      TYR  91  -4.649   4.829  -0.303
  691    HH   TYR  91           HH       TYR  91  -6.226   6.201   0.991
  692    H    ILE  92           H        ILE  92  -3.055   5.921  -5.157
  693    HA   ILE  92           HA       ILE  92  -2.908   7.983  -3.333
  694    HB   ILE  92           HB       ILE  92  -0.862   7.177  -5.396
  695   1HG1  ILE  92          1HG1      ILE  92  -1.909   5.590  -3.558
  696   2HG1  ILE  92          2HG1      ILE  92  -0.178   5.437  -3.989
  697   1HG2  ILE  92          1HG2      ILE  92  -0.474   8.718  -2.843
  698   2HG2  ILE  92          2HG2      ILE  92  -0.414   9.367  -4.469
  699   3HG2  ILE  92          3HG2      ILE  92   0.829   8.210  -3.939
  700   1HD1  ILE  92          1HD1      ILE  92  -1.544   6.753  -1.706
  701   2HD1  ILE  92          2HD1      ILE  92   0.209   6.847  -2.019
  702   3HD1  ILE  92          3HD1      ILE  92  -0.547   5.289  -1.650
  703    H    LYS  93           H        LYS  93  -2.383   8.305  -6.852
  704    HA   LYS  93           HA       LYS  93  -1.941  11.075  -6.695
  705   1HB   LYS  93          1HB       LYS  93  -3.092   9.445  -8.955
  706   2HB   LYS  93          2HB       LYS  93  -2.674  11.147  -9.082
  707   1HG   LYS  93          1HG       LYS  93  -0.332  10.573  -8.530
  708   2HG   LYS  93          2HG       LYS  93  -0.800   8.866  -8.525
  709   1HD   LYS  93          1HD       LYS  93  -1.509   9.035 -10.831
  710   2HD   LYS  93          2HD       LYS  93  -1.108  10.749 -10.856
  711   1HE   LYS  93          1HE       LYS  93   0.872   8.515 -10.400
  712   2HE   LYS  93          2HE       LYS  93   0.605   9.334 -11.936
  713   1HZ   LYS  93          1HZ       LYS  93   1.611  10.602  -9.436
  714   2HZ   LYS  93          2HZ       LYS  93   1.332  11.410 -10.901
  715   3HZ   LYS  93          3HZ       LYS  93   2.508  10.217 -10.811
  716    H    LYS  94           H        LYS  94  -4.909   9.261  -7.160
  717    HA   LYS  94           HA       LYS  94  -6.419  11.632  -7.572
  718   1HB   LYS  94          1HB       LYS  94  -7.333   8.834  -6.873
  719   2HB   LYS  94          2HB       LYS  94  -8.424  10.138  -7.308
  720   1HG   LYS  94          1HG       LYS  94  -6.311   8.897  -9.078
  721   2HG   LYS  94          2HG       LYS  94  -8.056   8.699  -9.223
  722   1HD   LYS  94          1HD       LYS  94  -8.278  11.110  -9.686
  723   2HD   LYS  94          2HD       LYS  94  -6.531  11.287  -9.540
  724   1HE   LYS  94          1HE       LYS  94  -7.155  11.201 -11.872
  725   2HE   LYS  94          2HE       LYS  94  -6.231   9.765 -11.444
  726   1HZ   LYS  94          1HZ       LYS  94  -8.146   9.272 -12.833
  727   2HZ   LYS  94          2HZ       LYS  94  -9.198   9.864 -11.655
  728   3HZ   LYS  94          3HZ       LYS  94  -8.247   8.503 -11.348
  729    H    TYR  95           H        TYR  95  -5.582   9.659  -4.873
  730    HA   TYR  95           HA       TYR  95  -7.239  10.652  -2.920
  731   1HB   TYR  95          1HB       TYR  95  -5.912   8.719  -2.758
  732   2HB   TYR  95          2HB       TYR  95  -4.416   9.590  -2.888
  733    HD1  TYR  95           1HD      TYR  95  -6.607   8.029  -0.863
  734    HD2  TYR  95           2HD      TYR  95  -4.280  11.494  -0.921
  735    HE1  TYR  95           1HE      TYR  95  -6.762   8.141   1.612
  736    HE2  TYR  95           2HE      TYR  95  -4.386  11.697   1.506
  737    HH   TYR  95           HH       TYR  95  -5.939  10.843   3.268
  738    H    MET  96           H        MET  96  -3.946  11.586  -3.694
  739    HA   MET  96           HA       MET  96  -3.891  13.670  -1.843
  740   1HB   MET  96          1HB       MET  96  -2.098  13.360  -4.208
  741   2HB   MET  96          2HB       MET  96  -1.852  14.344  -2.761
  742   1HG   MET  96          1HG       MET  96  -2.258  11.972  -1.577
  743   2HG   MET  96          2HG       MET  96  -1.592  11.446  -3.130
  744   1HE   MET  96          1HE       MET  96  -1.185  13.806  -0.212
  745   2HE   MET  96          2HE       MET  96  -0.560  14.809  -1.554
  746   3HE   MET  96          3HE       MET  96   0.534  14.263  -0.278
  747    H    GLN  97           H        GLN  97  -5.062  13.553  -4.969
  748    HA   GLN  97           HA       GLN  97  -5.028  16.310  -5.648
  749   1HB   GLN  97          1HB       GLN  97  -7.308  14.467  -6.386
  750   2HB   GLN  97          2HB       GLN  97  -6.854  15.957  -7.196
  751   1HG   GLN  97          1HG       GLN  97  -5.416  13.338  -7.171
  752   2HG   GLN  97          2HG       GLN  97  -6.090  14.192  -8.554
  753   1HE2  GLN  97          1HE2      GLN  97  -3.527  13.851  -6.373
  754   2HE2  GLN  97          2HE2      GLN  97  -2.381  14.935  -7.038
  755    H    LYS  98           H        LYS  98  -6.839  14.663  -3.300
  756    HA   LYS  98           HA       LYS  98  -9.008  16.535  -3.083
  757   1HB   LYS  98          1HB       LYS  98  -9.729  15.316  -1.237
  758   2HB   LYS  98          2HB       LYS  98  -9.014  14.111  -2.294
  759   1HG   LYS  98          1HG       LYS  98  -7.415  13.543  -0.726
  760   2HG   LYS  98          2HG       LYS  98  -7.136  15.235  -0.377
  761   1HD   LYS  98          1HD       LYS  98  -9.560  13.746   0.591
  762   2HD   LYS  98          2HD       LYS  98  -8.054  13.826   1.496
  763   1HE   LYS  98          1HE       LYS  98  -9.548  15.500   2.358
  764   2HE   LYS  98          2HE       LYS  98  -8.247  16.318   1.510
  765   1HZ   LYS  98          1HZ       LYS  98  -9.803  16.829  -0.274
  766   2HZ   LYS  98          2HZ       LYS  98 -10.488  17.264   1.181
  767   3HZ   LYS  98          3HZ       LYS  98 -10.991  15.866   0.427
  768    H    PHE  99           H        PHE  99  -5.790  16.475  -1.915
  769    HA   PHE  99           HA       PHE  99  -6.378  18.166   0.341
  770   1HB   PHE  99          1HB       PHE  99  -3.683  17.423  -0.819
  771   2HB   PHE  99          2HB       PHE  99  -3.933  18.420   0.614
  772    HD1  PHE  99           1HD      PHE  99  -3.240  15.181  -0.464
  773    HD2  PHE  99           2HD      PHE  99  -5.522  17.339   2.406
  774    HE1  PHE  99           1HE      PHE  99  -3.285  13.186   1.005
  775    HE2  PHE  99           2HE      PHE  99  -5.580  15.374   3.857
  776    HZ   PHE  99           HZ       PHE  99  -4.510  13.296   3.164
  777    H    GLY 100           H        GLY 100  -5.293  18.664  -2.911
  778   1HA   GLY 100          1HA       GLY 100  -5.786  20.711  -3.996
  779   2HA   GLY 100          2HA       GLY 100  -5.615  21.525  -2.441
  780    H    ALA 101           H        ALA 101  -3.837  22.553  -2.180
  781    HA   ALA 101           HA       ALA 101  -1.613  22.031  -3.992
  782   1HB   ALA 101          1HB       ALA 101  -2.400  24.334  -3.672
  783   2HB   ALA 101          2HB       ALA 101  -0.719  24.125  -3.175
  784   3HB   ALA 101          3HB       ALA 101  -1.995  24.218  -1.960
  785    H    VAL 102           H        VAL 102  -2.325  22.014  -0.539
  786    HA   VAL 102           HA       VAL 102   0.295  20.723  -0.163
  787    HB   VAL 102           HB       VAL 102  -1.004  22.147   2.104
  788   1HG1  VAL 102          1HG1      VAL 102   1.866  21.771   1.402
  789   2HG1  VAL 102          2HG1      VAL 102   0.919  20.873   2.594
  790   3HG1  VAL 102          3HG1      VAL 102   1.271  22.588   2.849
  791   1HG2  VAL 102          1HG2      VAL 102   0.580  23.640   0.036
  792   2HG2  VAL 102          2HG2      VAL 102   0.097  24.275   1.622
  793   3HG2  VAL 102          3HG2      VAL 102  -1.131  23.832   0.427
  794    H    TYR 103           H        TYR 103   0.372  19.245   1.522
  795    HA   TYR 103           HA       TYR 103  -2.012  17.737   1.662
  796   1HB   TYR 103          1HB       TYR 103  -0.161  16.397   1.189
  797   2HB   TYR 103          2HB       TYR 103   0.861  17.279   2.310
  798    HD1  TYR 103           1HD      TYR 103  -2.409  15.633   2.914
  799    HD2  TYR 103           2HD      TYR 103   1.718  15.691   3.663
  800    HE1  TYR 103           1HE      TYR 103  -2.732  13.937   4.582
  801    HE2  TYR 103           2HE      TYR 103   1.441  13.922   5.365
  802    HH   TYR 103           HH       TYR 103  -0.275  13.166   6.835
  803    H    LYS 104           H        LYS 104  -3.380  18.491   2.971
  804    HA   LYS 104           HA       LYS 104  -2.688  19.036   5.777
  805   1HB   LYS 104          1HB       LYS 104  -4.922  20.043   4.026
  806   2HB   LYS 104          2HB       LYS 104  -4.835  20.352   5.747
  807   1HG   LYS 104          1HG       LYS 104  -2.720  21.570   5.415
  808   2HG   LYS 104          2HG       LYS 104  -2.798  21.224   3.690
  809   1HD   LYS 104          1HD       LYS 104  -4.847  22.827   5.228
  810   2HD   LYS 104          2HD       LYS 104  -3.535  23.523   4.281
  811   1HE   LYS 104          1HE       LYS 104  -4.444  22.409   2.268
  812   2HE   LYS 104          2HE       LYS 104  -5.784  21.801   3.234
  813   1HZ   LYS 104          1HZ       LYS 104  -5.169  24.676   2.782
  814   2HZ   LYS 104          2HZ       LYS 104  -6.452  24.086   3.692
  815   3HZ   LYS 104          3HZ       LYS 104  -6.412  23.813   2.042
  816    HA   PRO 105           HA       PRO 105  -4.889  14.991   5.772
  817   1HB   PRO 105          1HB       PRO 105  -3.971  14.280   8.270
  818   2HB   PRO 105          2HB       PRO 105  -3.119  13.936   6.763
  819   1HG   PRO 105          1HG       PRO 105  -2.733  16.141   8.709
  820   2HG   PRO 105          2HG       PRO 105  -1.493  15.187   7.840
  821   1HD   PRO 105          1HD       PRO 105  -2.163  17.698   7.162
  822   2HD   PRO 105          2HD       PRO 105  -1.719  16.525   5.916
  823    H    LYS 106           H        LYS 106  -4.843  17.416   8.230
  824    HA   LYS 106           HA       LYS 106  -7.097  16.734   9.652
  825   1HB   LYS 106          1HB       LYS 106  -6.009  19.442   8.955
  826   2HB   LYS 106          2HB       LYS 106  -7.262  19.165  10.162
  827   1HG   LYS 106          1HG       LYS 106  -5.788  17.884  11.516
  828   2HG   LYS 106          2HG       LYS 106  -4.561  17.862  10.250
  829   1HD   LYS 106          1HD       LYS 106  -4.205  20.191  10.465
  830   2HD   LYS 106          2HD       LYS 106  -5.552  20.359  11.605
  831   1HE   LYS 106          1HE       LYS 106  -4.351  18.902  13.194
  832   2HE   LYS 106          2HE       LYS 106  -3.025  18.771  12.043
  833   1HZ   LYS 106          1HZ       LYS 106  -3.945  21.326  13.203
  834   2HZ   LYS 106          2HZ       LYS 106  -2.569  21.050  12.253
  835   3HZ   LYS 106          3HZ       LYS 106  -2.662  20.405  13.801
  836    H    GLU 107           H        GLU 107  -6.926  17.703   6.417
  837    HA   GLU 107           HA       GLU 107  -9.806  18.318   6.299
  838   1HB   GLU 107          1HB       GLU 107  -7.576  18.855   4.328
  839   2HB   GLU 107          2HB       GLU 107  -9.259  19.268   4.080
  840   1HG   GLU 107          1HG       GLU 107  -7.505  20.393   6.256
  841   2HG   GLU 107          2HG       GLU 107  -7.848  21.189   4.723
  842    H    ASP 108           H        ASP 108  -8.010  15.635   6.231
  843    HA   ASP 108           HA       ASP 108  -8.114  14.702   3.589
  844   1HB   ASP 108          1HB       ASP 108  -6.312  13.945   4.889
  845   2HB   ASP 108          2HB       ASP 108  -7.345  13.347   6.193
  846    H    THR 109           H        THR 109  -8.910  12.543   3.050
  847    HA   THR 109           HA       THR 109 -11.699  12.413   2.884
  848    HB   THR 109           HB       THR 109 -10.152  11.581   1.138
  849    HG1  THR 109           1HG      THR 109 -12.228  10.101   2.143
  850   1HG2  THR 109          1HG2      THR 109  -9.513   9.395   3.100
  851   2HG2  THR 109          2HG2      THR 109  -8.472  10.738   2.678
  852   3HG2  THR 109          3HG2      THR 109  -8.887   9.530   1.445
  Start of MODEL    9
    1    H    THR  10           H        THR  10  -3.358 -23.310   4.024
    2    HA   THR  10           HA       THR  10  -2.793 -22.425   6.739
    3    HB   THR  10           HB       THR  10  -0.408 -22.442   5.708
    4    HG1  THR  10           1HG      THR  10  -1.255 -24.559   4.161
    5   1HG2  THR  10          1HG2      THR  10  -0.210 -24.838   6.290
    6   2HG2  THR  10          2HG2      THR  10  -1.971 -24.955   6.316
    7   3HG2  THR  10          3HG2      THR  10  -1.135 -23.925   7.480
    8    H    SER  11           H        SER  11  -4.241 -20.996   4.461
    9    HA   SER  11           HA       SER  11  -2.506 -18.826   3.645
   10   1HB   SER  11          1HB       SER  11  -5.459 -18.942   3.664
   11   2HB   SER  11          2HB       SER  11  -4.399 -18.087   2.519
   12    HG   SER  11           HG       SER  11  -4.456 -19.844   1.318
   13    H    SER  12           H        SER  12  -4.370 -19.568   6.326
   14    HA   SER  12           HA       SER  12  -4.870 -17.024   7.259
   15   1HB   SER  12          1HB       SER  12  -4.876 -18.462   9.415
   16   2HB   SER  12          2HB       SER  12  -6.023 -18.836   8.110
   17    HG   SER  12           HG       SER  12  -4.470 -20.561   9.130
   18    H    GLU  13           H        GLU  13  -2.078 -19.385   7.854
   19    HA   GLU  13           HA       GLU  13  -0.715 -17.436   9.300
   20   1HB   GLU  13          1HB       GLU  13   1.021 -19.300   9.341
   21   2HB   GLU  13          2HB       GLU  13  -0.512 -19.574  10.155
   22   1HG   GLU  13          1HG       GLU  13  -1.294 -20.947   8.346
   23   2HG   GLU  13          2HG       GLU  13   0.094 -20.537   7.372
   24    H    LEU  14           H        LEU  14  -0.399 -18.961   6.132
   25    HA   LEU  14           HA       LEU  14   2.108 -18.182   5.297
   26   1HB   LEU  14          1HB       LEU  14   0.394 -19.649   4.185
   27   2HB   LEU  14          2HB       LEU  14  -0.402 -18.206   3.649
   28    HG   LEU  14           HG       LEU  14   1.018 -19.389   1.914
   29   1HD1  LEU  14          1HD1      LEU  14   0.304 -17.106   1.543
   30   2HD1  LEU  14          2HD1      LEU  14   1.933 -17.368   0.920
   31   3HD1  LEU  14          3HD1      LEU  14   1.701 -16.511   2.440
   32   1HD2  LEU  14          1HD2      LEU  14   3.281 -18.236   3.530
   33   2HD2  LEU  14          2HD2      LEU  14   3.415 -18.995   1.944
   34   3HD2  LEU  14          3HD2      LEU  14   2.894 -19.947   3.335
   35    H    ALA  15           H        ALA  15  -0.799 -16.608   5.359
   36    HA   ALA  15           HA       ALA  15   0.187 -14.378   3.842
   37   1HB   ALA  15          1HB       ALA  15  -1.978 -13.496   3.698
   38   2HB   ALA  15          2HB       ALA  15  -2.630 -14.813   4.689
   39   3HB   ALA  15          3HB       ALA  15  -1.950 -15.147   3.087
   40    H    LYS  16           H        LYS  16  -0.251 -15.234   7.024
   41    HA   LYS  16           HA       LYS  16  -0.685 -12.661   8.228
   42   1HB   LYS  16          1HB       LYS  16  -0.703 -15.098   9.273
   43   2HB   LYS  16          2HB       LYS  16   1.021 -14.840   9.397
   44   1HG   LYS  16          1HG       LYS  16   0.041 -14.293  11.495
   45   2HG   LYS  16          2HG       LYS  16   0.578 -12.794  10.736
   46   1HD   LYS  16          1HD       LYS  16  -1.648 -12.555  11.768
   47   2HD   LYS  16          2HD       LYS  16  -1.718 -12.311  10.027
   48   1HE   LYS  16          1HE       LYS  16  -3.587 -13.683  10.845
   49   2HE   LYS  16          2HE       LYS  16  -2.585 -14.576   9.719
   50   1HZ   LYS  16          1HZ       LYS  16  -3.134 -15.955  11.600
   51   2HZ   LYS  16          2HZ       LYS  16  -2.546 -14.812  12.676
   52   3HZ   LYS  16          3HZ       LYS  16  -1.488 -15.629  11.657
   53    H    LYS  17           H        LYS  17   2.007 -14.477   7.010
   54    HA   LYS  17           HA       LYS  17   3.974 -12.489   7.681
   55   1HB   LYS  17          1HB       LYS  17   4.068 -14.986   5.989
   56   2HB   LYS  17          2HB       LYS  17   5.419 -13.876   6.089
   57   1HG   LYS  17          1HG       LYS  17   5.823 -15.718   7.568
   58   2HG   LYS  17          2HG       LYS  17   5.510 -14.288   8.536
   59   1HD   LYS  17          1HD       LYS  17   3.247 -15.043   8.964
   60   2HD   LYS  17          2HD       LYS  17   3.493 -16.441   7.920
   61   1HE   LYS  17          1HE       LYS  17   5.020 -15.850  10.458
   62   2HE   LYS  17          2HE       LYS  17   3.709 -17.014  10.301
   63   1HZ   LYS  17          1HZ       LYS  17   6.325 -17.149   8.887
   64   2HZ   LYS  17          2HZ       LYS  17   5.058 -18.230   8.695
   65   3HZ   LYS  17          3HZ       LYS  17   5.835 -18.114  10.185
   66    H    SER  18           H        SER  18   2.135 -13.544   4.819
   67    HA   SER  18           HA       SER  18   3.380 -11.944   2.973
   68   1HB   SER  18          1HB       SER  18   0.468 -12.726   2.952
   69   2HB   SER  18          2HB       SER  18   1.438 -12.281   1.566
   70    HG   SER  18           HG       SER  18   1.950 -14.273   1.430
   71    H    LYS  19           H        LYS  19   0.839 -11.087   5.278
   72    HA   LYS  19           HA       LYS  19   0.157  -8.570   4.142
   73   1HB   LYS  19          1HB       LYS  19   0.029  -9.489   7.012
   74   2HB   LYS  19          2HB       LYS  19  -0.767  -8.065   6.343
   75   1HG   LYS  19          1HG       LYS  19  -2.082  -9.514   4.864
   76   2HG   LYS  19          2HG       LYS  19  -1.299 -10.928   5.554
   77   1HD   LYS  19          1HD       LYS  19  -3.394 -10.697   6.546
   78   2HD   LYS  19          2HD       LYS  19  -2.125 -10.230   7.730
   79   1HE   LYS  19          1HE       LYS  19  -2.656  -7.908   7.368
   80   2HE   LYS  19          2HE       LYS  19  -3.854  -8.350   6.147
   81   1HZ   LYS  19          1HZ       LYS  19  -4.873  -7.870   8.303
   82   2HZ   LYS  19          2HZ       LYS  19  -3.982  -9.085   9.021
   83   3HZ   LYS  19          3HZ       LYS  19  -5.142  -9.463   7.865
   84    H    GLU  20           H        GLU  20   2.669  -9.602   6.252
   85    HA   GLU  20           HA       GLU  20   3.633  -6.998   6.956
   86   1HB   GLU  20          1HB       GLU  20   5.110  -9.623   6.814
   87   2HB   GLU  20          2HB       GLU  20   5.589  -8.206   7.743
   88   1HG   GLU  20          1HG       GLU  20   2.966  -9.338   8.128
   89   2HG   GLU  20          2HG       GLU  20   4.325 -10.241   8.816
   90    H    VAL  21           H        VAL  21   4.599  -9.492   4.681
   91    HA   VAL  21           HA       VAL  21   6.700  -8.087   3.367
   92    HB   VAL  21           HB       VAL  21   4.865 -10.271   2.314
   93   1HG1  VAL  21          1HG1      VAL  21   7.565  -9.369   1.307
   94   2HG1  VAL  21          2HG1      VAL  21   6.018  -9.096   0.509
   95   3HG1  VAL  21          3HG1      VAL  21   6.641 -10.738   0.685
   96   1HG2  VAL  21          1HG2      VAL  21   6.679 -11.824   2.884
   97   2HG2  VAL  21          2HG2      VAL  21   6.048 -10.999   4.310
   98   3HG2  VAL  21          3HG2      VAL  21   7.583 -10.493   3.606
   99    H    PHE  22           H        PHE  22   3.284  -8.280   2.875
  100    HA   PHE  22           HA       PHE  22   3.255  -6.887   0.365
  101   1HB   PHE  22          1HB       PHE  22   1.370  -8.218   0.661
  102   2HB   PHE  22          2HB       PHE  22   1.181  -7.728   2.341
  103    HD1  PHE  22           1HD      PHE  22   1.182  -6.192  -1.029
  104    HD2  PHE  22           2HD      PHE  22  -0.568  -6.347   2.812
  105    HE1  PHE  22           1HE      PHE  22  -0.452  -4.419  -1.674
  106    HE2  PHE  22           2HE      PHE  22  -2.167  -4.635   2.183
  107    HZ   PHE  22           HZ       PHE  22  -2.156  -3.660   0.010
  108    H    ARG  23           H        ARG  23   2.331  -5.955   3.593
  109    HA   ARG  23           HA       ARG  23   1.923  -3.261   2.863
  110   1HB   ARG  23          1HB       ARG  23   1.770  -2.690   5.194
  111   2HB   ARG  23          2HB       ARG  23   1.042  -4.266   4.947
  112   1HG   ARG  23          1HG       ARG  23   2.207  -4.663   6.894
  113   2HG   ARG  23          2HG       ARG  23   3.374  -5.127   5.673
  114   1HD   ARG  23          1HD       ARG  23   4.374  -3.722   7.460
  115   2HD   ARG  23          2HD       ARG  23   4.583  -3.105   5.825
  116    HE   ARG  23           HE       ARG  23   2.289  -2.045   7.177
  117   1HH1  ARG  23          1HH1      ARG  23   5.755  -1.603   6.656
  118   2HH1  ARG  23          2HH1      ARG  23   5.729   0.066   7.017
  119   1HH2  ARG  23          1HH2      ARG  23   2.291   0.235   7.679
  120   2HH2  ARG  23          2HH2      ARG  23   3.744   1.124   7.652
  121    H    LYS  24           H        LYS  24   4.826  -4.967   3.576
  122    HA   LYS  24           HA       LYS  24   6.401  -2.693   4.167
  123   1HB   LYS  24          1HB       LYS  24   6.774  -5.125   4.732
  124   2HB   LYS  24          2HB       LYS  24   7.402  -5.296   3.101
  125   1HG   LYS  24          1HG       LYS  24   9.090  -3.604   3.581
  126   2HG   LYS  24          2HG       LYS  24   8.462  -3.456   5.225
  127   1HD   LYS  24          1HD       LYS  24   9.549  -5.928   3.960
  128   2HD   LYS  24          2HD       LYS  24  10.408  -4.895   5.118
  129   1HE   LYS  24          1HE       LYS  24   7.851  -6.450   5.696
  130   2HE   LYS  24          2HE       LYS  24   9.460  -6.952   6.166
  131   1HZ   LYS  24          1HZ       LYS  24   9.663  -5.007   7.544
  132   2HZ   LYS  24          2HZ       LYS  24   8.295  -5.882   7.983
  133   3HZ   LYS  24          3HZ       LYS  24   8.127  -4.460   7.108
  134    H    GLU  25           H        GLU  25   5.878  -4.707   1.226
  135    HA   GLU  25           HA       GLU  25   7.646  -3.486  -0.504
  136   1HB   GLU  25          1HB       GLU  25   4.862  -4.387  -1.131
  137   2HB   GLU  25          2HB       GLU  25   6.193  -4.240  -2.253
  138   1HG   GLU  25          1HG       GLU  25   6.370  -5.981   0.068
  139   2HG   GLU  25          2HG       GLU  25   5.372  -6.377  -1.342
  140    H    MET  26           H        MET  26   4.252  -3.144   0.068
  141    HA   MET  26           HA       MET  26   3.761  -1.060  -1.668
  142   1HB   MET  26          1HB       MET  26   2.147  -2.656  -0.854
  143   2HB   MET  26          2HB       MET  26   2.249  -1.900   0.724
  144   1HG   MET  26          1HG       MET  26   0.262  -1.196  -0.770
  145   2HG   MET  26          2HG       MET  26   1.186   0.044   0.076
  146   1HE   MET  26          1HE       MET  26   0.191  -1.436  -3.429
  147   2HE   MET  26          2HE       MET  26   1.917  -1.867  -3.555
  148   3HE   MET  26          3HE       MET  26   1.239  -0.510  -4.486
  149    H    SER  27           H        SER  27   4.462  -0.919   1.757
  150    HA   SER  27           HA       SER  27   4.118   1.849   1.982
  151   1HB   SER  27          1HB       SER  27   5.957   0.043   3.558
  152   2HB   SER  27          2HB       SER  27   5.801   1.767   3.890
  153    HG   SER  27           HG       SER  27   3.384   0.903   3.729
  154    H    GLN  28           H        GLN  28   6.840  -0.119   0.924
  155    HA   GLN  28           HA       GLN  28   8.530   2.160   0.596
  156   1HB   GLN  28          1HB       GLN  28   8.698  -0.560  -0.704
  157   2HB   GLN  28          2HB       GLN  28   9.924   0.682  -0.874
  158   1HG   GLN  28          1HG       GLN  28  10.241   0.597   1.602
  159   2HG   GLN  28          2HG       GLN  28   9.127  -0.772   1.631
  160   1HE2  GLN  28          1HE2      GLN  28   9.788  -2.733   0.783
  161   2HE2  GLN  28          2HE2      GLN  28  11.436  -3.058   0.398
  162    H    PHE  29           H        PHE  29   6.479   0.426  -1.574
  163    HA   PHE  29           HA       PHE  29   6.984   1.846  -3.904
  164   1HB   PHE  29          1HB       PHE  29   5.776  -0.275  -3.897
  165   2HB   PHE  29          2HB       PHE  29   4.473   0.443  -2.969
  166    HD1  PHE  29           1HD      PHE  29   6.085   0.297  -6.261
  167    HD2  PHE  29           2HD      PHE  29   2.749   1.694  -4.024
  168    HE1  PHE  29           1HE      PHE  29   4.878   0.801  -8.345
  169    HE2  PHE  29           2HE      PHE  29   1.565   2.204  -6.082
  170    HZ   PHE  29           HZ       PHE  29   2.580   1.773  -8.223
  171    H    ILE  30           H        ILE  30   4.475   2.355  -1.461
  172    HA   ILE  30           HA       ILE  30   3.394   4.648  -2.608
  173    HB   ILE  30           HB       ILE  30   3.312   3.643   0.234
  174   1HG1  ILE  30          1HG1      ILE  30   1.168   3.823  -1.872
  175   2HG1  ILE  30          2HG1      ILE  30   2.180   2.407  -1.630
  176   1HG2  ILE  30          1HG2      ILE  30   1.564   5.326   0.678
  177   2HG2  ILE  30          2HG2      ILE  30   1.817   5.995  -0.942
  178   3HG2  ILE  30          3HG2      ILE  30   3.098   6.100   0.246
  179   1HD1  ILE  30          1HD1      ILE  30   0.300   3.582   0.409
  180   2HD1  ILE  30          2HD1      ILE  30   1.330   2.172   0.613
  181   3HD1  ILE  30          3HD1      ILE  30   0.033   2.132  -0.553
  182    H    VAL  31           H        VAL  31   5.832   4.274  -0.012
  183    HA   VAL  31           HA       VAL  31   6.401   6.922   0.390
  184    HB   VAL  31           HB       VAL  31   8.155   4.459   0.425
  185   1HG1  VAL  31          1HG1      VAL  31   9.579   6.501  -0.175
  186   2HG1  VAL  31          2HG1      VAL  31  10.022   5.647   1.291
  187   3HG1  VAL  31          3HG1      VAL  31   9.137   7.153   1.417
  188   1HG2  VAL  31          1HG2      VAL  31   8.140   4.870   2.847
  189   2HG2  VAL  31          2HG2      VAL  31   6.499   4.772   2.192
  190   3HG2  VAL  31          3HG2      VAL  31   7.193   6.335   2.580
  191    H    GLN  32           H        GLN  32   7.720   4.821  -2.160
  192    HA   GLN  32           HA       GLN  32   9.363   6.554  -3.424
  193   1HB   GLN  32          1HB       GLN  32   9.136   4.146  -3.809
  194   2HB   GLN  32          2HB       GLN  32   7.610   4.418  -4.614
  195   1HG   GLN  32          1HG       GLN  32   8.789   5.726  -6.322
  196   2HG   GLN  32          2HG       GLN  32  10.313   5.293  -5.530
  197   1HE2  GLN  32          1HE2      GLN  32  10.961   3.115  -5.529
  198   2HE2  GLN  32          2HE2      GLN  32  10.333   1.986  -6.660
  199    H    CYS  33           H        CYS  33   5.947   5.858  -3.905
  200    HA   CYS  33           HA       CYS  33   5.394   7.565  -6.059
  201   1HB   CYS  33          1HB       CYS  33   3.690   6.337  -3.955
  202   2HB   CYS  33          2HB       CYS  33   3.014   7.227  -5.331
  203    HG   CYS  33           HG       CYS  33   4.654   4.269  -5.231
  204    H    LEU  34           H        LEU  34   5.220   8.067  -2.622
  205    HA   LEU  34           HA       LEU  34   4.075  10.685  -2.866
  206   1HB   LEU  34          1HB       LEU  34   5.269   9.322  -0.478
  207   2HB   LEU  34          2HB       LEU  34   4.488  10.884  -0.434
  208    HG   LEU  34           HG       LEU  34   3.204   8.254  -1.100
  209   1HD1  LEU  34          1HD1      LEU  34   2.903  10.130   1.250
  210   2HD1  LEU  34          2HD1      LEU  34   3.742   8.585   1.262
  211   3HD1  LEU  34          3HD1      LEU  34   1.997   8.636   1.005
  212   1HD2  LEU  34          1HD2      LEU  34   1.098   9.511  -1.093
  213   2HD2  LEU  34          2HD2      LEU  34   2.168  10.012  -2.397
  214   3HD2  LEU  34          3HD2      LEU  34   2.006  11.015  -0.954
  215    H    ASN  35           H        ASN  35   7.320   9.464  -2.753
  216    HA   ASN  35           HA       ASN  35   8.828  11.425  -2.010
  217   1HB   ASN  35          1HB       ASN  35   9.140   9.449  -4.030
  218   2HB   ASN  35          2HB       ASN  35  10.146  10.887  -4.343
  219   1HD2  ASN  35          1HD2      ASN  35   9.081   8.724  -1.882
  220   2HD2  ASN  35          2HD2      ASN  35  10.452   8.931  -0.900
  221    HA   PRO  36           HA       PRO  36   8.394  14.295  -5.900
  222   1HB   PRO  36          1HB       PRO  36   6.163  14.010  -7.453
  223   2HB   PRO  36          2HB       PRO  36   7.693  13.210  -7.819
  224   1HG   PRO  36          1HG       PRO  36   5.266  12.101  -6.455
  225   2HG   PRO  36          2HG       PRO  36   6.304  11.350  -7.680
  226   1HD   PRO  36          1HD       PRO  36   6.471  10.794  -5.057
  227   2HD   PRO  36          2HD       PRO  36   7.888  10.734  -6.103
  228    H    TYR  37           H        TYR  37   5.893  13.311  -3.826
  229    HA   TYR  37           HA       TYR  37   4.388  15.771  -4.063
  230   1HB   TYR  37          1HB       TYR  37   4.059  13.394  -2.243
  231   2HB   TYR  37          2HB       TYR  37   3.009  14.806  -2.227
  232    HD1  TYR  37           1HD      TYR  37   4.184  12.012  -4.316
  233    HD2  TYR  37           2HD      TYR  37   1.241  15.005  -3.754
  234    HE1  TYR  37           1HE      TYR  37   2.847  10.987  -6.045
  235    HE2  TYR  37           2HE      TYR  37  -0.114  14.028  -5.483
  236    HH   TYR  37           HH       TYR  37   0.123  12.659  -7.349
  237    H    ARG  38           H        ARG  38   6.819  14.382  -2.068
  238    HA   ARG  38           HA       ARG  38   6.420  16.360   0.021
  239   1HB   ARG  38          1HB       ARG  38   8.313  15.348   1.143
  240   2HB   ARG  38          2HB       ARG  38   7.172  14.114   0.627
  241   1HG   ARG  38          1HG       ARG  38   8.548  13.568  -1.244
  242   2HG   ARG  38          2HG       ARG  38   9.671  14.857  -0.846
  243   1HD   ARG  38          1HD       ARG  38  10.081  13.756   1.345
  244   2HD   ARG  38          2HD       ARG  38   8.989  12.466   0.852
  245    HE   ARG  38           HE       ARG  38  10.722  12.212  -1.058
  246   1HH1  ARG  38          1HH1      ARG  38  11.540  13.132   2.267
  247   2HH1  ARG  38          2HH1      ARG  38  12.993  12.256   2.280
  248   1HH2  ARG  38          1HH2      ARG  38  12.699  11.031  -1.014
  249   2HH2  ARG  38          2HH2      ARG  38  13.676  11.038   0.388
  250    H    LYS  39           H        LYS  39   7.665  16.534  -2.894
  251    HA   LYS  39           HA       LYS  39   9.980  18.167  -2.395
  252   1HB   LYS  39          1HB       LYS  39   8.290  17.981  -4.900
  253   2HB   LYS  39          2HB       LYS  39   9.908  18.649  -4.785
  254   1HG   LYS  39          1HG       LYS  39   9.081  15.777  -4.499
  255   2HG   LYS  39          2HG       LYS  39  10.063  16.498  -5.779
  256   1HD   LYS  39          1HD       LYS  39  11.792  17.025  -4.115
  257   2HD   LYS  39          2HD       LYS  39  10.802  16.252  -2.874
  258   1HE   LYS  39          1HE       LYS  39  12.424  14.671  -3.555
  259   2HE   LYS  39          2HE       LYS  39  10.862  14.189  -4.216
  260   1HZ   LYS  39          1HZ       LYS  39  12.697  14.004  -5.848
  261   2HZ   LYS  39          2HZ       LYS  39  12.926  15.667  -5.754
  262   3HZ   LYS  39          3HZ       LYS  39  11.480  15.057  -6.356
  263    HA   PRO  40           HA       PRO  40   7.709  21.856  -1.358
  264   1HB   PRO  40          1HB       PRO  40   9.494  23.731  -2.231
  265   2HB   PRO  40          2HB       PRO  40   9.693  22.829  -0.726
  266   1HG   PRO  40          1HG       PRO  40  10.907  22.298  -3.418
  267   2HG   PRO  40          2HG       PRO  40  11.681  22.283  -1.823
  268   1HD   PRO  40          1HD       PRO  40  10.967  20.018  -3.018
  269   2HD   PRO  40          2HD       PRO  40  10.767  20.220  -1.262
  270    H    ASP  41           H        ASP  41   8.608  21.047  -4.634
  271    HA   ASP  41           HA       ASP  41   7.171  23.257  -5.729
  272   1HB   ASP  41          1HB       ASP  41   8.196  22.368  -7.799
  273   2HB   ASP  41          2HB       ASP  41   9.350  23.034  -6.644
  274    H    CYS  42           H        CYS  42   6.358  20.552  -4.494
  275    HA   CYS  42           HA       CYS  42   4.879  19.280  -6.617
  276   1HB   CYS  42          1HB       CYS  42   5.373  18.052  -4.542
  277   2HB   CYS  42          2HB       CYS  42   4.308  19.149  -3.660
  278    HG   CYS  42           HG       CYS  42   2.568  17.206  -3.776
  279    H    LYS  43           H        LYS  43   3.189  20.014  -7.641
  280    HA   LYS  43           HA       LYS  43   1.946  22.452  -6.841
  281   1HB   LYS  43          1HB       LYS  43   1.313  20.568  -9.108
  282   2HB   LYS  43          2HB       LYS  43   0.482  22.078  -8.828
  283   1HG   LYS  43          1HG       LYS  43   3.421  21.792  -9.438
  284   2HG   LYS  43          2HG       LYS  43   2.166  22.264 -10.585
  285   1HD   LYS  43          1HD       LYS  43   1.648  24.194  -9.036
  286   2HD   LYS  43          2HD       LYS  43   3.120  23.778  -8.159
  287   1HE   LYS  43          1HE       LYS  43   2.914  24.556 -11.065
  288   2HE   LYS  43          2HE       LYS  43   3.530  25.558  -9.758
  289   1HZ   LYS  43          1HZ       LYS  43   4.764  23.001 -10.654
  290   2HZ   LYS  43          2HZ       LYS  43   5.367  24.029  -9.477
  291   3HZ   LYS  43          3HZ       LYS  43   5.279  24.533 -11.082
  292    H    VAL  44           H        VAL  44   1.069  19.067  -6.719
  293    HA   VAL  44           HA       VAL  44  -1.410  19.833  -5.371
  294    HB   VAL  44           HB       VAL  44  -1.229  17.654  -7.476
  295   1HG1  VAL  44          1HG1      VAL  44  -3.585  18.542  -5.813
  296   2HG1  VAL  44          2HG1      VAL  44  -2.734  17.002  -5.680
  297   3HG1  VAL  44          3HG1      VAL  44  -3.647  17.381  -7.137
  298   1HG2  VAL  44          1HG2      VAL  44  -1.326  19.865  -8.490
  299   2HG2  VAL  44          2HG2      VAL  44  -2.739  20.266  -7.513
  300   3HG2  VAL  44          3HG2      VAL  44  -2.846  19.005  -8.741
  301    H    GLY  45           H        GLY  45  -1.523  18.996  -3.518
  302   1HA   GLY  45          1HA       GLY  45  -1.311  17.555  -1.748
  303   2HA   GLY  45          2HA       GLY  45  -0.853  16.295  -2.893
  304    H    ARG  46           H        ARG  46   0.723  19.487  -1.949
  305    HA   ARG  46           HA       ARG  46   3.238  18.199  -1.986
  306   1HB   ARG  46          1HB       ARG  46   2.676  20.613  -2.675
  307   2HB   ARG  46          2HB       ARG  46   2.508  20.944  -0.962
  308   1HG   ARG  46          1HG       ARG  46   5.062  19.784  -1.993
  309   2HG   ARG  46          2HG       ARG  46   4.742  21.518  -2.165
  310   1HD   ARG  46          1HD       ARG  46   4.829  19.902   0.363
  311   2HD   ARG  46          2HD       ARG  46   6.101  20.941  -0.302
  312    HE   ARG  46           HE       ARG  46   3.845  22.495  -0.132
  313   1HH1  ARG  46          1HH1      ARG  46   5.955  20.839   2.164
  314   2HH1  ARG  46          2HH1      ARG  46   5.704  21.949   3.426
  315   1HH2  ARG  46          1HH2      ARG  46   3.466  23.987   1.550
  316   2HH2  ARG  46          2HH2      ARG  46   4.195  23.809   3.083
  317    H    ILE  47           H        ILE  47   4.015  17.122  -0.392
  318    HA   ILE  47           HA       ILE  47   2.717  17.096   2.145
  319    HB   ILE  47           HB       ILE  47   5.271  15.577   1.399
  320   1HG1  ILE  47          1HG1      ILE  47   2.379  14.665   1.495
  321   2HG1  ILE  47          2HG1      ILE  47   3.223  15.078   0.015
  322   1HG2  ILE  47          1HG2      ILE  47   3.497  15.402   3.788
  323   2HG2  ILE  47          2HG2      ILE  47   5.206  15.803   3.713
  324   3HG2  ILE  47          3HG2      ILE  47   4.655  14.188   3.280
  325   1HD1  ILE  47          1HD1      ILE  47   3.104  12.673   0.401
  326   2HD1  ILE  47          2HD1      ILE  47   4.022  12.875   1.896
  327   3HD1  ILE  47          3HD1      ILE  47   4.758  13.266   0.340
  328    H    THR  48           H        THR  48   3.037  18.176   3.778
  329    HA   THR  48           HA       THR  48   4.614  20.383   3.936
  330    HB   THR  48           HB       THR  48   3.866  20.183   6.397
  331    HG1  THR  48           1HG      THR  48   2.212  18.577   6.616
  332   1HG2  THR  48          1HG2      THR  48   2.732  21.493   4.666
  333   2HG2  THR  48          2HG2      THR  48   1.581  20.670   5.760
  334   3HG2  THR  48          3HG2      THR  48   1.944  19.990   4.157
  335    H    THR  49           H        THR  49   4.819  17.403   5.751
  336    HA   THR  49           HA       THR  49   7.644  17.941   6.280
  337    HB   THR  49           HB       THR  49   6.522  16.999   8.743
  338    HG1  THR  49           1HG      THR  49   4.584  17.976   8.248
  339   1HG2  THR  49          1HG2      THR  49   7.769  19.645   7.951
  340   2HG2  THR  49          2HG2      THR  49   8.646  18.213   8.490
  341   3HG2  THR  49          3HG2      THR  49   7.571  19.058   9.604
  342    H    THR  50           H        THR  50   8.704  16.134   7.457
  343    HA   THR  50           HA       THR  50   8.517  13.818   5.904
  344    HB   THR  50           HB       THR  50  10.502  14.615   6.804
  345    HG1  THR  50           1HG      THR  50  10.524  12.388   6.459
  346   1HG2  THR  50          1HG2      THR  50   9.494  13.912   9.540
  347   2HG2  THR  50          2HG2      THR  50   9.741  15.516   8.878
  348   3HG2  THR  50          3HG2      THR  50  11.144  14.468   9.184
  349    H    GLU  51           H        GLU  51   7.536  14.462   9.249
  350    HA   GLU  51           HA       GLU  51   6.670  11.850   9.764
  351   1HB   GLU  51          1HB       GLU  51   5.421  12.805  11.660
  352   2HB   GLU  51          2HB       GLU  51   7.068  13.396  11.598
  353   1HG   GLU  51          1HG       GLU  51   4.899  15.019  10.356
  354   2HG   GLU  51          2HG       GLU  51   5.071  14.983  12.103
  355    H    ASP  52           H        ASP  52   5.073  14.566   8.091
  356    HA   ASP  52           HA       ASP  52   2.501  13.408   8.063
  357   1HB   ASP  52          1HB       ASP  52   3.947  15.570   6.581
  358   2HB   ASP  52          2HB       ASP  52   2.299  15.100   6.194
  359    H    PHE  53           H        PHE  53   5.283  13.517   5.946
  360    HA   PHE  53           HA       PHE  53   4.205  12.172   3.774
  361   1HB   PHE  53          1HB       PHE  53   6.377  13.274   3.594
  362   2HB   PHE  53          2HB       PHE  53   6.990  12.354   4.951
  363    HD1  PHE  53           1HD      PHE  53   6.203  12.274   1.405
  364    HD2  PHE  53           2HD      PHE  53   7.751  10.120   4.706
  365    HE1  PHE  53           1HE      PHE  53   7.127  10.602  -0.124
  366    HE2  PHE  53           2HE      PHE  53   8.659   8.451   3.241
  367    HZ   PHE  53           HZ       PHE  53   8.357   8.705   0.738
  368    H    LYS  54           H        LYS  54   5.838  11.006   6.588
  369    HA   LYS  54           HA       LYS  54   5.770   8.176   6.083
  370   1HB   LYS  54          1HB       LYS  54   5.972   9.735   8.634
  371   2HB   LYS  54          2HB       LYS  54   6.182   7.994   8.499
  372   1HG   LYS  54          1HG       LYS  54   8.101   8.282   7.080
  373   2HG   LYS  54          2HG       LYS  54   7.843  10.028   7.029
  374   1HD   LYS  54          1HD       LYS  54   8.235  10.176   9.399
  375   2HD   LYS  54          2HD       LYS  54   8.428   8.419   9.492
  376   1HE   LYS  54          1HE       LYS  54  10.177  10.314   7.928
  377   2HE   LYS  54          2HE       LYS  54  10.584   9.610   9.490
  378   1HZ   LYS  54          1HZ       LYS  54  11.625   8.386   7.727
  379   2HZ   LYS  54          2HZ       LYS  54  10.160   8.124   6.956
  380   3HZ   LYS  54          3HZ       LYS  54  10.468   7.403   8.454
  381    H    HIS  55           H        HIS  55   3.536  10.360   7.762
  382    HA   HIS  55           HA       HIS  55   1.826   8.326   8.835
  383   1HB   HIS  55          1HB       HIS  55   1.904  10.675   9.709
  384   2HB   HIS  55          2HB       HIS  55   1.321  11.237   8.163
  385    HD1  HIS  55           1HD      HIS  55   0.131   9.405  11.223
  386    HD2  HIS  55           2HD      HIS  55  -1.477  11.162   7.800
  387    HE1  HIS  55           1HE      HIS  55  -2.341   9.367  11.537
  388    H    LEU  56           H        LEU  56   1.692  10.336   6.014
  389    HA   LEU  56           HA       LEU  56  -0.731   9.178   5.054
  390   1HB   LEU  56          1HB       LEU  56   0.931  11.286   4.307
  391   2HB   LEU  56          2HB       LEU  56   1.018  10.132   2.998
  392    HG   LEU  56           HG       LEU  56  -1.099  11.907   3.917
  393   1HD1  LEU  56          1HD1      LEU  56  -0.420  10.874   1.206
  394   2HD1  LEU  56          2HD1      LEU  56   0.112  12.371   1.955
  395   3HD1  LEU  56          3HD1      LEU  56  -1.588  12.148   1.579
  396   1HD2  LEU  56          1HD2      LEU  56  -1.856   9.182   2.836
  397   2HD2  LEU  56          2HD2      LEU  56  -2.946  10.567   2.959
  398   3HD2  LEU  56          3HD2      LEU  56  -2.317   9.864   4.400
  399    H    ALA  57           H        ALA  57   2.724   8.469   4.295
  400    HA   ALA  57           HA       ALA  57   2.140   6.577   2.367
  401   1HB   ALA  57          1HB       ALA  57   4.424   7.480   2.837
  402   2HB   ALA  57          2HB       ALA  57   4.382   5.723   2.730
  403   3HB   ALA  57          3HB       ALA  57   4.457   6.506   4.307
  404    H    ARG  58           H        ARG  58   2.325   6.249   5.802
  405    HA   ARG  58           HA       ARG  58   2.012   3.409   5.639
  406   1HB   ARG  58          1HB       ARG  58   1.989   3.294   8.086
  407   2HB   ARG  58          2HB       ARG  58   3.225   4.406   7.550
  408   1HG   ARG  58          1HG       ARG  58   2.374   5.414   9.440
  409   2HG   ARG  58          2HG       ARG  58   1.546   6.252   8.133
  410   1HD   ARG  58          1HD       ARG  58  -0.465   5.031   8.519
  411   2HD   ARG  58          2HD       ARG  58   0.351   3.915   9.614
  412    HE   ARG  58           HE       ARG  58   0.671   6.454  10.649
  413   1HH1  ARG  58          1HH1      ARG  58  -2.046   4.324   9.966
  414   2HH1  ARG  58          2HH1      ARG  58  -2.969   4.779  11.322
  415   1HH2  ARG  58          1HH2      ARG  58  -0.602   7.107  12.570
  416   2HH2  ARG  58          2HH2      ARG  58  -2.140   6.419  12.806
  417    H    LYS  59           H        LYS  59  -0.233   6.029   6.176
  418    HA   LYS  59           HA       LYS  59  -2.422   4.401   6.811
  419   1HB   LYS  59          1HB       LYS  59  -2.456   6.772   7.305
  420   2HB   LYS  59          2HB       LYS  59  -2.366   7.160   5.588
  421   1HG   LYS  59          1HG       LYS  59  -4.525   6.147   5.213
  422   2HG   LYS  59          2HG       LYS  59  -4.609   5.659   6.901
  423   1HD   LYS  59          1HD       LYS  59  -4.606   8.014   7.565
  424   2HD   LYS  59          2HD       LYS  59  -4.552   8.488   5.861
  425   1HE   LYS  59          1HE       LYS  59  -6.653   7.451   5.432
  426   2HE   LYS  59          2HE       LYS  59  -6.677   6.725   7.036
  427   1HZ   LYS  59          1HZ       LYS  59  -7.017   9.606   6.364
  428   2HZ   LYS  59          2HZ       LYS  59  -6.684   9.039   7.894
  429   3HZ   LYS  59          3HZ       LYS  59  -8.085   8.538   7.134
  430    H    LEU  60           H        LEU  60  -1.223   5.733   3.765
  431    HA   LEU  60           HA       LEU  60  -3.318   4.910   2.227
  432   1HB   LEU  60          1HB       LEU  60  -0.470   5.409   1.503
  433   2HB   LEU  60          2HB       LEU  60  -1.748   5.274   0.284
  434    HG   LEU  60           HG       LEU  60  -1.919   7.145   2.556
  435   1HD1  LEU  60          1HD1      LEU  60   0.054   7.899   1.519
  436   2HD1  LEU  60          2HD1      LEU  60  -1.195   8.941   0.814
  437   3HD1  LEU  60          3HD1      LEU  60  -0.541   7.582  -0.092
  438   1HD2  LEU  60          1HD2      LEU  60  -3.488   8.346   1.059
  439   2HD2  LEU  60          2HD2      LEU  60  -3.964   6.688   1.444
  440   3HD2  LEU  60          3HD2      LEU  60  -3.262   7.057  -0.131
  441    H    THR  61           H        THR  61  -0.246   3.453   3.034
  442    HA   THR  61           HA       THR  61  -0.273   1.087   1.545
  443    HB   THR  61           HB       THR  61   0.657   1.392   4.423
  444    HG1  THR  61           1HG      THR  61   1.752   2.805   2.963
  445   1HG2  THR  61          1HG2      THR  61   2.086  -0.551   3.951
  446   2HG2  THR  61          2HG2      THR  61   1.370  -0.683   2.345
  447   3HG2  THR  61          3HG2      THR  61   0.378  -0.955   3.778
  448    H    HIS  62           H        HIS  62  -1.759   1.939   4.553
  449    HA   HIS  62           HA       HIS  62  -2.779  -0.715   4.897
  450   1HB   HIS  62          1HB       HIS  62  -2.118   0.694   6.817
  451   2HB   HIS  62          2HB       HIS  62  -3.462   1.765   6.452
  452    HD1  HIS  62           1HD      HIS  62  -3.009  -1.939   7.279
  453    HD2  HIS  62           2HD      HIS  62  -5.613   1.216   7.956
  454    HE1  HIS  62           1HE      HIS  62  -4.806  -2.871   8.740
  455    H    GLY  63           H        GLY  63  -4.158   2.261   3.542
  456   1HA   GLY  63          1HA       GLY  63  -6.812   1.234   3.665
  457   2HA   GLY  63          2HA       GLY  63  -6.346   2.654   2.776
  458    H    VAL  64           H        VAL  64  -4.264   1.173   1.223
  459    HA   VAL  64           HA       VAL  64  -5.932   0.013  -0.861
  460    HB   VAL  64           HB       VAL  64  -2.916  -0.196  -0.425
  461   1HG1  VAL  64          1HG1      VAL  64  -3.770  -2.068  -1.855
  462   2HG1  VAL  64          2HG1      VAL  64  -2.768  -0.978  -2.783
  463   3HG1  VAL  64          3HG1      VAL  64  -4.506  -0.892  -2.935
  464   1HG2  VAL  64          1HG2      VAL  64  -2.742   1.461  -2.225
  465   2HG2  VAL  64          2HG2      VAL  64  -3.631   2.095  -0.838
  466   3HG2  VAL  64          3HG2      VAL  64  -4.499   1.576  -2.286
  467    H    MET  65           H        MET  65  -4.181  -1.029   1.713
  468    HA   MET  65           HA       MET  65  -4.144  -3.862   1.309
  469   1HB   MET  65          1HB       MET  65  -2.589  -2.843   2.897
  470   2HB   MET  65          2HB       MET  65  -3.915  -2.237   3.840
  471   1HG   MET  65          1HG       MET  65  -4.540  -4.345   4.552
  472   2HG   MET  65          2HG       MET  65  -3.339  -5.151   3.560
  473   1HE   MET  65          1HE       MET  65  -3.686  -5.360   6.617
  474   2HE   MET  65          2HE       MET  65  -2.035  -5.400   7.260
  475   3HE   MET  65          3HE       MET  65  -2.458  -6.344   5.818
  476    H    ASN  66           H        ASN  66  -6.220  -1.772   3.326
  477    HA   ASN  66           HA       ASN  66  -7.997  -3.787   4.155
  478   1HB   ASN  66          1HB       ASN  66  -8.056  -0.825   3.937
  479   2HB   ASN  66          2HB       ASN  66  -9.471  -1.661   4.493
  480   1HD2  ASN  66          1HD2      ASN  66  -8.033   0.262   5.839
  481   2HD2  ASN  66          2HD2      ASN  66  -7.289  -0.498   7.212
  482    H    LYS  67           H        LYS  67  -8.038  -1.568   1.425
  483    HA   LYS  67           HA       LYS  67 -10.622  -2.033   0.532
  484   1HB   LYS  67          1HB       LYS  67  -8.602  -0.410  -0.170
  485   2HB   LYS  67          2HB       LYS  67  -8.386  -1.628  -1.405
  486   1HG   LYS  67          1HG       LYS  67 -10.936  -0.080  -0.955
  487   2HG   LYS  67          2HG       LYS  67  -9.692   0.353  -2.116
  488   1HD   LYS  67          1HD       LYS  67 -10.066  -1.764  -3.288
  489   2HD   LYS  67          2HD       LYS  67 -11.321  -2.185  -2.116
  490   1HE   LYS  67          1HE       LYS  67 -12.329  -1.277  -4.129
  491   2HE   LYS  67          2HE       LYS  67 -12.587  -0.194  -2.771
  492   1HZ   LYS  67          1HZ       LYS  67 -10.563   0.137  -4.918
  493   2HZ   LYS  67          2HZ       LYS  67 -10.731   1.196  -3.621
  494   3HZ   LYS  67          3HZ       LYS  67 -11.971   1.028  -4.749
  495    H    GLU  68           H        GLU  68  -7.541  -3.670  -0.354
  496    HA   GLU  68           HA       GLU  68  -9.017  -5.426  -1.951
  497   1HB   GLU  68          1HB       GLU  68  -6.886  -6.542  -2.385
  498   2HB   GLU  68          2HB       GLU  68  -6.990  -4.804  -2.702
  499   1HG   GLU  68          1HG       GLU  68  -5.746  -4.355  -0.670
  500   2HG   GLU  68          2HG       GLU  68  -5.507  -6.088  -0.428
  501    H    LEU  69           H        LEU  69  -7.651  -5.690   1.272
  502    HA   LEU  69           HA       LEU  69  -8.416  -8.315   1.609
  503   1HB   LEU  69          1HB       LEU  69  -8.301  -6.046   3.571
  504   2HB   LEU  69          2HB       LEU  69  -8.725  -7.672   4.065
  505    HG   LEU  69           HG       LEU  69  -6.121  -6.940   2.722
  506   1HD1  LEU  69          1HD1      LEU  69  -6.282  -5.883   4.908
  507   2HD1  LEU  69          2HD1      LEU  69  -5.122  -7.210   4.916
  508   3HD1  LEU  69          3HD1      LEU  69  -6.723  -7.432   5.629
  509   1HD2  LEU  69          1HD2      LEU  69  -6.719  -9.256   2.363
  510   2HD2  LEU  69          2HD2      LEU  69  -7.113  -9.447   4.067
  511   3HD2  LEU  69          3HD2      LEU  69  -5.446  -9.175   3.584
  512    H    LYS  70           H        LYS  70 -10.552  -5.504   1.365
  513    HA   LYS  70           HA       LYS  70 -12.810  -6.881   2.437
  514   1HB   LYS  70          1HB       LYS  70 -12.648  -4.535   0.550
  515   2HB   LYS  70          2HB       LYS  70 -14.109  -5.091   1.363
  516   1HG   LYS  70          1HG       LYS  70 -12.999  -4.648   3.470
  517   2HG   LYS  70          2HG       LYS  70 -11.641  -3.971   2.574
  518   1HD   LYS  70          1HD       LYS  70 -13.206  -2.393   1.497
  519   2HD   LYS  70          2HD       LYS  70 -14.475  -2.968   2.581
  520   1HE   LYS  70          1HE       LYS  70 -11.866  -1.740   3.399
  521   2HE   LYS  70          2HE       LYS  70 -13.444  -0.935   3.487
  522   1HZ   LYS  70          1HZ       LYS  70 -12.536  -3.312   5.048
  523   2HZ   LYS  70          2HZ       LYS  70 -14.092  -2.701   5.093
  524   3HZ   LYS  70          3HZ       LYS  70 -12.808  -1.772   5.657
  525    H    TYR  71           H        TYR  71 -11.462  -6.264  -0.699
  526    HA   TYR  71           HA       TYR  71 -13.607  -7.723  -2.052
  527   1HB   TYR  71          1HB       TYR  71 -11.070  -6.475  -3.127
  528   2HB   TYR  71          2HB       TYR  71 -12.271  -7.273  -4.138
  529    HD1  TYR  71           1HD      TYR  71 -12.745  -5.262  -5.446
  530    HD2  TYR  71           2HD      TYR  71 -13.235  -5.267  -1.233
  531    HE1  TYR  71           1HE      TYR  71 -14.019  -3.152  -5.587
  532    HE2  TYR  71           2HE      TYR  71 -14.473  -3.172  -1.350
  533    HH   TYR  71           HH       TYR  71 -15.683  -1.907  -4.223
  534    H    CYS  72           H        CYS  72 -10.456  -8.368  -0.985
  535    HA   CYS  72           HA       CYS  72 -10.673 -11.140  -1.813
  536   1HB   CYS  72          1HB       CYS  72  -8.266  -9.371  -1.475
  537   2HB   CYS  72          2HB       CYS  72  -8.164 -11.111  -1.713
  538    HG   CYS  72           HG       CYS  72  -7.560 -10.309  -4.177
  539    H    LYS  73           H        LYS  73 -11.726 -11.561   0.077
  540    HA   LYS  73           HA       LYS  73 -10.879 -10.747   2.668
  541   1HB   LYS  73          1HB       LYS  73 -12.667 -12.972   1.732
  542   2HB   LYS  73          2HB       LYS  73 -12.477 -12.505   3.399
  543   1HG   LYS  73          1HG       LYS  73 -13.388 -10.496   1.315
  544   2HG   LYS  73          2HG       LYS  73 -14.536 -11.500   2.213
  545   1HD   LYS  73          1HD       LYS  73 -13.580 -10.541   4.307
  546   2HD   LYS  73          2HD       LYS  73 -12.544  -9.522   3.308
  547   1HE   LYS  73          1HE       LYS  73 -14.554  -8.336   4.096
  548   2HE   LYS  73          2HE       LYS  73 -14.471  -8.440   2.340
  549   1HZ   LYS  73          1HZ       LYS  73 -16.067 -10.261   4.048
  550   2HZ   LYS  73          2HZ       LYS  73 -16.114 -10.185   2.361
  551   3HZ   LYS  73          3HZ       LYS  73 -16.686  -8.910   3.289
  552    H    ASN  74           H        ASN  74  -9.873 -13.029   0.489
  553    HA   ASN  74           HA       ASN  74  -8.482 -14.597   2.505
  554   1HB   ASN  74          1HB       ASN  74  -8.859 -15.206  -0.436
  555   2HB   ASN  74          2HB       ASN  74  -8.212 -16.295   0.789
  556   1HD2  ASN  74          1HD2      ASN  74  -9.658 -16.957   2.457
  557   2HD2  ASN  74          2HD2      ASN  74 -11.339 -17.130   2.146
  558    HA   PRO  75           HA       PRO  75  -5.168 -11.802   1.212
  559   1HB   PRO  75          1HB       PRO  75  -3.407 -12.844   2.779
  560   2HB   PRO  75          2HB       PRO  75  -4.492 -11.510   3.197
  561   1HG   PRO  75          1HG       PRO  75  -4.537 -14.437   3.987
  562   2HG   PRO  75          2HG       PRO  75  -5.184 -13.073   4.923
  563   1HD   PRO  75          1HD       PRO  75  -6.677 -14.851   3.491
  564   2HD   PRO  75          2HD       PRO  75  -7.198 -13.195   3.855
  565    H    GLU  76           H        GLU  76  -5.418 -14.869   0.571
  566    HA   GLU  76           HA       GLU  76  -2.782 -15.593  -0.126
  567   1HB   GLU  76          1HB       GLU  76  -4.720 -17.156   0.315
  568   2HB   GLU  76          2HB       GLU  76  -5.365 -16.689  -1.247
  569   1HG   GLU  76          1HG       GLU  76  -3.398 -17.628  -2.338
  570   2HG   GLU  76          2HG       GLU  76  -2.751 -18.090  -0.760
  571    H    ASP  77           H        ASP  77  -4.781 -13.345  -1.181
  572    HA   ASP  77           HA       ASP  77  -3.691 -13.185  -3.954
  573   1HB   ASP  77          1HB       ASP  77  -6.204 -13.548  -3.846
  574   2HB   ASP  77          2HB       ASP  77  -6.307 -12.020  -2.976
  575    H    LEU  78           H        LEU  78  -3.322 -12.061  -0.919
  576    HA   LEU  78           HA       LEU  78  -3.283  -9.275  -1.511
  577   1HB   LEU  78          1HB       LEU  78  -4.195 -10.195   0.602
  578   2HB   LEU  78          2HB       LEU  78  -2.602 -10.882   0.906
  579    HG   LEU  78           HG       LEU  78  -1.738  -8.675   0.798
  580   1HD1  LEU  78          1HD1      LEU  78  -3.321  -6.779   1.350
  581   2HD1  LEU  78          2HD1      LEU  78  -4.656  -7.897   1.072
  582   3HD1  LEU  78          3HD1      LEU  78  -3.570  -7.467  -0.251
  583   1HD2  LEU  78          1HD2      LEU  78  -1.891  -9.762   2.853
  584   2HD2  LEU  78          2HD2      LEU  78  -3.600  -9.373   3.025
  585   3HD2  LEU  78          3HD2      LEU  78  -2.381  -8.093   3.130
  586    H    GLU  79           H        GLU  79  -1.615  -8.964  -2.799
  587    HA   GLU  79           HA       GLU  79   1.120  -9.578  -2.009
  588   1HB   GLU  79          1HB       GLU  79   0.126 -11.334  -3.582
  589   2HB   GLU  79          2HB       GLU  79  -0.218  -9.955  -4.630
  590   1HG   GLU  79          1HG       GLU  79   1.620 -11.000  -5.417
  591   2HG   GLU  79          2HG       GLU  79   2.113  -9.450  -4.756
  592    H    CYS  80           H        CYS  80   2.352  -7.915  -2.630
  593    HA   CYS  80           HA       CYS  80   0.959  -5.605  -3.680
  594   1HB   CYS  80          1HB       CYS  80   2.437  -5.039  -1.868
  595   2HB   CYS  80          2HB       CYS  80   3.819  -5.856  -2.555
  596    HG   CYS  80           HG       CYS  80   4.658  -3.876  -3.979
  597    H    ASN  81           H        ASN  81   0.508  -6.695  -5.519
  598    HA   ASN  81           HA       ASN  81   2.762  -7.256  -7.132
  599   1HB   ASN  81          1HB       ASN  81   1.220  -8.522  -8.647
  600   2HB   ASN  81          2HB       ASN  81   1.038  -9.029  -6.967
  601   1HD2  ASN  81          1HD2      ASN  81  -0.848  -8.591  -6.018
  602   2HD2  ASN  81          2HD2      ASN  81  -2.258  -8.010  -6.797
  603    H    GLU  82           H        GLU  82   1.604  -7.010  -9.668
  604    HA   GLU  82           HA       GLU  82   2.016  -4.481 -10.448
  605   1HB   GLU  82          1HB       GLU  82   0.376  -6.672 -11.421
  606   2HB   GLU  82          2HB       GLU  82   0.823  -5.345 -12.523
  607   1HG   GLU  82          1HG       GLU  82   3.157  -6.024 -12.267
  608   2HG   GLU  82          2HG       GLU  82   2.682  -7.253 -11.094
  609    H    ASN  83           H        ASN  83  -0.997  -6.276 -10.243
  610    HA   ASN  83           HA       ASN  83  -3.016  -4.508 -10.875
  611   1HB   ASN  83          1HB       ASN  83  -3.327  -6.946 -10.537
  612   2HB   ASN  83          2HB       ASN  83  -2.911  -6.778  -8.843
  613   1HD2  ASN  83          1HD2      ASN  83  -4.839  -7.728  -8.227
  614   2HD2  ASN  83          2HD2      ASN  83  -6.351  -6.916  -8.320
  615    H    VAL  84           H        VAL  84  -1.572  -5.341  -7.722
  616    HA   VAL  84           HA       VAL  84  -3.192  -3.592  -6.343
  617    HB   VAL  84           HB       VAL  84  -0.553  -4.818  -5.599
  618   1HG1  VAL  84          1HG1      VAL  84  -1.028  -2.648  -4.366
  619   2HG1  VAL  84          2HG1      VAL  84  -0.796  -4.092  -3.413
  620   3HG1  VAL  84          3HG1      VAL  84  -2.441  -3.463  -3.657
  621   1HG2  VAL  84          1HG2      VAL  84  -1.940  -6.201  -4.251
  622   2HG2  VAL  84          2HG2      VAL  84  -2.453  -6.256  -5.946
  623   3HG2  VAL  84          3HG2      VAL  84  -3.367  -5.307  -4.762
  624    H    LYS  85           H        LYS  85   0.117  -3.306  -7.462
  625    HA   LYS  85           HA       LYS  85   0.798  -0.775  -6.515
  626   1HB   LYS  85          1HB       LYS  85   1.590  -2.066  -9.103
  627   2HB   LYS  85          2HB       LYS  85   2.316  -0.590  -8.475
  628   1HG   LYS  85          1HG       LYS  85   3.100  -1.712  -6.569
  629   2HG   LYS  85          2HG       LYS  85   2.268  -3.206  -7.031
  630   1HD   LYS  85          1HD       LYS  85   3.673  -3.113  -9.141
  631   2HD   LYS  85          2HD       LYS  85   4.625  -1.869  -8.311
  632   1HE   LYS  85          1HE       LYS  85   4.842  -3.411  -6.415
  633   2HE   LYS  85          2HE       LYS  85   4.019  -4.610  -7.412
  634   1HZ   LYS  85          1HZ       LYS  85   5.834  -4.541  -9.005
  635   2HZ   LYS  85          2HZ       LYS  85   6.472  -4.863  -7.473
  636   3HZ   LYS  85          3HZ       LYS  85   6.609  -3.324  -8.114
  637    H    HIS  86           H        HIS  86  -0.670  -1.704  -9.437
  638    HA   HIS  86           HA       HIS  86  -0.934   0.700 -10.777
  639   1HB   HIS  86          1HB       HIS  86  -1.497  -1.504 -11.748
  640   2HB   HIS  86          2HB       HIS  86  -2.932  -1.574 -10.746
  641    HD1  HIS  86           1HD      HIS  86  -4.691  -1.560 -12.533
  642    HD2  HIS  86           2HD      HIS  86  -1.957   1.516 -12.954
  643    HE1  HIS  86           1HE      HIS  86  -5.558  -0.170 -14.428
  644    H    LYS  87           H        LYS  87  -3.226  -0.879  -8.656
  645    HA   LYS  87           HA       LYS  87  -5.167   1.245  -8.558
  646   1HB   LYS  87          1HB       LYS  87  -4.672  -0.921  -6.534
  647   2HB   LYS  87          2HB       LYS  87  -6.100   0.090  -6.647
  648   1HG   LYS  87          1HG       LYS  87  -6.657  -0.927  -8.781
  649   2HG   LYS  87          2HG       LYS  87  -5.201  -1.929  -8.677
  650   1HD   LYS  87          1HD       LYS  87  -6.017  -2.864  -6.579
  651   2HD   LYS  87          2HD       LYS  87  -7.478  -1.888  -6.737
  652   1HE   LYS  87          1HE       LYS  87  -8.056  -3.031  -8.788
  653   2HE   LYS  87          2HE       LYS  87  -6.564  -3.962  -8.711
  654   1HZ   LYS  87          1HZ       LYS  87  -7.334  -4.949  -6.654
  655   2HZ   LYS  87          2HZ       LYS  87  -8.438  -5.228  -7.905
  656   3HZ   LYS  87          3HZ       LYS  87  -8.765  -4.067  -6.740
  657    H    THR  88           H        THR  88  -2.373   0.599  -6.791
  658    HA   THR  88           HA       THR  88  -3.018   2.186  -4.568
  659    HB   THR  88           HB       THR  88  -0.532   1.007  -5.669
  660    HG1  THR  88           1HG      THR  88  -1.903  -0.463  -4.788
  661   1HG2  THR  88          1HG2      THR  88  -0.900   2.588  -3.130
  662   2HG2  THR  88          2HG2      THR  88   0.011   3.024  -4.595
  663   3HG2  THR  88          3HG2      THR  88   0.560   1.666  -3.593
  664    H    LYS  89           H        LYS  89  -0.692   2.600  -7.147
  665    HA   LYS  89           HA       LYS  89  -0.205   5.099  -6.260
  666   1HB   LYS  89          1HB       LYS  89   0.946   5.419  -8.603
  667   2HB   LYS  89          2HB       LYS  89   1.595   4.412  -7.336
  668   1HG   LYS  89          1HG       LYS  89   1.776   3.202  -9.364
  669   2HG   LYS  89          2HG       LYS  89   0.491   2.451  -8.407
  670   1HD   LYS  89          1HD       LYS  89  -0.127   2.491 -10.597
  671   2HD   LYS  89          2HD       LYS  89  -1.052   3.682  -9.700
  672   1HE   LYS  89          1HE       LYS  89  -0.299   4.662 -11.873
  673   2HE   LYS  89          2HE       LYS  89   0.433   5.473 -10.483
  674   1HZ   LYS  89          1HZ       LYS  89   2.071   5.080 -12.206
  675   2HZ   LYS  89          2HZ       LYS  89   1.754   3.431 -12.187
  676   3HZ   LYS  89          3HZ       LYS  89   2.470   4.162 -10.852
  677    H    GLU  90           H        GLU  90  -2.436   3.942  -8.693
  678    HA   GLU  90           HA       GLU  90  -3.256   6.538  -9.617
  679   1HB   GLU  90          1HB       GLU  90  -4.876   4.015  -9.532
  680   2HB   GLU  90          2HB       GLU  90  -5.397   5.492 -10.324
  681   1HG   GLU  90          1HG       GLU  90  -3.286   5.291 -11.721
  682   2HG   GLU  90          2HG       GLU  90  -3.164   3.649 -11.085
  683    H    TYR  91           H        TYR  91  -4.092   4.659  -6.794
  684    HA   TYR  91           HA       TYR  91  -6.428   6.121  -6.121
  685   1HB   TYR  91          1HB       TYR  91  -6.333   3.986  -5.113
  686   2HB   TYR  91          2HB       TYR  91  -4.644   4.174  -4.687
  687    HD1  TYR  91           1HD      TYR  91  -4.137   4.507  -2.514
  688    HD2  TYR  91           2HD      TYR  91  -7.954   5.761  -3.884
  689    HE1  TYR  91           1HE      TYR  91  -4.696   5.101  -0.263
  690    HE2  TYR  91           2HE      TYR  91  -8.582   6.375  -1.579
  691    HH   TYR  91           HH       TYR  91  -6.355   6.682   0.888
  692    H    ILE  92           H        ILE  92  -3.084   5.956  -5.096
  693    HA   ILE  92           HA       ILE  92  -2.885   8.067  -3.334
  694    HB   ILE  92           HB       ILE  92  -0.950   7.182  -5.471
  695   1HG1  ILE  92          1HG1      ILE  92  -1.805   5.739  -3.438
  696   2HG1  ILE  92          2HG1      ILE  92  -0.101   5.606  -3.958
  697   1HG2  ILE  92          1HG2      ILE  92  -0.381   8.963  -3.116
  698   2HG2  ILE  92          2HG2      ILE  92  -0.477   9.453  -4.793
  699   3HG2  ILE  92          3HG2      ILE  92   0.829   8.364  -4.272
  700   1HD1  ILE  92          1HD1      ILE  92  -1.372   7.120  -1.750
  701   2HD1  ILE  92          2HD1      ILE  92   0.367   7.198  -2.149
  702   3HD1  ILE  92          3HD1      ILE  92  -0.356   5.679  -1.587
  703    H    LYS  93           H        LYS  93  -2.457   8.275  -6.845
  704    HA   LYS  93           HA       LYS  93  -2.023  10.975  -7.032
  705   1HB   LYS  93          1HB       LYS  93  -3.672   9.269  -8.935
  706   2HB   LYS  93          2HB       LYS  93  -3.062  10.870  -9.316
  707   1HG   LYS  93          1HG       LYS  93  -1.372   8.448  -8.720
  708   2HG   LYS  93          2HG       LYS  93  -1.727   9.080 -10.330
  709   1HD   LYS  93          1HD       LYS  93  -0.568  11.095  -9.873
  710   2HD   LYS  93          2HD       LYS  93  -0.418  10.699  -8.165
  711   1HE   LYS  93          1HE       LYS  93   0.978   8.750  -8.813
  712   2HE   LYS  93          2HE       LYS  93   0.928   9.340 -10.476
  713   1HZ   LYS  93          1HZ       LYS  93   2.010  11.352  -9.805
  714   2HZ   LYS  93          2HZ       LYS  93   2.915  10.068  -9.201
  715   3HZ   LYS  93          3HZ       LYS  93   1.880  10.927  -8.184
  716    H    LYS  94           H        LYS  94  -5.039   9.217  -7.084
  717    HA   LYS  94           HA       LYS  94  -6.554  11.545  -7.570
  718   1HB   LYS  94          1HB       LYS  94  -7.256   9.295  -8.339
  719   2HB   LYS  94          2HB       LYS  94  -7.467   8.801  -6.670
  720   1HG   LYS  94          1HG       LYS  94  -9.306  10.361  -6.408
  721   2HG   LYS  94          2HG       LYS  94  -9.043  10.968  -8.041
  722   1HD   LYS  94          1HD       LYS  94 -10.840   9.494  -8.279
  723   2HD   LYS  94          2HD       LYS  94  -9.458   8.556  -8.814
  724   1HE   LYS  94          1HE       LYS  94 -10.794   8.376  -6.104
  725   2HE   LYS  94          2HE       LYS  94 -11.024   7.251  -7.429
  726   1HZ   LYS  94          1HZ       LYS  94  -8.546   7.697  -5.867
  727   2HZ   LYS  94          2HZ       LYS  94  -8.631   6.694  -7.239
  728   3HZ   LYS  94          3HZ       LYS  94  -9.525   6.329  -5.861
  729    H    TYR  95           H        TYR  95  -5.651   9.697  -4.771
  730    HA   TYR  95           HA       TYR  95  -7.334  10.947  -2.963
  731   1HB   TYR  95          1HB       TYR  95  -6.313   8.890  -2.448
  732   2HB   TYR  95          2HB       TYR  95  -4.713   9.591  -2.760
  733    HD1  TYR  95           1HD      TYR  95  -7.734   9.886  -0.529
  734    HD2  TYR  95           2HD      TYR  95  -3.547  10.561  -0.936
  735    HE1  TYR  95           1HE      TYR  95  -7.658  10.702   1.745
  736    HE2  TYR  95           2HE      TYR  95  -3.488  11.384   1.372
  737    HH   TYR  95           HH       TYR  95  -6.071  11.032   3.585
  738    H    MET  96           H        MET  96  -3.962  11.657  -3.782
  739    HA   MET  96           HA       MET  96  -3.879  13.795  -1.993
  740   1HB   MET  96          1HB       MET  96  -2.154  13.315  -4.360
  741   2HB   MET  96          2HB       MET  96  -1.798  14.410  -3.026
  742   1HG   MET  96          1HG       MET  96  -2.280  12.138  -1.637
  743   2HG   MET  96          2HG       MET  96  -1.667  11.463  -3.150
  744   1HE   MET  96          1HE       MET  96   0.626  14.363  -0.474
  745   2HE   MET  96          2HE       MET  96  -1.067  13.854  -0.246
  746   3HE   MET  96          3HE       MET  96  -0.602  14.820  -1.658
  747    H    GLN  97           H        GLN  97  -5.134  13.554  -5.058
  748    HA   GLN  97           HA       GLN  97  -5.031  16.307  -5.816
  749   1HB   GLN  97          1HB       GLN  97  -7.303  14.493  -6.626
  750   2HB   GLN  97          2HB       GLN  97  -6.749  15.936  -7.452
  751   1HG   GLN  97          1HG       GLN  97  -5.433  13.259  -7.283
  752   2HG   GLN  97          2HG       GLN  97  -6.018  14.082  -8.718
  753   1HE2  GLN  97          1HE2      GLN  97  -3.522  13.679  -6.457
  754   2HE2  GLN  97          2HE2      GLN  97  -2.295  14.618  -7.174
  755    H    LYS  98           H        LYS  98  -6.906  14.694  -3.484
  756    HA   LYS  98           HA       LYS  98  -9.046  16.595  -3.490
  757   1HB   LYS  98          1HB       LYS  98  -9.946  15.489  -1.586
  758   2HB   LYS  98          2HB       LYS  98  -9.324  14.274  -2.675
  759   1HG   LYS  98          1HG       LYS  98  -7.645  13.612  -1.300
  760   2HG   LYS  98          2HG       LYS  98  -7.476  15.179  -0.535
  761   1HD   LYS  98          1HD       LYS  98  -9.680  13.127  -0.161
  762   2HD   LYS  98          2HD       LYS  98  -8.311  13.436   0.922
  763   1HE   LYS  98          1HE       LYS  98  -9.103  15.502   1.575
  764   2HE   LYS  98          2HE       LYS  98 -10.272  15.625   0.268
  765   1HZ   LYS  98          1HZ       LYS  98 -11.623  14.032   1.271
  766   2HZ   LYS  98          2HZ       LYS  98 -11.135  15.058   2.543
  767   3HZ   LYS  98          3HZ       LYS  98 -10.432  13.537   2.337
  768    H    PHE  99           H        PHE  99  -5.956  16.468  -2.015
  769    HA   PHE  99           HA       PHE  99  -6.589  18.219   0.175
  770   1HB   PHE  99          1HB       PHE  99  -3.909  17.452  -0.996
  771   2HB   PHE  99          2HB       PHE  99  -4.112  18.492   0.403
  772    HD1  PHE  99           1HD      PHE  99  -3.313  15.284  -0.547
  773    HD2  PHE  99           2HD      PHE  99  -5.773  17.368   2.244
  774    HE1  PHE  99           1HE      PHE  99  -3.245  13.342   1.002
  775    HE2  PHE  99           2HE      PHE  99  -5.684  15.420   3.761
  776    HZ   PHE  99           HZ       PHE  99  -4.475  13.434   3.105
  777    H    GLY 100           H        GLY 100  -5.194  18.631  -3.012
  778   1HA   GLY 100          1HA       GLY 100  -5.678  20.605  -4.241
  779   2HA   GLY 100          2HA       GLY 100  -5.617  21.499  -2.718
  780    H    ALA 101           H        ALA 101  -3.921  22.657  -2.636
  781    HA   ALA 101           HA       ALA 101  -1.553  22.041  -4.145
  782   1HB   ALA 101          1HB       ALA 101  -2.058  24.210  -2.121
  783   2HB   ALA 101          2HB       ALA 101  -2.317  24.350  -3.862
  784   3HB   ALA 101          3HB       ALA 101  -0.686  24.120  -3.223
  785    H    VAL 102           H        VAL 102  -2.396  22.035  -0.685
  786    HA   VAL 102           HA       VAL 102   0.214  20.743  -0.250
  787    HB   VAL 102           HB       VAL 102  -1.155  22.124   1.988
  788   1HG1  VAL 102          1HG1      VAL 102   0.776  20.902   2.515
  789   2HG1  VAL 102          2HG1      VAL 102   1.094  22.622   2.771
  790   3HG1  VAL 102          3HG1      VAL 102   1.734  21.806   1.342
  791   1HG2  VAL 102          1HG2      VAL 102  -1.304  23.843   0.340
  792   2HG2  VAL 102          2HG2      VAL 102   0.409  23.677  -0.058
  793   3HG2  VAL 102          3HG2      VAL 102  -0.080  24.297   1.529
  794    H    TYR 103           H        TYR 103   0.296  19.239   1.400
  795    HA   TYR 103           HA       TYR 103  -2.057  17.661   1.515
  796   1HB   TYR 103          1HB       TYR 103  -0.125  16.355   1.099
  797   2HB   TYR 103          2HB       TYR 103   0.815  17.253   2.278
  798    HD1  TYR 103           1HD      TYR 103  -2.476  15.755   3.004
  799    HD2  TYR 103           2HD      TYR 103   1.691  15.385   3.399
  800    HE1  TYR 103           1HE      TYR 103  -2.827  14.024   4.640
  801    HE2  TYR 103           2HE      TYR 103   1.372  13.582   5.078
  802    HH   TYR 103           HH       TYR 103  -0.355  12.971   6.708
  803    H    LYS 104           H        LYS 104  -3.445  18.453   2.793
  804    HA   LYS 104           HA       LYS 104  -2.748  19.116   5.562
  805   1HB   LYS 104          1HB       LYS 104  -5.116  19.881   3.879
  806   2HB   LYS 104          2HB       LYS 104  -4.868  20.394   5.535
  807   1HG   LYS 104          1HG       LYS 104  -2.903  21.669   4.878
  808   2HG   LYS 104          2HG       LYS 104  -3.039  21.063   3.227
  809   1HD   LYS 104          1HD       LYS 104  -5.111  22.731   4.636
  810   2HD   LYS 104          2HD       LYS 104  -3.918  23.366   3.505
  811   1HE   LYS 104          1HE       LYS 104  -4.858  21.924   1.735
  812   2HE   LYS 104          2HE       LYS 104  -6.054  21.312   2.871
  813   1HZ   LYS 104          1HZ       LYS 104  -6.991  23.042   1.502
  814   2HZ   LYS 104          2HZ       LYS 104  -5.788  24.121   1.982
  815   3HZ   LYS 104          3HZ       LYS 104  -6.918  23.567   3.101
  816    HA   PRO 105           HA       PRO 105  -4.914  15.021   5.724
  817   1HB   PRO 105          1HB       PRO 105  -4.072  14.492   8.306
  818   2HB   PRO 105          2HB       PRO 105  -3.211  14.003   6.846
  819   1HG   PRO 105          1HG       PRO 105  -2.785  16.315   8.626
  820   2HG   PRO 105          2HG       PRO 105  -1.567  15.303   7.773
  821   1HD   PRO 105          1HD       PRO 105  -2.259  17.810   7.045
  822   2HD   PRO 105          2HD       PRO 105  -1.778  16.608   5.846
  823    H    LYS 106           H        LYS 106  -5.104  17.640   7.974
  824    HA   LYS 106           HA       LYS 106  -7.480  16.943   9.236
  825   1HB   LYS 106          1HB       LYS 106  -6.646  19.699   8.325
  826   2HB   LYS 106          2HB       LYS 106  -8.069  19.423   9.315
  827   1HG   LYS 106          1HG       LYS 106  -6.319  20.186  10.745
  828   2HG   LYS 106          2HG       LYS 106  -6.544  18.473  11.073
  829   1HD   LYS 106          1HD       LYS 106  -4.581  17.926   9.777
  830   2HD   LYS 106          2HD       LYS 106  -4.410  19.604   9.264
  831   1HE   LYS 106          1HE       LYS 106  -4.027  20.259  11.604
  832   2HE   LYS 106          2HE       LYS 106  -4.188  18.574  12.096
  833   1HZ   LYS 106          1HZ       LYS 106  -2.226  18.046  10.759
  834   2HZ   LYS 106          2HZ       LYS 106  -1.864  19.226  11.888
  835   3HZ   LYS 106          3HZ       LYS 106  -2.074  19.648  10.286
  836    H    GLU 107           H        GLU 107  -7.030  17.726   5.953
  837    HA   GLU 107           HA       GLU 107  -9.881  18.026   5.392
  838   1HB   GLU 107          1HB       GLU 107  -7.465  18.022   3.585
  839   2HB   GLU 107          2HB       GLU 107  -9.113  18.200   3.017
  840   1HG   GLU 107          1HG       GLU 107  -7.685  20.078   4.881
  841   2HG   GLU 107          2HG       GLU 107  -7.922  20.324   3.153
  842    H    ASP 108           H        ASP 108  -7.676  15.506   5.793
  843    HA   ASP 108           HA       ASP 108  -8.298  13.742   3.711
  844   1HB   ASP 108          1HB       ASP 108  -6.292  13.205   4.703
  845   2HB   ASP 108          2HB       ASP 108  -6.842  13.644   6.304
  846    H    THR 109           H        THR 109  -9.253  11.563   4.142
  847    HA   THR 109           HA       THR 109 -11.957  11.718   4.669
  848    HB   THR 109           HB       THR 109 -11.271   9.994   3.213
  849    HG1  THR 109           1HG      THR 109 -12.946   9.284   4.591
  850   1HG2  THR 109          1HG2      THR 109  -9.435   8.958   5.375
  851   2HG2  THR 109          2HG2      THR 109  -8.962   9.793   3.898
  852   3HG2  THR 109          3HG2      THR 109  -9.689   8.195   3.798
  Start of MODEL   10
    1    H    THR  10           H        THR  10  -4.098 -22.966   4.481
    2    HA   THR  10           HA       THR  10  -3.185 -22.349   7.184
    3    HB   THR  10           HB       THR  10  -2.082 -24.248   5.993
    4    HG1  THR  10           1HG      THR  10  -0.775 -23.203   7.437
    5   1HG2  THR  10          1HG2      THR  10  -0.613 -23.810   4.054
    6   2HG2  THR  10          2HG2      THR  10  -1.205 -22.147   4.005
    7   3HG2  THR  10          3HG2      THR  10  -2.310 -23.484   3.694
    8    H    SER  11           H        SER  11  -4.462 -20.777   4.819
    9    HA   SER  11           HA       SER  11  -2.539 -18.707   4.139
   10   1HB   SER  11          1HB       SER  11  -5.458 -18.886   3.770
   11   2HB   SER  11          2HB       SER  11  -4.352 -17.796   2.898
   12    HG   SER  11           HG       SER  11  -3.448 -19.559   1.851
   13    H    SER  12           H        SER  12  -4.270 -19.292   6.809
   14    HA   SER  12           HA       SER  12  -4.883 -16.611   7.401
   15   1HB   SER  12          1HB       SER  12  -5.204 -17.804   9.665
   16   2HB   SER  12          2HB       SER  12  -6.185 -18.291   8.256
   17    HG   SER  12           HG       SER  12  -5.514 -20.150   8.941
   18    H    GLU  13           H        GLU  13  -2.311 -19.066   8.354
   19    HA   GLU  13           HA       GLU  13  -0.819 -17.140   9.681
   20   1HB   GLU  13          1HB       GLU  13   0.672 -19.125  10.031
   21   2HB   GLU  13          2HB       GLU  13  -0.975 -19.338  10.604
   22   1HG   GLU  13          1HG       GLU  13  -1.448 -20.607   8.442
   23   2HG   GLU  13          2HG       GLU  13   0.254 -20.483   8.105
   24    H    LEU  14           H        LEU  14  -0.606 -18.932   6.645
   25    HA   LEU  14           HA       LEU  14   1.970 -18.355   5.736
   26   1HB   LEU  14          1HB       LEU  14   0.095 -19.878   4.860
   27   2HB   LEU  14          2HB       LEU  14  -0.465 -18.462   4.007
   28    HG   LEU  14           HG       LEU  14   2.261 -19.712   3.625
   29   1HD1  LEU  14          1HD1      LEU  14   0.526 -21.247   2.954
   30   2HD1  LEU  14          2HD1      LEU  14   1.348 -20.596   1.537
   31   3HD1  LEU  14          3HD1      LEU  14  -0.245 -19.988   1.989
   32   1HD2  LEU  14          1HD2      LEU  14   0.774 -17.699   1.936
   33   2HD2  LEU  14          2HD2      LEU  14   2.369 -18.373   1.588
   34   3HD2  LEU  14          3HD2      LEU  14   2.137 -17.328   2.990
   35    H    ALA  15           H        ALA  15  -0.929 -16.704   5.594
   36    HA   ALA  15           HA       ALA  15   0.108 -14.669   3.815
   37   1HB   ALA  15          1HB       ALA  15  -2.710 -14.955   4.711
   38   2HB   ALA  15          2HB       ALA  15  -2.021 -15.483   3.156
   39   3HB   ALA  15          3HB       ALA  15  -2.049 -13.762   3.597
   40    H    LYS  16           H        LYS  16  -0.241 -15.179   7.045
   41    HA   LYS  16           HA       LYS  16  -0.527 -12.486   7.958
   42   1HB   LYS  16          1HB       LYS  16  -0.665 -14.452   9.477
   43   2HB   LYS  16          2HB       LYS  16   1.006 -14.830   9.112
   44   1HG   LYS  16          1HG       LYS  16   1.703 -12.725  10.146
   45   2HG   LYS  16          2HG       LYS  16   0.014 -12.370  10.526
   46   1HD   LYS  16          1HD       LYS  16  -0.135 -14.333  11.906
   47   2HD   LYS  16          2HD       LYS  16   1.506 -14.805  11.454
   48   1HE   LYS  16          1HE       LYS  16   2.377 -12.796  12.525
   49   2HE   LYS  16          2HE       LYS  16   0.739 -12.306  12.951
   50   1HZ   LYS  16          1HZ       LYS  16   1.889 -13.396  14.792
   51   2HZ   LYS  16          2HZ       LYS  16   2.072 -14.787  13.872
   52   3HZ   LYS  16          3HZ       LYS  16   0.529 -14.261  14.309
   53    H    LYS  17           H        LYS  17   2.168 -14.560   7.057
   54    HA   LYS  17           HA       LYS  17   4.159 -12.584   7.290
   55   1HB   LYS  17          1HB       LYS  17   4.061 -15.154   5.696
   56   2HB   LYS  17          2HB       LYS  17   5.455 -14.099   5.686
   57   1HG   LYS  17          1HG       LYS  17   5.838 -15.942   7.190
   58   2HG   LYS  17          2HG       LYS  17   5.710 -14.458   8.116
   59   1HD   LYS  17          1HD       LYS  17   3.429 -15.018   8.743
   60   2HD   LYS  17          2HD       LYS  17   3.496 -16.468   7.745
   61   1HE   LYS  17          1HE       LYS  17   5.309 -15.920  10.087
   62   2HE   LYS  17          2HE       LYS  17   3.847 -16.901  10.165
   63   1HZ   LYS  17          1HZ       LYS  17   5.820 -18.258   9.897
   64   2HZ   LYS  17          2HZ       LYS  17   6.194 -17.510   8.420
   65   3HZ   LYS  17          3HZ       LYS  17   4.795 -18.405   8.587
   66    H    SER  18           H        SER  18   2.114 -13.675   4.592
   67    HA   SER  18           HA       SER  18   3.350 -12.118   2.675
   68   1HB   SER  18          1HB       SER  18   0.461 -13.017   2.703
   69   2HB   SER  18          2HB       SER  18   1.412 -12.569   1.288
   70    HG   SER  18           HG       SER  18   1.199 -14.913   1.909
   71    H    LYS  19           H        LYS  19   0.867 -11.278   5.033
   72    HA   LYS  19           HA       LYS  19   0.171  -8.783   3.841
   73   1HB   LYS  19          1HB       LYS  19  -0.151  -9.748   6.686
   74   2HB   LYS  19          2HB       LYS  19  -0.815  -8.239   6.069
   75   1HG   LYS  19          1HG       LYS  19  -1.976  -9.771   4.317
   76   2HG   LYS  19          2HG       LYS  19  -1.606 -11.063   5.437
   77   1HD   LYS  19          1HD       LYS  19  -2.941  -8.635   6.535
   78   2HD   LYS  19          2HD       LYS  19  -3.899  -9.702   5.517
   79   1HE   LYS  19          1HE       LYS  19  -4.195 -10.248   7.809
   80   2HE   LYS  19          2HE       LYS  19  -3.365 -11.561   6.972
   81   1HZ   LYS  19          1HZ       LYS  19  -2.392 -11.179   9.136
   82   2HZ   LYS  19          2HZ       LYS  19  -2.129  -9.565   8.818
   83   3HZ   LYS  19          3HZ       LYS  19  -1.251 -10.727   7.991
   84    H    GLU  20           H        GLU  20   2.635  -9.844   5.990
   85    HA   GLU  20           HA       GLU  20   3.461  -7.219   6.797
   86   1HB   GLU  20          1HB       GLU  20   5.116  -9.743   6.744
   87   2HB   GLU  20          2HB       GLU  20   5.357  -8.334   7.776
   88   1HG   GLU  20          1HG       GLU  20   3.207  -8.769   8.819
   89   2HG   GLU  20          2HG       GLU  20   3.060 -10.172   7.761
   90    H    VAL  21           H        VAL  21   4.549  -9.606   4.486
   91    HA   VAL  21           HA       VAL  21   6.635  -8.067   3.302
   92    HB   VAL  21           HB       VAL  21   4.950 -10.314   2.122
   93   1HG1  VAL  21          1HG1      VAL  21   6.768 -10.596   0.524
   94   2HG1  VAL  21          2HG1      VAL  21   7.619  -9.227   1.237
   95   3HG1  VAL  21          3HG1      VAL  21   6.083  -8.975   0.405
   96   1HG2  VAL  21          1HG2      VAL  21   6.847 -11.768   2.670
   97   2HG2  VAL  21          2HG2      VAL  21   6.144 -11.041   4.114
   98   3HG2  VAL  21          3HG2      VAL  21   7.654 -10.411   3.455
   99    H    PHE  22           H        PHE  22   3.201  -8.388   2.641
  100    HA   PHE  22           HA       PHE  22   3.232  -6.816   0.241
  101   1HB   PHE  22          1HB       PHE  22   1.321  -8.162   0.411
  102   2HB   PHE  22          2HB       PHE  22   1.125  -7.799   2.125
  103    HD1  PHE  22           1HD      PHE  22  -0.540  -6.307   2.734
  104    HD2  PHE  22           2HD      PHE  22   0.991  -6.093  -1.215
  105    HE1  PHE  22           1HE      PHE  22  -2.106  -4.512   2.229
  106    HE2  PHE  22           2HE      PHE  22  -0.572  -4.259  -1.718
  107    HZ   PHE  22           HZ       PHE  22  -2.148  -3.466   0.047
  108    H    ARG  23           H        ARG  23   2.267  -6.079   3.534
  109    HA   ARG  23           HA       ARG  23   1.784  -3.368   2.951
  110   1HB   ARG  23          1HB       ARG  23   1.685  -2.910   5.320
  111   2HB   ARG  23          2HB       ARG  23   0.980  -4.485   5.005
  112   1HG   ARG  23          1HG       ARG  23   2.197  -5.004   6.880
  113   2HG   ARG  23          2HG       ARG  23   3.388  -5.307   5.627
  114   1HD   ARG  23          1HD       ARG  23   4.421  -3.163   5.963
  115   2HD   ARG  23          2HD       ARG  23   3.197  -2.719   7.154
  116    HE   ARG  23           HE       ARG  23   4.757  -5.106   7.683
  117   1HH1  ARG  23          1HH1      ARG  23   4.518  -1.640   8.236
  118   2HH1  ARG  23          2HH1      ARG  23   5.212  -1.641   9.779
  119   1HH2  ARG  23          1HH2      ARG  23   5.786  -5.166   9.802
  120   2HH2  ARG  23          2HH2      ARG  23   6.009  -3.738  10.684
  121    H    LYS  24           H        LYS  24   4.762  -5.035   3.566
  122    HA   LYS  24           HA       LYS  24   6.232  -2.696   4.092
  123   1HB   LYS  24          1HB       LYS  24   6.875  -4.888   4.915
  124   2HB   LYS  24          2HB       LYS  24   7.113  -5.446   3.270
  125   1HG   LYS  24          1HG       LYS  24   8.978  -3.930   2.992
  126   2HG   LYS  24          2HG       LYS  24   8.653  -3.235   4.578
  127   1HD   LYS  24          1HD       LYS  24   9.218  -5.231   5.700
  128   2HD   LYS  24          2HD       LYS  24   9.240  -6.149   4.193
  129   1HE   LYS  24          1HE       LYS  24  11.101  -3.873   4.809
  130   2HE   LYS  24          2HE       LYS  24  11.478  -5.567   5.114
  131   1HZ   LYS  24          1HZ       LYS  24  11.273  -6.038   2.804
  132   2HZ   LYS  24          2HZ       LYS  24  12.353  -4.763   2.957
  133   3HZ   LYS  24          3HZ       LYS  24  10.771  -4.488   2.434
  134    H    GLU  25           H        GLU  25   5.761  -4.739   1.094
  135    HA   GLU  25           HA       GLU  25   7.422  -2.917  -0.341
  136   1HB   GLU  25          1HB       GLU  25   6.108  -4.255  -2.268
  137   2HB   GLU  25          2HB       GLU  25   7.659  -4.803  -1.593
  138   1HG   GLU  25          1HG       GLU  25   6.119  -6.151  -0.047
  139   2HG   GLU  25          2HG       GLU  25   4.843  -5.687  -1.150
  140    H    MET  26           H        MET  26   4.063  -3.108   0.237
  141    HA   MET  26           HA       MET  26   3.401  -1.220  -1.767
  142   1HB   MET  26          1HB       MET  26   1.841  -2.707  -0.787
  143   2HB   MET  26          2HB       MET  26   2.044  -1.963   0.789
  144   1HG   MET  26          1HG       MET  26   0.243  -0.705   0.290
  145   2HG   MET  26          2HG       MET  26   1.343   0.188  -0.744
  146   1HE   MET  26          1HE       MET  26   1.525  -2.028  -3.413
  147   2HE   MET  26          2HE       MET  26   1.527  -0.236  -3.445
  148   3HE   MET  26          3HE       MET  26   0.327  -1.110  -4.338
  149    H    SER  27           H        SER  27   4.218  -0.966   1.594
  150    HA   SER  27           HA       SER  27   3.762   1.793   1.810
  151   1HB   SER  27          1HB       SER  27   5.442   1.749   3.699
  152   2HB   SER  27          2HB       SER  27   3.982   0.754   3.917
  153    HG   SER  27           HG       SER  27   5.150  -0.986   3.566
  154    H    GLN  28           H        GLN  28   6.561  -0.071   1.004
  155    HA   GLN  28           HA       GLN  28   8.264   2.209   0.708
  156   1HB   GLN  28          1HB       GLN  28   8.475  -0.518  -0.568
  157   2HB   GLN  28          2HB       GLN  28   9.713   0.721  -0.686
  158   1HG   GLN  28          1HG       GLN  28  10.003   0.668   1.731
  159   2HG   GLN  28          2HG       GLN  28   8.754  -0.574   1.850
  160   1HE2  GLN  28          1HE2      GLN  28   9.178  -2.630   1.092
  161   2HE2  GLN  28          2HE2      GLN  28  10.783  -3.169   0.744
  162    H    PHE  29           H        PHE  29   6.325   0.416  -1.559
  163    HA   PHE  29           HA       PHE  29   6.860   1.806  -3.876
  164   1HB   PHE  29          1HB       PHE  29   5.615  -0.272  -3.792
  165   2HB   PHE  29          2HB       PHE  29   4.338   0.501  -2.877
  166    HD1  PHE  29           1HD      PHE  29   5.996   0.376  -6.154
  167    HD2  PHE  29           2HD      PHE  29   2.572   1.579  -3.935
  168    HE1  PHE  29           1HE      PHE  29   4.771   0.808  -8.237
  169    HE2  PHE  29           2HE      PHE  29   1.379   2.012  -6.013
  170    HZ   PHE  29           HZ       PHE  29   2.427   1.621  -8.108
  171    H    ILE  30           H        ILE  30   4.372   2.373  -1.443
  172    HA   ILE  30           HA       ILE  30   3.292   4.676  -2.592
  173    HB   ILE  30           HB       ILE  30   3.157   3.561   0.197
  174   1HG1  ILE  30          1HG1      ILE  30   1.096   3.846  -1.996
  175   2HG1  ILE  30          2HG1      ILE  30   2.072   2.414  -1.722
  176   1HG2  ILE  30          1HG2      ILE  30   2.982   6.016   0.342
  177   2HG2  ILE  30          2HG2      ILE  30   1.444   5.239   0.729
  178   3HG2  ILE  30          3HG2      ILE  30   1.690   5.996  -0.850
  179   1HD1  ILE  30          1HD1      ILE  30   0.082   3.581   0.202
  180   2HD1  ILE  30          2HD1      ILE  30   1.086   2.158   0.459
  181   3HD1  ILE  30          3HD1      ILE  30  -0.137   2.144  -0.799
  182    H    VAL  31           H        VAL  31   5.761   4.269  -0.035
  183    HA   VAL  31           HA       VAL  31   6.349   6.894   0.416
  184    HB   VAL  31           HB       VAL  31   8.137   4.447   0.265
  185   1HG1  VAL  31          1HG1      VAL  31   9.968   5.662   1.224
  186   2HG1  VAL  31          2HG1      VAL  31   9.002   7.107   1.385
  187   3HG1  VAL  31          3HG1      VAL  31   9.482   6.553  -0.227
  188   1HG2  VAL  31          1HG2      VAL  31   7.156   6.131   2.561
  189   2HG2  VAL  31          2HG2      VAL  31   8.160   4.684   2.705
  190   3HG2  VAL  31          3HG2      VAL  31   6.512   4.569   2.079
  191    H    GLN  32           H        GLN  32   7.599   4.878  -2.268
  192    HA   GLN  32           HA       GLN  32   9.152   6.726  -3.460
  193   1HB   GLN  32          1HB       GLN  32   9.163   4.381  -3.949
  194   2HB   GLN  32          2HB       GLN  32   7.560   4.470  -4.634
  195   1HG   GLN  32          1HG       GLN  32   9.217   4.270  -6.337
  196   2HG   GLN  32          2HG       GLN  32   8.371   5.823  -6.427
  197   1HE2  GLN  32          1HE2      GLN  32  10.065   6.713  -7.625
  198   2HE2  GLN  32          2HE2      GLN  32  11.575   7.151  -6.927
  199    H    CYS  33           H        CYS  33   5.761   5.973  -3.808
  200    HA   CYS  33           HA       CYS  33   5.110   7.662  -5.955
  201   1HB   CYS  33          1HB       CYS  33   3.479   6.452  -3.778
  202   2HB   CYS  33          2HB       CYS  33   2.768   7.294  -5.165
  203    HG   CYS  33           HG       CYS  33   4.559   4.406  -5.098
  204    H    LEU  34           H        LEU  34   5.060   8.124  -2.506
  205    HA   LEU  34           HA       LEU  34   3.914  10.742  -2.706
  206   1HB   LEU  34          1HB       LEU  34   5.084   9.302  -0.361
  207   2HB   LEU  34          2HB       LEU  34   4.413  10.915  -0.266
  208    HG   LEU  34           HG       LEU  34   2.924   8.395  -0.966
  209   1HD1  LEU  34          1HD1      LEU  34   2.867  10.217   1.426
  210   2HD1  LEU  34          2HD1      LEU  34   3.498   8.571   1.368
  211   3HD1  LEU  34          3HD1      LEU  34   1.772   8.864   1.152
  212   1HD2  LEU  34          1HD2      LEU  34   1.941  11.246  -0.744
  213   2HD2  LEU  34          2HD2      LEU  34   0.914   9.824  -0.882
  214   3HD2  LEU  34          3HD2      LEU  34   1.978  10.265  -2.213
  215    H    ASN  35           H        ASN  35   7.157   9.491  -2.610
  216    HA   ASN  35           HA       ASN  35   8.749  11.367  -1.910
  217   1HB   ASN  35          1HB       ASN  35   8.877   9.441  -3.979
  218   2HB   ASN  35          2HB       ASN  35   9.888  10.856  -4.355
  219   1HD2  ASN  35          1HD2      ASN  35   8.967   8.675  -1.869
  220   2HD2  ASN  35          2HD2      ASN  35  10.399   8.820  -0.979
  221    HA   PRO  36           HA       PRO  36   8.338  14.324  -5.767
  222   1HB   PRO  36          1HB       PRO  36   6.022  14.163  -7.222
  223   2HB   PRO  36          2HB       PRO  36   7.484  13.291  -7.676
  224   1HG   PRO  36          1HG       PRO  36   5.086  12.297  -6.194
  225   2HG   PRO  36          2HG       PRO  36   6.012  11.508  -7.483
  226   1HD   PRO  36          1HD       PRO  36   6.295  10.883  -4.899
  227   2HD   PRO  36          2HD       PRO  36   7.666  10.815  -6.006
  228    H    TYR  37           H        TYR  37   5.774  13.431  -3.684
  229    HA   TYR  37           HA       TYR  37   4.344  15.912  -3.994
  230   1HB   TYR  37          1HB       TYR  37   3.911  13.563  -2.168
  231   2HB   TYR  37          2HB       TYR  37   2.905  15.010  -2.163
  232    HD1  TYR  37           1HD      TYR  37   3.876  12.045  -4.061
  233    HD2  TYR  37           2HD      TYR  37   1.386  15.453  -3.922
  234    HE1  TYR  37           1HE      TYR  37   2.551  11.093  -5.849
  235    HE2  TYR  37           2HE      TYR  37   0.021  14.562  -5.723
  236    HH   TYR  37           HH       TYR  37   0.320  12.992  -7.583
  237    H    ARG  38           H        ARG  38   6.730  14.610  -1.946
  238    HA   ARG  38           HA       ARG  38   6.236  16.628   0.092
  239   1HB   ARG  38          1HB       ARG  38   8.138  15.672   1.276
  240   2HB   ARG  38          2HB       ARG  38   6.969  14.440   0.821
  241   1HG   ARG  38          1HG       ARG  38   8.349  13.790  -1.039
  242   2HG   ARG  38          2HG       ARG  38   9.506  15.061  -0.639
  243   1HD   ARG  38          1HD       ARG  38   9.934  14.016   1.522
  244   2HD   ARG  38          2HD       ARG  38   8.671  12.825   1.187
  245    HE   ARG  38           HE       ARG  38  10.500  12.551  -0.834
  246   1HH1  ARG  38          1HH1      ARG  38  10.695  12.350   2.727
  247   2HH1  ARG  38          2HH1      ARG  38  11.816  11.083   2.704
  248   1HH2  ARG  38          1HH2      ARG  38  12.061  10.781  -0.806
  249   2HH2  ARG  38          2HH2      ARG  38  12.619  10.208   0.703
  250    H    LYS  39           H        LYS  39   7.603  16.730  -2.783
  251    HA   LYS  39           HA       LYS  39   9.930  18.337  -2.173
  252   1HB   LYS  39          1HB       LYS  39   8.545  17.922  -4.824
  253   2HB   LYS  39          2HB       LYS  39  10.150  18.581  -4.573
  254   1HG   LYS  39          1HG       LYS  39   9.226  15.760  -4.154
  255   2HG   LYS  39          2HG       LYS  39  10.396  16.372  -5.325
  256   1HD   LYS  39          1HD       LYS  39  11.887  17.004  -3.491
  257   2HD   LYS  39          2HD       LYS  39  10.695  16.372  -2.347
  258   1HE   LYS  39          1HE       LYS  39  12.355  14.679  -2.650
  259   2HE   LYS  39          2HE       LYS  39  10.862  14.196  -3.455
  260   1HZ   LYS  39          1HZ       LYS  39  11.807  14.945  -5.571
  261   2HZ   LYS  39          2HZ       LYS  39  12.760  13.748  -4.882
  262   3HZ   LYS  39          3HZ       LYS  39  13.248  15.345  -4.800
  263    HA   PRO  40           HA       PRO  40   7.713  22.236  -2.081
  264   1HB   PRO  40          1HB       PRO  40   9.712  23.882  -2.924
  265   2HB   PRO  40          2HB       PRO  40   9.585  23.235  -1.285
  266   1HG   PRO  40          1HG       PRO  40  11.293  22.292  -3.549
  267   2HG   PRO  40          2HG       PRO  40  11.698  22.447  -1.833
  268   1HD   PRO  40          1HD       PRO  40  11.061  20.077  -2.982
  269   2HD   PRO  40          2HD       PRO  40  10.675  20.428  -1.288
  270    H    ASP  41           H        ASP  41   8.671  20.636  -4.821
  271    HA   ASP  41           HA       ASP  41   7.920  22.700  -6.715
  272   1HB   ASP  41          1HB       ASP  41   9.997  21.396  -7.101
  273   2HB   ASP  41          2HB       ASP  41   9.062  19.914  -7.063
  274    H    CYS  42           H        CYS  42   6.611  20.363  -4.891
  275    HA   CYS  42           HA       CYS  42   4.858  19.073  -6.727
  276   1HB   CYS  42          1HB       CYS  42   5.411  18.106  -4.485
  277   2HB   CYS  42          2HB       CYS  42   4.461  19.388  -3.758
  278    HG   CYS  42           HG       CYS  42   2.573  17.533  -3.589
  279    H    LYS  43           H        LYS  43   2.991  19.681  -7.522
  280    HA   LYS  43           HA       LYS  43   2.080  22.368  -6.914
  281   1HB   LYS  43          1HB       LYS  43   2.541  21.740  -9.226
  282   2HB   LYS  43          2HB       LYS  43   1.374  20.439  -9.112
  283   1HG   LYS  43          1HG       LYS  43  -0.423  22.043  -8.867
  284   2HG   LYS  43          2HG       LYS  43   0.742  23.373  -8.942
  285   1HD   LYS  43          1HD       LYS  43   1.441  22.667 -11.140
  286   2HD   LYS  43          2HD       LYS  43   0.327  21.304 -11.084
  287   1HE   LYS  43          1HE       LYS  43  -1.559  22.836 -11.010
  288   2HE   LYS  43          2HE       LYS  43  -0.459  24.214 -10.994
  289   1HZ   LYS  43          1HZ       LYS  43  -1.313  23.780 -13.213
  290   2HZ   LYS  43          2HZ       LYS  43  -0.677  22.219 -13.175
  291   3HZ   LYS  43          3HZ       LYS  43   0.357  23.546 -13.148
  292    H    VAL  44           H        VAL  44   1.082  19.045  -6.586
  293    HA   VAL  44           HA       VAL  44  -1.367  19.991  -5.348
  294    HB   VAL  44           HB       VAL  44  -1.991  19.392  -7.624
  295   1HG1  VAL  44          1HG1      VAL  44  -1.803  17.123  -8.491
  296   2HG1  VAL  44          2HG1      VAL  44  -0.846  16.680  -7.077
  297   3HG1  VAL  44          3HG1      VAL  44  -0.233  17.880  -8.211
  298   1HG2  VAL  44          1HG2      VAL  44  -3.741  17.731  -7.168
  299   2HG2  VAL  44          2HG2      VAL  44  -3.629  18.946  -5.894
  300   3HG2  VAL  44          3HG2      VAL  44  -2.948  17.337  -5.642
  301    H    GLY  45           H        GLY  45  -1.635  19.186  -3.457
  302   1HA   GLY  45          1HA       GLY  45  -1.507  17.806  -1.621
  303   2HA   GLY  45          2HA       GLY  45  -1.100  16.483  -2.708
  304    H    ARG  46           H        ARG  46   0.709  19.602  -1.961
  305    HA   ARG  46           HA       ARG  46   3.087  18.124  -1.859
  306   1HB   ARG  46          1HB       ARG  46   3.037  20.480  -2.583
  307   2HB   ARG  46          2HB       ARG  46   2.544  20.943  -0.952
  308   1HG   ARG  46          1HG       ARG  46   4.576  20.144  -0.015
  309   2HG   ARG  46          2HG       ARG  46   5.075  19.445  -1.546
  310   1HD   ARG  46          1HD       ARG  46   6.280  21.431  -1.166
  311   2HD   ARG  46          2HD       ARG  46   5.146  21.715  -2.491
  312    HE   ARG  46           HE       ARG  46   3.790  22.923  -0.932
  313   1HH1  ARG  46          1HH1      ARG  46   7.080  22.235   0.225
  314   2HH1  ARG  46          2HH1      ARG  46   7.254  23.709   1.045
  315   1HH2  ARG  46          1HH2      ARG  46   4.021  24.923   0.287
  316   2HH2  ARG  46          2HH2      ARG  46   5.468  25.244   1.137
  317    H    ILE  47           H        ILE  47   3.860  17.078  -0.288
  318    HA   ILE  47           HA       ILE  47   2.636  17.055   2.285
  319    HB   ILE  47           HB       ILE  47   5.191  15.593   1.452
  320   1HG1  ILE  47          1HG1      ILE  47   2.307  14.646   1.522
  321   2HG1  ILE  47          2HG1      ILE  47   3.188  15.067   0.066
  322   1HG2  ILE  47          1HG2      ILE  47   5.060  15.843   3.795
  323   2HG2  ILE  47          2HG2      ILE  47   4.746  14.180   3.300
  324   3HG2  ILE  47          3HG2      ILE  47   3.424  15.195   3.824
  325   1HD1  ILE  47          1HD1      ILE  47   3.065  12.663   0.439
  326   2HD1  ILE  47          2HD1      ILE  47   3.948  12.860   1.955
  327   3HD1  ILE  47          3HD1      ILE  47   4.719  13.263   0.415
  328    H    THR  48           H        THR  48   2.980  18.278   3.851
  329    HA   THR  48           HA       THR  48   4.656  20.436   3.997
  330    HB   THR  48           HB       THR  48   3.899  20.212   6.458
  331    HG1  THR  48           1HG      THR  48   2.797  18.382   6.846
  332   1HG2  THR  48          1HG2      THR  48   1.982  20.207   4.207
  333   2HG2  THR  48          2HG2      THR  48   2.890  21.644   4.749
  334   3HG2  THR  48          3HG2      THR  48   1.660  20.887   5.806
  335    H    THR  49           H        THR  49   4.756  17.432   5.793
  336    HA   THR  49           HA       THR  49   7.510  18.099   6.667
  337    HB   THR  49           HB       THR  49   5.582  16.701   8.493
  338    HG1  THR  49           1HG      THR  49   4.410  18.370   8.427
  339   1HG2  THR  49          1HG2      THR  49   7.881  18.608   8.974
  340   2HG2  THR  49          2HG2      THR  49   7.955  16.851   9.124
  341   3HG2  THR  49          3HG2      THR  49   6.940  17.789  10.219
  342    H    THR  50           H        THR  50   8.776  16.284   7.206
  343    HA   THR  50           HA       THR  50   8.530  13.907   5.796
  344    HB   THR  50           HB       THR  50  10.525  14.852   6.646
  345    HG1  THR  50           1HG      THR  50  10.441  12.557   6.257
  346   1HG2  THR  50          1HG2      THR  50   9.832  15.692   8.771
  347   2HG2  THR  50          2HG2      THR  50  11.226  14.628   9.027
  348   3HG2  THR  50          3HG2      THR  50   9.584  14.064   9.390
  349    H    GLU  51           H        GLU  51   7.660  14.744   9.128
  350    HA   GLU  51           HA       GLU  51   6.608  12.259  10.024
  351   1HB   GLU  51          1HB       GLU  51   5.432  14.965  10.629
  352   2HB   GLU  51          2HB       GLU  51   5.300  13.511  11.599
  353   1HG   GLU  51          1HG       GLU  51   7.730  13.682  12.046
  354   2HG   GLU  51          2HG       GLU  51   7.725  15.226  11.189
  355    H    ASP  52           H        ASP  52   5.102  14.802   8.033
  356    HA   ASP  52           HA       ASP  52   2.529  13.602   8.049
  357   1HB   ASP  52          1HB       ASP  52   3.945  15.744   6.526
  358   2HB   ASP  52          2HB       ASP  52   2.348  15.216   6.056
  359    H    PHE  53           H        PHE  53   5.338  13.577   6.017
  360    HA   PHE  53           HA       PHE  53   4.282  12.158   3.889
  361   1HB   PHE  53          1HB       PHE  53   6.451  13.288   3.739
  362   2HB   PHE  53          2HB       PHE  53   7.063  12.319   5.060
  363    HD1  PHE  53           1HD      PHE  53   6.144  12.293   1.523
  364    HD2  PHE  53           2HD      PHE  53   7.885  10.100   4.708
  365    HE1  PHE  53           1HE      PHE  53   7.007  10.650  -0.082
  366    HE2  PHE  53           2HE      PHE  53   8.740   8.452   3.123
  367    HZ   PHE  53           HZ       PHE  53   8.302   8.753   0.689
  368    H    LYS  54           H        LYS  54   5.973  11.074   6.750
  369    HA   LYS  54           HA       LYS  54   5.871   8.237   6.332
  370   1HB   LYS  54          1HB       LYS  54   6.034   9.808   8.903
  371   2HB   LYS  54          2HB       LYS  54   6.328   8.079   8.734
  372   1HG   LYS  54          1HG       LYS  54   8.223   8.508   7.275
  373   2HG   LYS  54          2HG       LYS  54   7.904  10.238   7.337
  374   1HD   LYS  54          1HD       LYS  54   9.733   9.721   8.796
  375   2HD   LYS  54          2HD       LYS  54   8.349  10.181   9.783
  376   1HE   LYS  54          1HE       LYS  54   7.881   7.828  10.241
  377   2HE   LYS  54          2HE       LYS  54   9.219   7.346   9.200
  378   1HZ   LYS  54          1HZ       LYS  54  10.732   8.488  10.723
  379   2HZ   LYS  54          2HZ       LYS  54   9.883   7.270  11.483
  380   3HZ   LYS  54          3HZ       LYS  54   9.445   8.874  11.750
  381    H    HIS  55           H        HIS  55   3.646  10.484   7.923
  382    HA   HIS  55           HA       HIS  55   1.850   8.545   9.010
  383   1HB   HIS  55          1HB       HIS  55   2.023  10.914   9.797
  384   2HB   HIS  55          2HB       HIS  55   1.492  11.450   8.226
  385    HD1  HIS  55           1HD      HIS  55   0.173   9.991  11.405
  386    HD2  HIS  55           2HD      HIS  55  -1.269  11.290   7.735
  387    HE1  HIS  55           1HE      HIS  55  -2.313  10.197  11.698
  388    H    LEU  56           H        LEU  56   1.843  10.501   6.094
  389    HA   LEU  56           HA       LEU  56  -0.598   9.397   5.132
  390   1HB   LEU  56          1HB       LEU  56   1.052  11.473   4.431
  391   2HB   LEU  56          2HB       LEU  56   1.273  10.323   3.138
  392    HG   LEU  56           HG       LEU  56  -0.928  12.054   3.831
  393   1HD1  LEU  56          1HD1      LEU  56  -1.282  12.124   1.466
  394   2HD1  LEU  56          2HD1      LEU  56  -0.043  10.885   1.256
  395   3HD1  LEU  56          3HD1      LEU  56   0.378  12.447   1.946
  396   1HD2  LEU  56          1HD2      LEU  56  -2.685  10.606   2.803
  397   2HD2  LEU  56          2HD2      LEU  56  -2.159  10.091   4.366
  398   3HD2  LEU  56          3HD2      LEU  56  -1.564   9.247   2.924
  399    H    ALA  57           H        ALA  57   2.832   8.601   4.420
  400    HA   ALA  57           HA       ALA  57   2.234   6.705   2.485
  401   1HB   ALA  57          1HB       ALA  57   4.539   7.556   2.937
  402   2HB   ALA  57          2HB       ALA  57   4.463   5.796   2.857
  403   3HB   ALA  57          3HB       ALA  57   4.554   6.603   4.423
  404    H    ARG  58           H        ARG  58   2.381   6.385   5.920
  405    HA   ARG  58           HA       ARG  58   1.995   3.521   5.837
  406   1HB   ARG  58          1HB       ARG  58   1.674   3.566   8.273
  407   2HB   ARG  58          2HB       ARG  58   3.040   4.575   7.831
  408   1HG   ARG  58          1HG       ARG  58   1.630   6.559   8.057
  409   2HG   ARG  58          2HG       ARG  58   0.288   5.532   8.547
  410   1HD   ARG  58          1HD       ARG  58   2.930   5.712   9.959
  411   2HD   ARG  58          2HD       ARG  58   1.478   6.590  10.443
  412    HE   ARG  58           HE       ARG  58   0.938   3.838  10.249
  413   1HH1  ARG  58          1HH1      ARG  58   2.543   6.186  12.383
  414   2HH1  ARG  58          2HH1      ARG  58   2.453   5.184  13.756
  415   1HH2  ARG  58          1HH2      ARG  58   0.776   2.515  12.141
  416   2HH2  ARG  58          2HH2      ARG  58   1.401   3.065  13.623
  417    H    LYS  59           H        LYS  59  -0.120   6.277   6.227
  418    HA   LYS  59           HA       LYS  59  -2.524   5.040   6.848
  419   1HB   LYS  59          1HB       LYS  59  -1.988   7.471   6.945
  420   2HB   LYS  59          2HB       LYS  59  -2.039   7.517   5.197
  421   1HG   LYS  59          1HG       LYS  59  -4.074   8.409   6.197
  422   2HG   LYS  59          2HG       LYS  59  -4.398   6.975   5.221
  423   1HD   LYS  59          1HD       LYS  59  -4.593   5.609   7.149
  424   2HD   LYS  59          2HD       LYS  59  -3.994   6.892   8.201
  425   1HE   LYS  59          1HE       LYS  59  -6.488   7.031   6.579
  426   2HE   LYS  59          2HE       LYS  59  -6.466   6.555   8.285
  427   1HZ   LYS  59          1HZ       LYS  59  -6.994   8.881   8.142
  428   2HZ   LYS  59          2HZ       LYS  59  -5.800   9.193   7.088
  429   3HZ   LYS  59          3HZ       LYS  59  -5.396   8.783   8.711
  430    H    LEU  60           H        LEU  60  -1.159   5.935   3.705
  431    HA   LEU  60           HA       LEU  60  -3.317   5.054   2.260
  432   1HB   LEU  60          1HB       LEU  60  -0.500   5.551   1.456
  433   2HB   LEU  60          2HB       LEU  60  -1.801   5.367   0.269
  434    HG   LEU  60           HG       LEU  60  -1.984   7.278   2.496
  435   1HD1  LEU  60          1HD1      LEU  60  -1.241   9.069   0.844
  436   2HD1  LEU  60          2HD1      LEU  60  -0.711   7.774  -0.231
  437   3HD1  LEU  60          3HD1      LEU  60   0.018   7.961   1.355
  438   1HD2  LEU  60          1HD2      LEU  60  -3.998   6.738   1.385
  439   2HD2  LEU  60          2HD2      LEU  60  -3.285   7.103  -0.191
  440   3HD2  LEU  60          3HD2      LEU  60  -3.574   8.405   0.971
  441    H    THR  61           H        THR  61  -0.211   3.641   3.062
  442    HA   THR  61           HA       THR  61  -0.232   1.252   1.600
  443    HB   THR  61           HB       THR  61   0.738   1.681   4.439
  444    HG1  THR  61           1HG      THR  61   1.786   3.063   2.999
  445   1HG2  THR  61          1HG2      THR  61   1.489  -0.447   2.423
  446   2HG2  THR  61          2HG2      THR  61   0.494  -0.700   3.856
  447   3HG2  THR  61          3HG2      THR  61   2.187  -0.257   4.036
  448    H    HIS  62           H        HIS  62  -1.637   2.116   4.611
  449    HA   HIS  62           HA       HIS  62  -2.647  -0.547   5.005
  450   1HB   HIS  62          1HB       HIS  62  -1.924   0.887   6.896
  451   2HB   HIS  62          2HB       HIS  62  -3.282   1.956   6.547
  452    HD1  HIS  62           1HD      HIS  62  -2.812  -1.773   7.387
  453    HD2  HIS  62           2HD      HIS  62  -5.429   1.395   8.055
  454    HE1  HIS  62           1HE      HIS  62  -4.611  -2.703   8.802
  455    H    GLY  63           H        GLY  63  -3.932   2.400   3.561
  456   1HA   GLY  63          1HA       GLY  63  -6.611   1.538   3.784
  457   2HA   GLY  63          2HA       GLY  63  -6.055   2.862   2.786
  458    H    VAL  64           H        VAL  64  -4.128   1.223   1.318
  459    HA   VAL  64           HA       VAL  64  -5.831   0.005  -0.708
  460    HB   VAL  64           HB       VAL  64  -2.837  -0.234  -0.190
  461   1HG1  VAL  64          1HG1      VAL  64  -3.456  -2.285  -1.320
  462   2HG1  VAL  64          2HG1      VAL  64  -2.717  -1.274  -2.544
  463   3HG1  VAL  64          3HG1      VAL  64  -4.451  -1.445  -2.474
  464   1HG2  VAL  64          1HG2      VAL  64  -4.389   1.268  -2.295
  465   2HG2  VAL  64          2HG2      VAL  64  -2.637   1.131  -2.235
  466   3HG2  VAL  64          3HG2      VAL  64  -3.499   1.972  -0.942
  467    H    MET  65           H        MET  65  -4.020  -0.978   1.815
  468    HA   MET  65           HA       MET  65  -4.156  -3.814   1.565
  469   1HB   MET  65          1HB       MET  65  -2.490  -2.784   3.023
  470   2HB   MET  65          2HB       MET  65  -3.752  -2.125   4.013
  471   1HG   MET  65          1HG       MET  65  -4.430  -4.277   4.720
  472   2HG   MET  65          2HG       MET  65  -3.187  -5.040   3.738
  473   1HE   MET  65          1HE       MET  65  -2.483  -6.192   6.023
  474   2HE   MET  65          2HE       MET  65  -3.675  -5.162   6.849
  475   3HE   MET  65          3HE       MET  65  -2.016  -5.268   7.479
  476    H    ASN  66           H        ASN  66  -6.100  -1.539   3.527
  477    HA   ASN  66           HA       ASN  66  -7.971  -3.411   4.526
  478   1HB   ASN  66          1HB       ASN  66  -7.915  -0.476   4.038
  479   2HB   ASN  66          2HB       ASN  66  -9.381  -1.218   4.606
  480   1HD2  ASN  66          1HD2      ASN  66  -7.821   0.767   5.843
  481   2HD2  ASN  66          2HD2      ASN  66  -7.215   0.068   7.302
  482    H    LYS  67           H        LYS  67  -8.092  -1.450   1.662
  483    HA   LYS  67           HA       LYS  67 -10.755  -2.271   1.104
  484   1HB   LYS  67          1HB       LYS  67  -8.710  -1.049  -0.727
  485   2HB   LYS  67          2HB       LYS  67 -10.345  -1.437  -1.235
  486   1HG   LYS  67          1HG       LYS  67 -11.228   0.088   0.461
  487   2HG   LYS  67          2HG       LYS  67  -9.578   0.485   0.951
  488   1HD   LYS  67          1HD       LYS  67  -9.116   1.292  -1.316
  489   2HD   LYS  67          2HD       LYS  67 -10.769   0.912  -1.782
  490   1HE   LYS  67          1HE       LYS  67 -11.644   2.548  -0.257
  491   2HE   LYS  67          2HE       LYS  67 -10.044   2.848   0.413
  492   1HZ   LYS  67          1HZ       LYS  67  -9.336   3.680  -1.721
  493   2HZ   LYS  67          2HZ       LYS  67 -10.697   4.555  -1.205
  494   3HZ   LYS  67          3HZ       LYS  67 -10.837   3.383  -2.396
  495    H    GLU  68           H        GLU  68  -7.598  -3.533  -0.006
  496    HA   GLU  68           HA       GLU  68  -9.148  -5.308  -1.490
  497   1HB   GLU  68          1HB       GLU  68  -7.105  -6.219  -2.361
  498   2HB   GLU  68          2HB       GLU  68  -7.297  -4.465  -2.482
  499   1HG   GLU  68          1HG       GLU  68  -5.695  -4.083  -0.799
  500   2HG   GLU  68          2HG       GLU  68  -5.499  -5.818  -0.511
  501    H    LEU  69           H        LEU  69  -7.464  -5.551   1.650
  502    HA   LEU  69           HA       LEU  69  -8.024  -8.228   1.870
  503   1HB   LEU  69          1HB       LEU  69  -7.939  -6.041   3.918
  504   2HB   LEU  69          2HB       LEU  69  -8.313  -7.696   4.366
  505    HG   LEU  69           HG       LEU  69  -5.761  -6.821   3.007
  506   1HD1  LEU  69          1HD1      LEU  69  -6.286  -7.568   5.874
  507   2HD1  LEU  69          2HD1      LEU  69  -5.893  -5.952   5.259
  508   3HD1  LEU  69          3HD1      LEU  69  -4.710  -7.259   5.137
  509   1HD2  LEU  69          1HD2      LEU  69  -5.016  -9.079   3.676
  510   2HD2  LEU  69          2HD2      LEU  69  -6.275  -9.085   2.449
  511   3HD2  LEU  69          3HD2      LEU  69  -6.678  -9.462   4.129
  512    H    LYS  70           H        LYS  70 -10.298  -5.580   1.889
  513    HA   LYS  70           HA       LYS  70 -12.493  -7.106   2.885
  514   1HB   LYS  70          1HB       LYS  70 -12.421  -4.828   0.942
  515   2HB   LYS  70          2HB       LYS  70 -13.862  -5.476   1.699
  516   1HG   LYS  70          1HG       LYS  70 -13.029  -4.822   3.836
  517   2HG   LYS  70          2HG       LYS  70 -11.568  -4.181   3.059
  518   1HD   LYS  70          1HD       LYS  70 -12.933  -2.692   1.705
  519   2HD   LYS  70          2HD       LYS  70 -14.383  -3.295   2.475
  520   1HE   LYS  70          1HE       LYS  70 -12.125  -1.928   3.933
  521   2HE   LYS  70          2HE       LYS  70 -13.618  -1.119   3.445
  522   1HZ   LYS  70          1HZ       LYS  70 -14.833  -2.689   4.857
  523   2HZ   LYS  70          2HZ       LYS  70 -13.757  -1.779   5.750
  524   3HZ   LYS  70          3HZ       LYS  70 -13.392  -3.384   5.376
  525    H    TYR  71           H        TYR  71 -11.280  -6.336  -0.268
  526    HA   TYR  71           HA       TYR  71 -13.351  -7.788  -1.618
  527   1HB   TYR  71          1HB       TYR  71 -10.813  -6.632  -2.765
  528   2HB   TYR  71          2HB       TYR  71 -12.249  -7.100  -3.664
  529    HD1  TYR  71           1HD      TYR  71 -13.915  -5.784  -1.085
  530    HD2  TYR  71           2HD      TYR  71 -11.103  -4.458  -3.997
  531    HE1  TYR  71           1HE      TYR  71 -14.745  -3.519  -0.825
  532    HE2  TYR  71           2HE      TYR  71 -11.930  -2.155  -3.734
  533    HH   TYR  71           HH       TYR  71 -13.863  -1.012  -2.998
  534    H    CYS  72           H        CYS  72 -10.126  -8.400  -0.661
  535    HA   CYS  72           HA       CYS  72 -10.169 -10.954  -2.009
  536   1HB   CYS  72          1HB       CYS  72  -7.915  -9.523  -0.568
  537   2HB   CYS  72          2HB       CYS  72  -7.764 -11.106  -1.327
  538    HG   CYS  72           HG       CYS  72  -7.471 -10.324  -3.763
  539    H    LYS  73           H        LYS  73 -11.289 -12.194  -0.953
  540    HA   LYS  73           HA       LYS  73 -11.888 -11.987   1.815
  541   1HB   LYS  73          1HB       LYS  73 -12.572 -14.067  -0.256
  542   2HB   LYS  73          2HB       LYS  73 -13.374 -13.852   1.299
  543   1HG   LYS  73          1HG       LYS  73 -13.276 -11.584  -0.700
  544   2HG   LYS  73          2HG       LYS  73 -14.558 -12.814  -0.790
  545   1HD   LYS  73          1HD       LYS  73 -15.052 -12.158   1.596
  546   2HD   LYS  73          2HD       LYS  73 -13.853 -10.875   1.381
  547   1HE   LYS  73          1HE       LYS  73 -16.326 -11.236  -0.311
  548   2HE   LYS  73          2HE       LYS  73 -16.154 -10.073   0.999
  549   1HZ   LYS  73          1HZ       LYS  73 -15.741  -8.994  -1.107
  550   2HZ   LYS  73          2HZ       LYS  73 -14.586 -10.110  -1.537
  551   3HZ   LYS  73          3HZ       LYS  73 -14.314  -9.070  -0.221
  552    H    ASN  74           H        ASN  74  -9.510 -13.534  -0.022
  553    HA   ASN  74           HA       ASN  74  -8.441 -14.744   2.390
  554   1HB   ASN  74          1HB       ASN  74  -8.650 -16.089  -0.319
  555   2HB   ASN  74          2HB       ASN  74  -7.388 -16.538   0.817
  556   1HD2  ASN  74          1HD2      ASN  74 -10.758 -16.706   0.076
  557   2HD2  ASN  74          2HD2      ASN  74 -11.191 -17.822   1.322
  558    HA   PRO  75           HA       PRO  75  -5.143 -11.938   1.061
  559   1HB   PRO  75          1HB       PRO  75  -3.393 -12.901   2.707
  560   2HB   PRO  75          2HB       PRO  75  -4.408 -11.512   3.015
  561   1HG   PRO  75          1HG       PRO  75  -4.558 -14.321   4.105
  562   2HG   PRO  75          2HG       PRO  75  -5.282 -12.865   4.819
  563   1HD   PRO  75          1HD       PRO  75  -6.649 -14.860   3.512
  564   2HD   PRO  75          2HD       PRO  75  -7.239 -13.198   3.688
  565    H    GLU  76           H        GLU  76  -5.272 -15.070   0.535
  566    HA   GLU  76           HA       GLU  76  -2.572 -15.704  -0.083
  567   1HB   GLU  76          1HB       GLU  76  -4.493 -17.327   0.436
  568   2HB   GLU  76          2HB       GLU  76  -5.109 -16.958  -1.160
  569   1HG   GLU  76          1HG       GLU  76  -3.955 -19.046  -1.241
  570   2HG   GLU  76          2HG       GLU  76  -3.008 -17.850  -2.119
  571    H    ASP  77           H        ASP  77  -4.770 -13.663  -1.173
  572    HA   ASP  77           HA       ASP  77  -3.896 -13.535  -4.014
  573   1HB   ASP  77          1HB       ASP  77  -6.287 -14.215  -3.650
  574   2HB   ASP  77          2HB       ASP  77  -6.525 -12.706  -2.782
  575    H    LEU  78           H        LEU  78  -3.363 -12.195  -1.060
  576    HA   LEU  78           HA       LEU  78  -3.532  -9.446  -1.813
  577   1HB   LEU  78          1HB       LEU  78  -4.374 -10.254   0.356
  578   2HB   LEU  78          2HB       LEU  78  -2.784 -10.904   0.706
  579    HG   LEU  78           HG       LEU  78  -2.016  -8.577   0.310
  580   1HD1  LEU  78          1HD1      LEU  78  -3.589  -6.823   1.076
  581   2HD1  LEU  78          2HD1      LEU  78  -4.854  -8.040   1.128
  582   3HD1  LEU  78          3HD1      LEU  78  -4.130  -7.591  -0.428
  583   1HD2  LEU  78          1HD2      LEU  78  -1.682  -9.611   2.314
  584   2HD2  LEU  78          2HD2      LEU  78  -3.385  -9.513   2.752
  585   3HD2  LEU  78          3HD2      LEU  78  -2.392  -8.043   2.727
  586    H    GLU  79           H        GLU  79  -1.813  -8.905  -2.919
  587    HA   GLU  79           HA       GLU  79   0.946  -9.571  -2.208
  588   1HB   GLU  79          1HB       GLU  79   0.020 -11.269  -3.865
  589   2HB   GLU  79          2HB       GLU  79  -0.479  -9.847  -4.786
  590   1HG   GLU  79          1HG       GLU  79   1.346 -10.706  -5.781
  591   2HG   GLU  79          2HG       GLU  79   1.793  -9.182  -5.052
  592    H    CYS  80           H        CYS  80   2.185  -7.888  -2.756
  593    HA   CYS  80           HA       CYS  80   0.876  -5.513  -3.745
  594   1HB   CYS  80          1HB       CYS  80   2.484  -5.084  -1.966
  595   2HB   CYS  80          2HB       CYS  80   3.764  -5.974  -2.730
  596    HG   CYS  80           HG       CYS  80   4.736  -4.043  -3.980
  597    H    ASN  81           H        ASN  81   0.326  -6.594  -5.611
  598    HA   ASN  81           HA       ASN  81   2.545  -7.257  -7.245
  599   1HB   ASN  81          1HB       ASN  81   0.998  -8.492  -8.769
  600   2HB   ASN  81          2HB       ASN  81   0.693  -8.939  -7.090
  601   1HD2  ASN  81          1HD2      ASN  81  -1.269  -8.426  -6.293
  602   2HD2  ASN  81          2HD2      ASN  81  -2.552  -7.719  -7.192
  603    H    GLU  82           H        GLU  82   1.845  -6.841  -9.756
  604    HA   GLU  82           HA       GLU  82   2.022  -4.315 -10.472
  605   1HB   GLU  82          1HB       GLU  82   0.793  -6.657 -11.537
  606   2HB   GLU  82          2HB       GLU  82   0.696  -5.212 -12.558
  607   1HG   GLU  82          1HG       GLU  82   3.186  -6.364 -11.389
  608   2HG   GLU  82          2HG       GLU  82   2.693  -6.695 -13.070
  609    H    ASN  83           H        ASN  83  -1.017  -6.105 -10.415
  610    HA   ASN  83           HA       ASN  83  -2.878  -4.164 -11.115
  611   1HB   ASN  83          1HB       ASN  83  -3.058  -6.562  -9.295
  612   2HB   ASN  83          2HB       ASN  83  -4.465  -5.592  -9.717
  613   1HD2  ASN  83          1HD2      ASN  83  -3.869  -8.370 -10.236
  614   2HD2  ASN  83          2HD2      ASN  83  -3.920  -8.604 -11.943
  615    H    VAL  84           H        VAL  84  -1.698  -5.246  -7.888
  616    HA   VAL  84           HA       VAL  84  -3.260  -3.438  -6.553
  617    HB   VAL  84           HB       VAL  84  -0.679  -4.765  -5.744
  618   1HG1  VAL  84          1HG1      VAL  84  -2.563  -3.168  -3.983
  619   2HG1  VAL  84          2HG1      VAL  84  -0.923  -2.686  -4.424
  620   3HG1  VAL  84          3HG1      VAL  84  -1.186  -4.125  -3.446
  621   1HG2  VAL  84          1HG2      VAL  84  -2.133  -6.060  -4.375
  622   2HG2  VAL  84          2HG2      VAL  84  -2.580  -6.165  -6.090
  623   3HG2  VAL  84          3HG2      VAL  84  -3.517  -5.149  -4.967
  624    H    LYS  85           H        LYS  85   0.077  -3.227  -7.631
  625    HA   LYS  85           HA       LYS  85   0.746  -0.654  -6.650
  626   1HB   LYS  85          1HB       LYS  85   1.671  -2.064  -9.137
  627   2HB   LYS  85          2HB       LYS  85   2.416  -0.614  -8.467
  628   1HG   LYS  85          1HG       LYS  85   2.966  -1.748  -6.474
  629   2HG   LYS  85          2HG       LYS  85   2.102  -3.196  -7.000
  630   1HD   LYS  85          1HD       LYS  85   3.714  -3.266  -8.942
  631   2HD   LYS  85          2HD       LYS  85   4.637  -2.015  -8.089
  632   1HE   LYS  85          1HE       LYS  85   4.658  -3.441  -6.110
  633   2HE   LYS  85          2HE       LYS  85   3.803  -4.651  -7.067
  634   1HZ   LYS  85          1HZ       LYS  85   6.533  -3.637  -7.680
  635   2HZ   LYS  85          2HZ       LYS  85   5.696  -4.855  -8.517
  636   3HZ   LYS  85          3HZ       LYS  85   6.184  -5.116  -6.927
  637    H    HIS  86           H        HIS  86  -0.573  -1.590  -9.610
  638    HA   HIS  86           HA       HIS  86  -0.761   0.842 -10.977
  639   1HB   HIS  86          1HB       HIS  86  -1.266  -1.384 -11.949
  640   2HB   HIS  86          2HB       HIS  86  -2.773  -1.415 -11.054
  641    HD1  HIS  86           1HD      HIS  86  -4.528  -1.220 -12.822
  642    HD2  HIS  86           2HD      HIS  86  -1.417   1.452 -13.351
  643    HE1  HIS  86           1HE      HIS  86  -5.130   0.066 -14.881
  644    H    LYS  87           H        LYS  87  -3.148  -0.729  -9.026
  645    HA   LYS  87           HA       LYS  87  -5.084   1.329  -8.997
  646   1HB   LYS  87          1HB       LYS  87  -5.548  -1.075  -8.663
  647   2HB   LYS  87          2HB       LYS  87  -4.564  -1.094  -7.230
  648   1HG   LYS  87          1HG       LYS  87  -7.087   0.500  -7.485
  649   2HG   LYS  87          2HG       LYS  87  -7.063  -1.187  -6.965
  650   1HD   LYS  87          1HD       LYS  87  -5.706   1.144  -5.582
  651   2HD   LYS  87          2HD       LYS  87  -7.185   0.359  -5.042
  652   1HE   LYS  87          1HE       LYS  87  -4.435  -0.937  -5.207
  653   2HE   LYS  87          2HE       LYS  87  -5.235  -0.333  -3.765
  654   1HZ   LYS  87          1HZ       LYS  87  -6.276  -2.579  -5.434
  655   2HZ   LYS  87          2HZ       LYS  87  -6.925  -2.054  -3.985
  656   3HZ   LYS  87          3HZ       LYS  87  -5.425  -2.799  -4.003
  657    H    THR  88           H        THR  88  -2.348   0.653  -7.051
  658    HA   THR  88           HA       THR  88  -3.093   2.283  -4.872
  659    HB   THR  88           HB       THR  88  -0.631   0.894  -5.736
  660    HG1  THR  88           1HG      THR  88  -1.931  -0.562  -4.938
  661   1HG2  THR  88          1HG2      THR  88  -0.028   2.862  -4.602
  662   2HG2  THR  88          2HG2      THR  88   0.306   1.466  -3.549
  663   3HG2  THR  88          3HG2      THR  88  -1.105   2.523  -3.240
  664    H    LYS  89           H        LYS  89  -0.487   2.607  -7.239
  665    HA   LYS  89           HA       LYS  89   0.012   5.114  -6.320
  666   1HB   LYS  89          1HB       LYS  89   1.194   5.474  -8.619
  667   2HB   LYS  89          2HB       LYS  89   1.821   4.384  -7.403
  668   1HG   LYS  89          1HG       LYS  89   1.994   3.281  -9.525
  669   2HG   LYS  89          2HG       LYS  89   0.679   2.550  -8.582
  670   1HD   LYS  89          1HD       LYS  89  -0.811   3.189  -9.792
  671   2HD   LYS  89          2HD       LYS  89  -0.081   4.708 -10.377
  672   1HE   LYS  89          1HE       LYS  89   0.710   1.891 -11.199
  673   2HE   LYS  89          2HE       LYS  89  -0.268   2.970 -12.228
  674   1HZ   LYS  89          1HZ       LYS  89   1.959   2.939 -12.941
  675   2HZ   LYS  89          2HZ       LYS  89   2.560   3.160 -11.391
  676   3HZ   LYS  89          3HZ       LYS  89   1.755   4.437 -12.174
  677    H    GLU  90           H        GLU  90  -2.142   4.051  -8.868
  678    HA   GLU  90           HA       GLU  90  -2.934   6.653  -9.715
  679   1HB   GLU  90          1HB       GLU  90  -4.501   4.103  -9.756
  680   2HB   GLU  90          2HB       GLU  90  -5.091   5.603 -10.458
  681   1HG   GLU  90          1HG       GLU  90  -3.048   5.612 -11.910
  682   2HG   GLU  90          2HG       GLU  90  -2.712   3.979 -11.321
  683    H    TYR  91           H        TYR  91  -3.879   4.703  -6.959
  684    HA   TYR  91           HA       TYR  91  -6.231   6.173  -6.312
  685   1HB   TYR  91          1HB       TYR  91  -6.183   4.027  -5.307
  686   2HB   TYR  91          2HB       TYR  91  -4.496   4.182  -4.872
  687    HD1  TYR  91           1HD      TYR  91  -4.007   4.425  -2.652
  688    HD2  TYR  91           2HD      TYR  91  -7.743   5.909  -4.047
  689    HE1  TYR  91           1HE      TYR  91  -4.567   5.052  -0.390
  690    HE2  TYR  91           2HE      TYR  91  -8.348   6.542  -1.744
  691    HH   TYR  91           HH       TYR  91  -6.097   6.689   0.747
  692    H    ILE  92           H        ILE  92  -2.919   5.974  -5.188
  693    HA   ILE  92           HA       ILE  92  -2.775   8.017  -3.355
  694    HB   ILE  92           HB       ILE  92  -0.762   7.188  -5.433
  695   1HG1  ILE  92          1HG1      ILE  92  -1.722   5.656  -3.572
  696   2HG1  ILE  92          2HG1      ILE  92   0.021   5.569  -3.916
  697   1HG2  ILE  92          1HG2      ILE  92   0.972   8.272  -4.032
  698   2HG2  ILE  92          2HG2      ILE  92  -0.328   8.886  -2.988
  699   3HG2  ILE  92          3HG2      ILE  92  -0.238   9.409  -4.661
  700   1HD1  ILE  92          1HD1      ILE  92  -1.500   6.923  -1.772
  701   2HD1  ILE  92          2HD1      ILE  92   0.248   7.134  -2.046
  702   3HD1  ILE  92          3HD1      ILE  92  -0.395   5.540  -1.597
  703    H    LYS  93           H        LYS  93  -2.099   8.402  -6.794
  704    HA   LYS  93           HA       LYS  93  -1.729  11.171  -6.537
  705   1HB   LYS  93          1HB       LYS  93  -2.532   9.579  -8.986
  706   2HB   LYS  93          2HB       LYS  93  -1.942  11.241  -8.996
  707   1HG   LYS  93          1HG       LYS  93   0.156  10.469  -7.945
  708   2HG   LYS  93          2HG       LYS  93  -0.425   8.815  -8.062
  709   1HD   LYS  93          1HD       LYS  93  -0.479   9.011 -10.489
  710   2HD   LYS  93          2HD       LYS  93   0.093  10.681 -10.370
  711   1HE   LYS  93          1HE       LYS  93   2.134   9.897  -9.261
  712   2HE   LYS  93          2HE       LYS  93   1.569   8.235  -9.389
  713   1HZ   LYS  93          1HZ       LYS  93   1.664   8.449 -11.813
  714   2HZ   LYS  93          2HZ       LYS  93   3.156   8.777 -11.106
  715   3HZ   LYS  93          3HZ       LYS  93   2.205  10.041 -11.659
  716    H    LYS  94           H        LYS  94  -4.610   9.308  -7.253
  717    HA   LYS  94           HA       LYS  94  -6.167  11.606  -7.782
  718   1HB   LYS  94          1HB       LYS  94  -6.981   8.815  -6.960
  719   2HB   LYS  94          2HB       LYS  94  -8.129  10.073  -7.379
  720   1HG   LYS  94          1HG       LYS  94  -7.228  10.180  -9.627
  721   2HG   LYS  94          2HG       LYS  94  -6.015   8.973  -9.203
  722   1HD   LYS  94          1HD       LYS  94  -7.670   7.298  -8.897
  723   2HD   LYS  94          2HD       LYS  94  -8.975   8.482  -8.986
  724   1HE   LYS  94          1HE       LYS  94  -7.085   7.794 -11.224
  725   2HE   LYS  94          2HE       LYS  94  -8.737   7.195 -11.065
  726   1HZ   LYS  94          1HZ       LYS  94  -9.483   9.542 -11.106
  727   2HZ   LYS  94          2HZ       LYS  94  -8.759   9.054 -12.526
  728   3HZ   LYS  94          3HZ       LYS  94  -7.907  10.028 -11.457
  729    H    TYR  95           H        TYR  95  -5.429   9.742  -4.941
  730    HA   TYR  95           HA       TYR  95  -7.130  10.951  -3.122
  731   1HB   TYR  95          1HB       TYR  95  -6.035   8.918  -2.663
  732   2HB   TYR  95          2HB       TYR  95  -4.464   9.657  -2.994
  733    HD1  TYR  95           1HD      TYR  95  -3.274  10.655  -1.209
  734    HD2  TYR  95           2HD      TYR  95  -7.376   9.716  -0.701
  735    HE1  TYR  95           1HE      TYR  95  -3.128  11.312   1.116
  736    HE2  TYR  95           2HE      TYR  95  -7.225  10.343   1.663
  737    HH   TYR  95           HH       TYR  95  -5.735  10.684   3.356
  738    H    MET  96           H        MET  96  -3.769  11.662  -3.875
  739    HA   MET  96           HA       MET  96  -3.539  13.831  -2.147
  740   1HB   MET  96          1HB       MET  96  -2.019  13.564  -4.740
  741   2HB   MET  96          2HB       MET  96  -1.586  14.478  -3.298
  742   1HG   MET  96          1HG       MET  96  -1.764  11.487  -3.458
  743   2HG   MET  96          2HG       MET  96  -0.279  12.434  -3.494
  744   1HE   MET  96          1HE       MET  96  -1.107  14.711  -1.397
  745   2HE   MET  96          2HE       MET  96   0.464  13.966  -1.606
  746   3HE   MET  96          3HE       MET  96  -0.273  14.048   0.025
  747    H    GLN  97           H        GLN  97  -4.890  13.638  -5.222
  748    HA   GLN  97           HA       GLN  97  -4.928  16.406  -5.854
  749   1HB   GLN  97          1HB       GLN  97  -7.102  14.500  -6.715
  750   2HB   GLN  97          2HB       GLN  97  -6.658  16.011  -7.480
  751   1HG   GLN  97          1HG       GLN  97  -5.186  13.408  -7.470
  752   2HG   GLN  97          2HG       GLN  97  -5.811  14.286  -8.852
  753   1HE2  GLN  97          1HE2      GLN  97  -3.297  13.801  -6.684
  754   2HE2  GLN  97          2HE2      GLN  97  -2.105  14.866  -7.303
  755    H    LYS  98           H        LYS  98  -6.722  14.665  -3.545
  756    HA   LYS  98           HA       LYS  98  -8.919  16.526  -3.421
  757   1HB   LYS  98          1HB       LYS  98  -9.793  15.324  -1.627
  758   2HB   LYS  98          2HB       LYS  98  -9.072  14.143  -2.716
  759   1HG   LYS  98          1HG       LYS  98  -7.741  13.351  -1.107
  760   2HG   LYS  98          2HG       LYS  98  -7.219  14.971  -0.660
  761   1HD   LYS  98          1HD       LYS  98  -9.882  13.836   0.171
  762   2HD   LYS  98          2HD       LYS  98  -8.416  13.563   1.103
  763   1HE   LYS  98          1HE       LYS  98  -9.610  15.408   2.056
  764   2HE   LYS  98          2HE       LYS  98  -8.139  16.028   1.316
  765   1HZ   LYS  98          1HZ       LYS  98  -9.961  17.462   0.978
  766   2HZ   LYS  98          2HZ       LYS  98 -10.933  16.263   0.286
  767   3HZ   LYS  98          3HZ       LYS  98  -9.578  16.850  -0.521
  768    H    PHE  99           H        PHE  99  -5.827  16.382  -1.947
  769    HA   PHE  99           HA       PHE  99  -6.549  18.090   0.247
  770   1HB   PHE  99          1HB       PHE  99  -3.813  17.416  -0.826
  771   2HB   PHE  99          2HB       PHE  99  -4.096  18.407   0.595
  772    HD1  PHE  99           1HD      PHE  99  -5.832  17.169   2.351
  773    HD2  PHE  99           2HD      PHE  99  -3.196  15.275  -0.429
  774    HE1  PHE  99           1HE      PHE  99  -5.750  15.128   3.785
  775    HE2  PHE  99           2HE      PHE  99  -3.148  13.264   1.027
  776    HZ   PHE  99           HZ       PHE  99  -4.449  13.209   3.065
  777    H    GLY 100           H        GLY 100  -5.317  18.644  -2.963
  778   1HA   GLY 100          1HA       GLY 100  -5.831  20.650  -4.075
  779   2HA   GLY 100          2HA       GLY 100  -5.739  21.487  -2.527
  780    H    ALA 101           H        ALA 101  -4.054  22.665  -2.402
  781    HA   ALA 101           HA       ALA 101  -1.721  22.157  -4.040
  782   1HB   ALA 101          1HB       ALA 101  -2.230  24.288  -1.978
  783   2HB   ALA 101          2HB       ALA 101  -2.581  24.431  -3.700
  784   3HB   ALA 101          3HB       ALA 101  -0.908  24.263  -3.150
  785    H    VAL 102           H        VAL 102  -2.497  22.107  -0.583
  786    HA   VAL 102           HA       VAL 102   0.132  20.836  -0.174
  787    HB   VAL 102           HB       VAL 102  -1.167  22.182   2.120
  788   1HG1  VAL 102          1HG1      VAL 102   1.692  22.024   1.284
  789   2HG1  VAL 102          2HG1      VAL 102   0.863  21.027   2.480
  790   3HG1  VAL 102          3HG1      VAL 102   1.103  22.753   2.781
  791   1HG2  VAL 102          1HG2      VAL 102  -0.217  24.401   1.621
  792   2HG2  VAL 102          2HG2      VAL 102  -1.504  23.893   0.522
  793   3HG2  VAL 102          3HG2      VAL 102   0.181  23.827  -0.010
  794    H    TYR 103           H        TYR 103   0.226  19.320   1.482
  795    HA   TYR 103           HA       TYR 103  -2.126  17.754   1.560
  796   1HB   TYR 103          1HB       TYR 103  -0.244  16.467   1.076
  797   2HB   TYR 103          2HB       TYR 103   0.755  17.362   2.207
  798    HD1  TYR 103           1HD      TYR 103  -2.466  15.675   2.864
  799    HD2  TYR 103           2HD      TYR 103   1.682  15.679   3.463
  800    HE1  TYR 103           1HE      TYR 103  -2.739  13.927   4.477
  801    HE2  TYR 103           2HE      TYR 103   1.434  13.839   5.134
  802    HH   TYR 103           HH       TYR 103  -0.219  13.067   6.631
  803    H    LYS 104           H        LYS 104  -3.531  18.443   2.896
  804    HA   LYS 104           HA       LYS 104  -2.858  18.986   5.707
  805   1HB   LYS 104          1HB       LYS 104  -5.295  19.672   4.080
  806   2HB   LYS 104          2HB       LYS 104  -5.057  20.078   5.757
  807   1HG   LYS 104          1HG       LYS 104  -3.495  21.722   5.296
  808   2HG   LYS 104          2HG       LYS 104  -3.092  21.038   3.718
  809   1HD   LYS 104          1HD       LYS 104  -5.821  22.153   4.333
  810   2HD   LYS 104          2HD       LYS 104  -4.519  23.146   3.667
  811   1HE   LYS 104          1HE       LYS 104  -4.424  21.916   1.685
  812   2HE   LYS 104          2HE       LYS 104  -5.279  20.544   2.356
  813   1HZ   LYS 104          1HZ       LYS 104  -7.267  21.736   2.337
  814   2HZ   LYS 104          2HZ       LYS 104  -6.582  21.852   0.796
  815   3HZ   LYS 104          3HZ       LYS 104  -6.539  23.191   1.853
  816    HA   PRO 105           HA       PRO 105  -4.825  14.778   5.596
  817   1HB   PRO 105          1HB       PRO 105  -3.906  14.039   8.086
  818   2HB   PRO 105          2HB       PRO 105  -3.011  13.792   6.586
  819   1HG   PRO 105          1HG       PRO 105  -2.783  15.939   8.609
  820   2HG   PRO 105          2HG       PRO 105  -1.484  15.086   7.712
  821   1HD   PRO 105          1HD       PRO 105  -2.309  17.598   7.135
  822   2HD   PRO 105          2HD       PRO 105  -1.752  16.509   5.855
  823    H    LYS 106           H        LYS 106  -5.012  17.189   8.051
  824    HA   LYS 106           HA       LYS 106  -7.171  16.375   9.483
  825   1HB   LYS 106          1HB       LYS 106  -6.564  19.191   8.559
  826   2HB   LYS 106          2HB       LYS 106  -7.866  18.834   9.673
  827   1HG   LYS 106          1HG       LYS 106  -5.983  19.633  10.930
  828   2HG   LYS 106          2HG       LYS 106  -6.177  17.921  11.270
  829   1HD   LYS 106          1HD       LYS 106  -4.321  17.392   9.773
  830   2HD   LYS 106          2HD       LYS 106  -4.165  19.088   9.327
  831   1HE   LYS 106          1HE       LYS 106  -3.620  19.639  11.666
  832   2HE   LYS 106          2HE       LYS 106  -3.760  17.938  12.094
  833   1HZ   LYS 106          1HZ       LYS 106  -1.766  19.044  10.170
  834   2HZ   LYS 106          2HZ       LYS 106  -1.852  17.440  10.713
  835   3HZ   LYS 106          3HZ       LYS 106  -1.470  18.660  11.770
  836    H    GLU 107           H        GLU 107  -7.260  17.259   6.198
  837    HA   GLU 107           HA       GLU 107 -10.177  16.963   6.286
  838   1HB   GLU 107          1HB       GLU 107 -10.306  18.037   4.145
  839   2HB   GLU 107          2HB       GLU 107  -9.273  18.925   5.289
  840   1HG   GLU 107          1HG       GLU 107  -7.339  18.265   4.228
  841   2HG   GLU 107          2HG       GLU 107  -8.213  17.111   3.212
  842    H    ASP 108           H        ASP 108  -7.816  14.900   6.102
  843    HA   ASP 108           HA       ASP 108  -8.208  13.443   3.763
  844   1HB   ASP 108          1HB       ASP 108  -6.196  13.041   4.817
  845   2HB   ASP 108          2HB       ASP 108  -6.876  12.902   6.408
  846    H    THR 109           H        THR 109  -9.070  11.398   3.604
  847    HA   THR 109           HA       THR 109 -11.866  11.654   3.998
  848    HB   THR 109           HB       THR 109 -11.245  10.926   1.871
  849    HG1  THR 109           1HG      THR 109 -12.852   9.458   3.275
  850   1HG2  THR 109          1HG2      THR 109  -9.880   8.896   1.441
  851   2HG2  THR 109          2HG2      THR 109  -9.646   8.744   3.198
  852   3HG2  THR 109          3HG2      THR 109  -9.032  10.152   2.349
  Start of MODEL   11
    1    H    THR  10           H        THR  10  -1.678 -23.521   3.241
    2    HA   THR  10           HA       THR  10  -4.038 -22.923   4.755
    3    HB   THR  10           HB       THR  10  -2.953 -24.460   6.169
    4    HG1  THR  10           1HG      THR  10  -1.902 -22.890   7.810
    5   1HG2  THR  10          1HG2      THR  10  -0.562 -24.345   6.807
    6   2HG2  THR  10          2HG2      THR  10  -0.350 -23.010   5.672
    7   3HG2  THR  10          3HG2      THR  10  -0.791 -24.610   5.076
    8    H    SER  11           H        SER  11  -4.386 -21.107   3.780
    9    HA   SER  11           HA       SER  11  -2.379 -19.072   3.204
   10   1HB   SER  11          1HB       SER  11  -5.312 -18.999   3.007
   11   2HB   SER  11          2HB       SER  11  -4.121 -18.073   2.056
   12    HG   SER  11           HG       SER  11  -4.410 -19.743   0.613
   13    H    SER  12           H        SER  12  -4.366 -19.822   5.758
   14    HA   SER  12           HA       SER  12  -4.812 -17.239   6.669
   15   1HB   SER  12          1HB       SER  12  -5.104 -18.482   8.851
   16   2HB   SER  12          2HB       SER  12  -6.057 -19.055   7.467
   17    HG   SER  12           HG       SER  12  -5.134 -20.888   7.591
   18    H    GLU  13           H        GLU  13  -2.128 -19.639   7.422
   19    HA   GLU  13           HA       GLU  13  -0.748 -17.693   8.878
   20   1HB   GLU  13          1HB       GLU  13   0.894 -19.509   9.099
   21   2HB   GLU  13          2HB       GLU  13  -0.723 -19.954   9.615
   22   1HG   GLU  13          1HG       GLU  13  -1.018 -21.023   7.323
   23   2HG   GLU  13          2HG       GLU  13   0.688 -20.740   7.095
   24    H    LEU  14           H        LEU  14  -0.678 -18.969   5.627
   25    HA   LEU  14           HA       LEU  14   1.835 -18.146   4.688
   26   1HB   LEU  14          1HB       LEU  14   0.035 -19.404   3.450
   27   2HB   LEU  14          2HB       LEU  14  -0.806 -17.895   3.316
   28    HG   LEU  14           HG       LEU  14   1.000 -16.930   1.963
   29   1HD1  LEU  14          1HD1      LEU  14   2.864 -18.278   2.753
   30   2HD1  LEU  14          2HD1      LEU  14   2.718 -18.349   0.998
   31   3HD1  LEU  14          3HD1      LEU  14   2.167 -19.702   1.982
   32   1HD2  LEU  14          1HD2      LEU  14   0.508 -18.176  -0.078
   33   2HD2  LEU  14          2HD2      LEU  14  -0.945 -17.936   0.893
   34   3HD2  LEU  14          3HD2      LEU  14  -0.131 -19.503   0.889
   35    H    ALA  15           H        ALA  15  -0.940 -16.603   5.335
   36    HA   ALA  15           HA       ALA  15  -0.220 -14.122   4.060
   37   1HB   ALA  15          1HB       ALA  15  -2.476 -14.756   3.820
   38   2HB   ALA  15          2HB       ALA  15  -2.341 -13.239   4.719
   39   3HB   ALA  15          3HB       ALA  15  -2.687 -14.751   5.573
   40    H    LYS  16           H        LYS  16   0.039 -15.485   7.151
   41    HA   LYS  16           HA       LYS  16  -0.029 -13.122   8.658
   42   1HB   LYS  16          1HB       LYS  16  -0.060 -15.345   9.723
   43   2HB   LYS  16          2HB       LYS  16   1.574 -15.640   9.145
   44   1HG   LYS  16          1HG       LYS  16   2.408 -13.823  10.547
   45   2HG   LYS  16          2HG       LYS  16   0.773 -13.506  11.118
   46   1HD   LYS  16          1HD       LYS  16   2.040 -14.815  12.737
   47   2HD   LYS  16          2HD       LYS  16   0.679 -15.738  12.107
   48   1HE   LYS  16          1HE       LYS  16   2.177 -16.939  10.603
   49   2HE   LYS  16          2HE       LYS  16   3.539 -15.969  11.165
   50   1HZ   LYS  16          1HZ       LYS  16   3.272 -16.919  13.345
   51   2HZ   LYS  16          2HZ       LYS  16   3.452 -18.150  12.207
   52   3HZ   LYS  16          3HZ       LYS  16   1.929 -17.807  12.850
   53    H    LYS  17           H        LYS  17   2.428 -14.821   6.850
   54    HA   LYS  17           HA       LYS  17   4.385 -12.777   7.299
   55   1HB   LYS  17          1HB       LYS  17   4.432 -15.205   5.496
   56   2HB   LYS  17          2HB       LYS  17   5.703 -14.005   5.494
   57   1HG   LYS  17          1HG       LYS  17   6.474 -15.786   6.844
   58   2HG   LYS  17          2HG       LYS  17   6.044 -14.483   7.940
   59   1HD   LYS  17          1HD       LYS  17   5.267 -16.549   8.885
   60   2HD   LYS  17          2HD       LYS  17   3.855 -15.646   8.331
   61   1HE   LYS  17          1HE       LYS  17   3.663 -17.999   7.740
   62   2HE   LYS  17          2HE       LYS  17   3.790 -17.013   6.293
   63   1HZ   LYS  17          1HZ       LYS  17   6.173 -17.599   6.200
   64   2HZ   LYS  17          2HZ       LYS  17   5.178 -18.930   6.080
   65   3HZ   LYS  17          3HZ       LYS  17   5.967 -18.615   7.528
   66    H    SER  18           H        SER  18   2.059 -13.672   4.761
   67    HA   SER  18           HA       SER  18   3.221 -12.059   2.834
   68   1HB   SER  18          1HB       SER  18   1.435 -13.944   2.527
   69   2HB   SER  18          2HB       SER  18   0.270 -12.659   2.835
   70    HG   SER  18           HG       SER  18   0.680 -11.775   0.913
   71    H    LYS  19           H        LYS  19   0.855 -11.264   5.377
   72    HA   LYS  19           HA       LYS  19   0.165  -8.753   4.242
   73   1HB   LYS  19          1HB       LYS  19  -0.022  -9.537   7.156
   74   2HB   LYS  19          2HB       LYS  19  -0.803  -8.164   6.396
   75   1HG   LYS  19          1HG       LYS  19  -1.906 -10.017   4.891
   76   2HG   LYS  19          2HG       LYS  19  -1.483 -11.059   6.233
   77   1HD   LYS  19          1HD       LYS  19  -3.126  -8.544   6.469
   78   2HD   LYS  19          2HD       LYS  19  -3.789 -10.169   6.346
   79   1HE   LYS  19          1HE       LYS  19  -1.998  -9.128   8.525
   80   2HE   LYS  19          2HE       LYS  19  -3.745  -9.349   8.623
   81   1HZ   LYS  19          1HZ       LYS  19  -3.378 -11.763   8.243
   82   2HZ   LYS  19          2HZ       LYS  19  -2.681 -11.193   9.649
   83   3HZ   LYS  19          3HZ       LYS  19  -1.703 -11.500   8.330
   84    H    GLU  20           H        GLU  20   2.644  -9.761   6.575
   85    HA   GLU  20           HA       GLU  20   3.366  -7.052   7.000
   86   1HB   GLU  20          1HB       GLU  20   5.354  -7.819   8.163
   87   2HB   GLU  20          2HB       GLU  20   3.967  -8.750   8.687
   88   1HG   GLU  20          1HG       GLU  20   4.690 -10.652   7.461
   89   2HG   GLU  20          2HG       GLU  20   5.938  -9.718   6.638
   90    H    VAL  21           H        VAL  21   4.575  -9.553   4.801
   91    HA   VAL  21           HA       VAL  21   6.661  -7.924   3.741
   92    HB   VAL  21           HB       VAL  21   5.200 -10.273   2.476
   93   1HG1  VAL  21          1HG1      VAL  21   7.866  -9.027   1.753
   94   2HG1  VAL  21          2HG1      VAL  21   6.377  -8.871   0.825
   95   3HG1  VAL  21          3HG1      VAL  21   7.149 -10.446   0.986
   96   1HG2  VAL  21          1HG2      VAL  21   7.811 -10.197   3.992
   97   2HG2  VAL  21          2HG2      VAL  21   7.149 -11.610   3.170
   98   3HG2  VAL  21          3HG2      VAL  21   6.301 -10.913   4.551
   99    H    PHE  22           H        PHE  22   3.282  -8.430   2.754
  100    HA   PHE  22           HA       PHE  22   3.401  -6.810   0.436
  101   1HB   PHE  22          1HB       PHE  22   1.505  -8.139   0.503
  102   2HB   PHE  22          2HB       PHE  22   1.275  -7.887   2.230
  103    HD1  PHE  22           1HD      PHE  22   1.120  -6.027  -1.005
  104    HD2  PHE  22           2HD      PHE  22  -0.404  -6.459   2.926
  105    HE1  PHE  22           1HE      PHE  22  -0.562  -4.292  -1.462
  106    HE2  PHE  22           2HE      PHE  22  -2.085  -4.740   2.466
  107    HZ   PHE  22           HZ       PHE  22  -2.180  -3.660   0.286
  108    H    ARG  23           H        ARG  23   2.309  -6.120   3.709
  109    HA   ARG  23           HA       ARG  23   1.829  -3.412   3.140
  110   1HB   ARG  23          1HB       ARG  23   1.588  -2.977   5.507
  111   2HB   ARG  23          2HB       ARG  23   0.910  -4.546   5.120
  112   1HG   ARG  23          1HG       ARG  23   2.005  -5.135   7.058
  113   2HG   ARG  23          2HG       ARG  23   3.255  -5.365   5.867
  114   1HD   ARG  23          1HD       ARG  23   4.415  -3.424   6.381
  115   2HD   ARG  23          2HD       ARG  23   3.062  -2.731   7.273
  116    HE   ARG  23           HE       ARG  23   3.573  -4.065   9.105
  117   1HH1  ARG  23          1HH1      ARG  23   5.800  -4.899   6.487
  118   2HH1  ARG  23          2HH1      ARG  23   6.975  -5.544   7.526
  119   1HH2  ARG  23          1HH2      ARG  23   5.178  -4.956  10.486
  120   2HH2  ARG  23          2HH2      ARG  23   6.629  -5.594   9.842
  121    H    LYS  24           H        LYS  24   4.762  -5.054   3.893
  122    HA   LYS  24           HA       LYS  24   6.259  -2.793   4.579
  123   1HB   LYS  24          1HB       LYS  24   6.778  -5.314   4.921
  124   2HB   LYS  24          2HB       LYS  24   7.314  -5.308   3.263
  125   1HG   LYS  24          1HG       LYS  24   8.541  -3.758   5.540
  126   2HG   LYS  24          2HG       LYS  24   9.156  -5.238   4.823
  127   1HD   LYS  24          1HD       LYS  24   9.337  -3.998   2.668
  128   2HD   LYS  24          2HD       LYS  24   8.968  -2.521   3.555
  129   1HE   LYS  24          1HE       LYS  24  11.314  -4.363   3.987
  130   2HE   LYS  24          2HE       LYS  24  11.358  -2.732   3.330
  131   1HZ   LYS  24          1HZ       LYS  24  10.623  -1.897   5.498
  132   2HZ   LYS  24          2HZ       LYS  24  12.049  -2.753   5.614
  133   3HZ   LYS  24          3HZ       LYS  24  10.621  -3.469   6.115
  134    H    GLU  25           H        GLU  25   5.887  -4.647   1.453
  135    HA   GLU  25           HA       GLU  25   7.519  -2.751   0.087
  136   1HB   GLU  25          1HB       GLU  25   6.327  -4.102  -1.878
  137   2HB   GLU  25          2HB       GLU  25   7.841  -4.657  -1.112
  138   1HG   GLU  25          1HG       GLU  25   6.232  -5.993   0.340
  139   2HG   GLU  25          2HG       GLU  25   4.999  -5.550  -0.838
  140    H    MET  26           H        MET  26   4.130  -3.054   0.571
  141    HA   MET  26           HA       MET  26   3.576  -1.136  -1.441
  142   1HB   MET  26          1HB       MET  26   1.945  -2.748  -0.661
  143   2HB   MET  26          2HB       MET  26   1.984  -1.971   0.914
  144   1HG   MET  26          1HG       MET  26   0.043  -1.308  -0.685
  145   2HG   MET  26          2HG       MET  26   0.888  -0.060   0.221
  146   1HE   MET  26          1HE       MET  26   1.229  -0.555  -4.366
  147   2HE   MET  26          2HE       MET  26  -0.075  -1.235  -3.441
  148   3HE   MET  26          3HE       MET  26   1.548  -1.988  -3.357
  149    H    SER  27           H        SER  27   4.261  -1.003   1.961
  150    HA   SER  27           HA       SER  27   3.767   1.746   2.296
  151   1HB   SER  27          1HB       SER  27   5.827   0.067   3.783
  152   2HB   SER  27          2HB       SER  27   5.395   1.719   4.218
  153    HG   SER  27           HG       SER  27   3.678  -0.512   4.125
  154    H    GLN  28           H        GLN  28   6.543  -0.096   1.152
  155    HA   GLN  28           HA       GLN  28   8.231   2.192   0.856
  156   1HB   GLN  28          1HB       GLN  28   8.405  -0.483  -0.544
  157   2HB   GLN  28          2HB       GLN  28   9.682   0.722  -0.458
  158   1HG   GLN  28          1HG       GLN  28   8.502  -0.740   1.878
  159   2HG   GLN  28          2HG       GLN  28  10.025  -1.133   1.097
  160   1HE2  GLN  28          1HE2      GLN  28   9.377  -0.334   3.847
  161   2HE2  GLN  28          2HE2      GLN  28  10.369   1.027   4.178
  162    H    PHE  29           H        PHE  29   6.224   0.365  -1.358
  163    HA   PHE  29           HA       PHE  29   6.738   1.822  -3.648
  164   1HB   PHE  29          1HB       PHE  29   5.571  -0.318  -3.696
  165   2HB   PHE  29          2HB       PHE  29   4.229   0.371  -2.800
  166    HD1  PHE  29           1HD      PHE  29   2.546   1.570  -3.865
  167    HD2  PHE  29           2HD      PHE  29   5.982   0.366  -6.029
  168    HE1  PHE  29           1HE      PHE  29   1.414   2.129  -5.951
  169    HE2  PHE  29           2HE      PHE  29   4.849   0.922  -8.132
  170    HZ   PHE  29           HZ       PHE  29   2.524   1.818  -8.062
  171    H    ILE  30           H        ILE  30   4.200   2.286  -1.230
  172    HA   ILE  30           HA       ILE  30   3.118   4.589  -2.372
  173    HB   ILE  30           HB       ILE  30   3.057   3.576   0.474
  174   1HG1  ILE  30          1HG1      ILE  30   0.891   3.774  -1.621
  175   2HG1  ILE  30          2HG1      ILE  30   1.886   2.350  -1.379
  176   1HG2  ILE  30          1HG2      ILE  30   1.532   5.932  -0.658
  177   2HG2  ILE  30          2HG2      ILE  30   2.894   6.052   0.425
  178   3HG2  ILE  30          3HG2      ILE  30   1.391   5.292   0.988
  179   1HD1  ILE  30          1HD1      ILE  30   1.013   2.118   0.877
  180   2HD1  ILE  30          2HD1      ILE  30  -0.277   2.100  -0.294
  181   3HD1  ILE  30          3HD1      ILE  30   0.010   3.537   0.669
  182    H    VAL  31           H        VAL  31   5.593   4.203   0.175
  183    HA   VAL  31           HA       VAL  31   6.188   6.860   0.538
  184    HB   VAL  31           HB       VAL  31   7.940   4.399   0.561
  185   1HG1  VAL  31          1HG1      VAL  31   9.803   5.663   1.457
  186   2HG1  VAL  31          2HG1      VAL  31   8.875   7.142   1.427
  187   3HG1  VAL  31          3HG1      VAL  31   9.366   6.387  -0.097
  188   1HG2  VAL  31          1HG2      VAL  31   6.335   4.704   2.365
  189   2HG2  VAL  31          2HG2      VAL  31   6.989   6.294   2.708
  190   3HG2  VAL  31          3HG2      VAL  31   7.984   4.855   2.981
  191    H    GLN  32           H        GLN  32   7.466   4.746  -2.028
  192    HA   GLN  32           HA       GLN  32   9.063   6.491  -3.322
  193   1HB   GLN  32          1HB       GLN  32   9.001   4.148  -3.788
  194   2HB   GLN  32          2HB       GLN  32   7.346   4.257  -4.357
  195   1HG   GLN  32          1HG       GLN  32   8.117   5.635  -6.222
  196   2HG   GLN  32          2HG       GLN  32   9.781   5.398  -5.676
  197   1HE2  GLN  32          1HE2      GLN  32   7.356   2.882  -5.488
  198   2HE2  GLN  32          2HE2      GLN  32   8.038   1.873  -6.707
  199    H    CYS  33           H        CYS  33   5.639   5.796  -3.701
  200    HA   CYS  33           HA       CYS  33   5.032   7.427  -5.868
  201   1HB   CYS  33          1HB       CYS  33   3.386   6.359  -3.635
  202   2HB   CYS  33          2HB       CYS  33   2.664   7.198  -5.021
  203    HG   CYS  33           HG       CYS  33   4.162   4.185  -4.800
  204    H    LEU  34           H        LEU  34   4.997   8.028  -2.436
  205    HA   LEU  34           HA       LEU  34   3.854  10.653  -2.658
  206   1HB   LEU  34          1HB       LEU  34   5.206   9.320  -0.342
  207   2HB   LEU  34          2HB       LEU  34   4.372  10.858  -0.260
  208    HG   LEU  34           HG       LEU  34   3.119   8.220  -0.943
  209   1HD1  LEU  34          1HD1      LEU  34   2.044   8.464   1.256
  210   2HD1  LEU  34          2HD1      LEU  34   2.953   9.948   1.531
  211   3HD1  LEU  34          3HD1      LEU  34   3.798   8.404   1.402
  212   1HD2  LEU  34          1HD2      LEU  34   1.994  10.061  -2.051
  213   2HD2  LEU  34          2HD2      LEU  34   1.885  10.933  -0.525
  214   3HD2  LEU  34          3HD2      LEU  34   1.002   9.423  -0.744
  215    H    ASN  35           H        ASN  35   7.083   9.425  -2.619
  216    HA   ASN  35           HA       ASN  35   8.594  11.440  -1.966
  217   1HB   ASN  35          1HB       ASN  35   8.979   9.365  -3.892
  218   2HB   ASN  35          2HB       ASN  35  10.008  10.792  -4.181
  219   1HD2  ASN  35          1HD2      ASN  35   8.825   8.650  -1.749
  220   2HD2  ASN  35          2HD2      ASN  35  10.127   8.933  -0.691
  221    HA   PRO  36           HA       PRO  36   8.228  14.045  -6.082
  222   1HB   PRO  36          1HB       PRO  36   5.925  13.718  -7.531
  223   2HB   PRO  36          2HB       PRO  36   7.430  12.876  -7.907
  224   1HG   PRO  36          1HG       PRO  36   5.042  11.892  -6.410
  225   2HG   PRO  36          2HG       PRO  36   6.033  11.053  -7.614
  226   1HD   PRO  36          1HD       PRO  36   6.274  10.637  -4.968
  227   2HD   PRO  36          2HD       PRO  36   7.666  10.511  -6.047
  228    H    TYR  37           H        TYR  37   5.686  13.252  -3.937
  229    HA   TYR  37           HA       TYR  37   4.298  15.775  -4.296
  230   1HB   TYR  37          1HB       TYR  37   3.825  13.519  -2.339
  231   2HB   TYR  37          2HB       TYR  37   2.834  14.965  -2.451
  232    HD1  TYR  37           1HD      TYR  37   3.894  11.948  -4.250
  233    HD2  TYR  37           2HD      TYR  37   1.104  15.123  -4.070
  234    HE1  TYR  37           1HE      TYR  37   2.560  10.828  -5.921
  235    HE2  TYR  37           2HE      TYR  37  -0.267  14.067  -5.752
  236    HH   TYR  37           HH       TYR  37  -0.080  12.408  -7.520
  237    H    ARG  38           H        ARG  38   6.714  14.449  -2.267
  238    HA   ARG  38           HA       ARG  38   6.344  16.536  -0.276
  239   1HB   ARG  38          1HB       ARG  38   8.225  15.567   0.893
  240   2HB   ARG  38          2HB       ARG  38   7.075  14.315   0.442
  241   1HG   ARG  38          1HG       ARG  38   8.463  13.660  -1.384
  242   2HG   ARG  38          2HG       ARG  38   9.587  14.970  -1.046
  243   1HD   ARG  38          1HD       ARG  38   9.901  13.997   1.240
  244   2HD   ARG  38          2HD       ARG  38   8.869  12.657   0.734
  245    HE   ARG  38           HE       ARG  38  10.647  12.184  -0.969
  246   1HH1  ARG  38          1HH1      ARG  38  11.497  13.938   2.004
  247   2HH1  ARG  38          2HH1      ARG  38  13.069  13.306   2.078
  248   1HH2  ARG  38          1HH2      ARG  38  12.797  11.301  -0.844
  249   2HH2  ARG  38          2HH2      ARG  38  13.839  11.803   0.419
  250    H    LYS  39           H        LYS  39   7.575  16.524  -3.204
  251    HA   LYS  39           HA       LYS  39  10.001  18.012  -2.951
  252   1HB   LYS  39          1HB       LYS  39   8.073  17.755  -5.265
  253   2HB   LYS  39          2HB       LYS  39   9.696  18.424  -5.351
  254   1HG   LYS  39          1HG       LYS  39   9.008  15.593  -4.627
  255   2HG   LYS  39          2HG       LYS  39   9.580  16.142  -6.205
  256   1HD   LYS  39          1HD       LYS  39  11.658  16.873  -5.223
  257   2HD   LYS  39          2HD       LYS  39  11.072  16.435  -3.614
  258   1HE   LYS  39          1HE       LYS  39  10.913  14.148  -4.243
  259   2HE   LYS  39          2HE       LYS  39  11.416  14.496  -5.892
  260   1HZ   LYS  39          1HZ       LYS  39  13.558  15.302  -4.964
  261   2HZ   LYS  39          2HZ       LYS  39  13.277  13.666  -4.695
  262   3HZ   LYS  39          3HZ       LYS  39  13.062  14.771  -3.436
  263    HA   PRO  40           HA       PRO  40   8.195  21.941  -2.076
  264   1HB   PRO  40          1HB       PRO  40  10.059  23.610  -3.131
  265   2HB   PRO  40          2HB       PRO  40  10.313  22.710  -1.630
  266   1HG   PRO  40          1HG       PRO  40  11.254  22.073  -4.400
  267   2HG   PRO  40          2HG       PRO  40  12.141  21.971  -2.867
  268   1HD   PRO  40          1HD       PRO  40  11.070  19.798  -4.059
  269   2HD   PRO  40          2HD       PRO  40  11.163  19.954  -2.295
  270    H    ASP  41           H        ASP  41   8.769  20.913  -5.318
  271    HA   ASP  41           HA       ASP  41   7.293  23.221  -6.373
  272   1HB   ASP  41          1HB       ASP  41   9.556  22.700  -7.362
  273   2HB   ASP  41          2HB       ASP  41   8.911  21.161  -7.909
  274    H    CYS  42           H        CYS  42   6.527  20.544  -5.035
  275    HA   CYS  42           HA       CYS  42   5.011  18.991  -6.783
  276   1HB   CYS  42          1HB       CYS  42   5.441  18.435  -4.356
  277   2HB   CYS  42          2HB       CYS  42   4.286  19.684  -3.968
  278    HG   CYS  42           HG       CYS  42   2.906  17.309  -3.605
  279    H    LYS  43           H        LYS  43   3.129  19.219  -7.751
  280    HA   LYS  43           HA       LYS  43   1.988  21.846  -7.884
  281   1HB   LYS  43          1HB       LYS  43   1.458  19.319  -9.384
  282   2HB   LYS  43          2HB       LYS  43   0.650  20.850  -9.697
  283   1HG   LYS  43          1HG       LYS  43   2.754  21.891 -10.236
  284   2HG   LYS  43          2HG       LYS  43   3.616  20.407  -9.830
  285   1HD   LYS  43          1HD       LYS  43   3.376  20.580 -12.207
  286   2HD   LYS  43          2HD       LYS  43   2.407  19.247 -11.565
  287   1HE   LYS  43          1HE       LYS  43   1.196  20.535 -13.313
  288   2HE   LYS  43          2HE       LYS  43   0.374  20.558 -11.758
  289   1HZ   LYS  43          1HZ       LYS  43   2.084  22.754 -12.827
  290   2HZ   LYS  43          2HZ       LYS  43   1.251  22.794 -11.377
  291   3HZ   LYS  43          3HZ       LYS  43   0.410  22.737 -12.816
  292    H    VAL  44           H        VAL  44   1.154  18.668  -6.699
  293    HA   VAL  44           HA       VAL  44  -1.276  19.710  -5.564
  294    HB   VAL  44           HB       VAL  44  -2.043  18.963  -7.753
  295   1HG1  VAL  44          1HG1      VAL  44  -0.805  16.306  -7.133
  296   2HG1  VAL  44          2HG1      VAL  44  -0.310  17.449  -8.385
  297   3HG1  VAL  44          3HG1      VAL  44  -1.877  16.644  -8.492
  298   1HG2  VAL  44          1HG2      VAL  44  -3.553  18.577  -5.884
  299   2HG2  VAL  44          2HG2      VAL  44  -2.836  16.985  -5.627
  300   3HG2  VAL  44          3HG2      VAL  44  -3.725  17.324  -7.114
  301    H    GLY  45           H        GLY  45  -1.497  19.033  -3.633
  302   1HA   GLY  45          1HA       GLY  45  -1.356  17.750  -1.739
  303   2HA   GLY  45          2HA       GLY  45  -0.996  16.368  -2.769
  304    H    ARG  46           H        ARG  46   0.818  19.511  -2.081
  305    HA   ARG  46           HA       ARG  46   3.286  18.156  -2.099
  306   1HB   ARG  46          1HB       ARG  46   2.926  20.578  -2.668
  307   2HB   ARG  46          2HB       ARG  46   2.595  20.868  -0.971
  308   1HG   ARG  46          1HG       ARG  46   4.860  19.959  -0.446
  309   2HG   ARG  46          2HG       ARG  46   5.202  19.943  -2.169
  310   1HD   ARG  46          1HD       ARG  46   4.534  22.303  -0.453
  311   2HD   ARG  46          2HD       ARG  46   6.091  21.935  -1.203
  312    HE   ARG  46           HE       ARG  46   4.392  22.140  -3.296
  313   1HH1  ARG  46          1HH1      ARG  46   5.090  24.315  -0.546
  314   2HH1  ARG  46          2HH1      ARG  46   4.870  25.733  -1.445
  315   1HH2  ARG  46          1HH2      ARG  46   4.071  24.173  -4.510
  316   2HH2  ARG  46          2HH2      ARG  46   4.266  25.655  -3.701
  317    H    ILE  47           H        ILE  47   4.006  16.936  -0.528
  318    HA   ILE  47           HA       ILE  47   2.809  16.987   2.074
  319    HB   ILE  47           HB       ILE  47   5.278  15.381   1.275
  320   1HG1  ILE  47          1HG1      ILE  47   2.343  14.626   1.327
  321   2HG1  ILE  47          2HG1      ILE  47   3.289  14.907  -0.131
  322   1HG2  ILE  47          1HG2      ILE  47   4.774  14.054   3.136
  323   2HG2  ILE  47          2HG2      ILE  47   3.449  15.094   3.614
  324   3HG2  ILE  47          3HG2      ILE  47   5.101  15.709   3.624
  325   1HD1  ILE  47          1HD1      ILE  47   4.686  13.030   0.372
  326   2HD1  ILE  47          2HD1      ILE  47   2.986  12.534   0.386
  327   3HD1  ILE  47          3HD1      ILE  47   3.853  12.794   1.906
  328    H    THR  48           H        THR  48   3.207  18.294   3.555
  329    HA   THR  48           HA       THR  48   5.044  20.304   3.613
  330    HB   THR  48           HB       THR  48   4.264  20.257   6.078
  331    HG1  THR  48           1HG      THR  48   2.991  18.577   6.543
  332   1HG2  THR  48          1HG2      THR  48   2.144  21.152   5.386
  333   2HG2  THR  48          2HG2      THR  48   2.345  20.324   3.829
  334   3HG2  THR  48          3HG2      THR  48   3.417  21.681   4.254
  335    H    THR  49           H        THR  49   4.891  17.469   5.681
  336    HA   THR  49           HA       THR  49   7.691  18.007   6.483
  337    HB   THR  49           HB       THR  49   5.714  16.940   8.453
  338    HG1  THR  49           1HG      THR  49   4.556  18.592   8.123
  339   1HG2  THR  49          1HG2      THR  49   7.093  18.231  10.022
  340   2HG2  THR  49          2HG2      THR  49   8.025  18.881   8.678
  341   3HG2  THR  49          3HG2      THR  49   8.099  17.157   9.049
  342    H    THR  50           H        THR  50   8.780  16.137   7.314
  343    HA   THR  50           HA       THR  50   8.407  13.753   5.951
  344    HB   THR  50           HB       THR  50  10.444  14.600   6.887
  345    HG1  THR  50           1HG      THR  50  10.621  12.528   6.446
  346   1HG2  THR  50          1HG2      THR  50   9.365  13.729   9.543
  347   2HG2  THR  50          2HG2      THR  50   9.614  15.380   9.004
  348   3HG2  THR  50          3HG2      THR  50  11.021  14.318   9.272
  349    H    GLU  51           H        GLU  51   7.453  14.703   9.212
  350    HA   GLU  51           HA       GLU  51   6.332  12.248  10.053
  351   1HB   GLU  51          1HB       GLU  51   5.052  13.549  11.688
  352   2HB   GLU  51          2HB       GLU  51   6.715  14.118  11.632
  353   1HG   GLU  51          1HG       GLU  51   6.078  16.024  10.321
  354   2HG   GLU  51          2HG       GLU  51   4.425  15.428  10.182
  355    H    ASP  52           H        ASP  52   4.954  14.833   7.961
  356    HA   ASP  52           HA       ASP  52   2.349  13.754   8.003
  357   1HB   ASP  52          1HB       ASP  52   3.884  15.758   6.392
  358   2HB   ASP  52          2HB       ASP  52   2.229  15.363   6.020
  359    H    PHE  53           H        PHE  53   5.183  13.632   5.973
  360    HA   PHE  53           HA       PHE  53   4.150  12.210   3.833
  361   1HB   PHE  53          1HB       PHE  53   6.408  13.286   3.803
  362   2HB   PHE  53          2HB       PHE  53   6.902  12.239   5.111
  363    HD1  PHE  53           1HD      PHE  53   7.413   9.936   4.733
  364    HD2  PHE  53           2HD      PHE  53   6.334  12.502   1.554
  365    HE1  PHE  53           1HE      PHE  53   8.249   8.295   3.175
  366    HE2  PHE  53           2HE      PHE  53   7.181  10.870  -0.066
  367    HZ   PHE  53           HZ       PHE  53   8.144   8.770   0.704
  368    H    LYS  54           H        LYS  54   5.718  11.099   6.705
  369    HA   LYS  54           HA       LYS  54   5.512   8.275   6.241
  370   1HB   LYS  54          1HB       LYS  54   6.040   9.921   8.670
  371   2HB   LYS  54          2HB       LYS  54   6.019   8.156   8.682
  372   1HG   LYS  54          1HG       LYS  54   7.816   8.105   7.053
  373   2HG   LYS  54          2HG       LYS  54   7.779   9.862   6.935
  374   1HD   LYS  54          1HD       LYS  54   8.514  10.120   9.144
  375   2HD   LYS  54          2HD       LYS  54   8.331   8.392   9.494
  376   1HE   LYS  54          1HE       LYS  54  10.687   8.975   9.149
  377   2HE   LYS  54          2HE       LYS  54  10.117   7.895   7.886
  378   1HZ   LYS  54          1HZ       LYS  54   9.906   9.766   6.403
  379   2HZ   LYS  54          2HZ       LYS  54  11.457   9.688   6.999
  380   3HZ   LYS  54          3HZ       LYS  54  10.402  10.851   7.601
  381    H    HIS  55           H        HIS  55   3.435  10.596   7.970
  382    HA   HIS  55           HA       HIS  55   1.632   8.717   9.170
  383   1HB   HIS  55          1HB       HIS  55   1.825  11.113   9.836
  384   2HB   HIS  55          2HB       HIS  55   1.334  11.590   8.236
  385    HD1  HIS  55           1HD      HIS  55  -0.057  10.519  11.528
  386    HD2  HIS  55           2HD      HIS  55  -1.445  11.322   7.681
  387    HE1  HIS  55           1HE      HIS  55  -2.526  10.739  11.746
  388    H    LEU  56           H        LEU  56   1.596  10.479   6.177
  389    HA   LEU  56           HA       LEU  56  -0.875   9.277   5.323
  390   1HB   LEU  56          1HB       LEU  56   0.277  11.460   4.574
  391   2HB   LEU  56          2HB       LEU  56   1.111  10.410   3.482
  392    HG   LEU  56           HG       LEU  56  -1.007   9.468   2.701
  393   1HD1  LEU  56          1HD1      LEU  56  -2.353  10.294   4.697
  394   2HD1  LEU  56          2HD1      LEU  56  -3.052  10.430   3.125
  395   3HD1  LEU  56          3HD1      LEU  56  -2.362  11.866   3.883
  396   1HD2  LEU  56          1HD2      LEU  56  -1.382  11.300   1.194
  397   2HD2  LEU  56          2HD2      LEU  56   0.329  11.031   1.550
  398   3HD2  LEU  56          3HD2      LEU  56  -0.525  12.385   2.320
  399    H    ALA  57           H        ALA  57   2.551   8.556   4.606
  400    HA   ALA  57           HA       ALA  57   1.964   6.580   2.709
  401   1HB   ALA  57          1HB       ALA  57   4.192   5.659   3.170
  402   2HB   ALA  57          2HB       ALA  57   4.247   6.518   4.707
  403   3HB   ALA  57          3HB       ALA  57   4.288   7.423   3.196
  404    H    ARG  58           H        ARG  58   2.039   6.418   6.146
  405    HA   ARG  58           HA       ARG  58   1.561   3.602   6.415
  406   1HB   ARG  58          1HB       ARG  58   0.766   5.845   8.267
  407   2HB   ARG  58          2HB       ARG  58   0.696   4.141   8.668
  408   1HG   ARG  58          1HG       ARG  58   3.081   3.975   8.566
  409   2HG   ARG  58          2HG       ARG  58   3.206   5.646   7.997
  410   1HD   ARG  58          1HD       ARG  58   2.122   6.402  10.039
  411   2HD   ARG  58          2HD       ARG  58   2.086   4.748  10.640
  412    HE   ARG  58           HE       ARG  58   4.702   5.535   9.904
  413   1HH1  ARG  58          1HH1      ARG  58   2.342   5.758  12.526
  414   2HH1  ARG  58          2HH1      ARG  58   3.479   6.182  13.723
  415   1HH2  ARG  58          1HH2      ARG  58   6.265   6.123  11.558
  416   2HH2  ARG  58          2HH2      ARG  58   5.759   6.381  13.160
  417    H    LYS  59           H        LYS  59  -0.559   6.460   6.235
  418    HA   LYS  59           HA       LYS  59  -2.912   5.044   6.883
  419   1HB   LYS  59          1HB       LYS  59  -2.671   7.430   7.259
  420   2HB   LYS  59          2HB       LYS  59  -2.483   7.709   5.542
  421   1HG   LYS  59          1HG       LYS  59  -4.763   7.197   5.113
  422   2HG   LYS  59          2HG       LYS  59  -4.996   6.579   6.751
  423   1HD   LYS  59          1HD       LYS  59  -4.207   9.432   6.181
  424   2HD   LYS  59          2HD       LYS  59  -5.888   8.914   6.301
  425   1HE   LYS  59          1HE       LYS  59  -5.519   8.151   8.585
  426   2HE   LYS  59          2HE       LYS  59  -3.810   8.556   8.479
  427   1HZ   LYS  59          1HZ       LYS  59  -4.282  10.820   8.493
  428   2HZ   LYS  59          2HZ       LYS  59  -5.382  10.224   9.624
  429   3HZ   LYS  59          3HZ       LYS  59  -5.876  10.601   8.040
  430    H    LEU  60           H        LEU  60  -1.476   6.039   3.806
  431    HA   LEU  60           HA       LEU  60  -3.525   5.220   2.279
  432   1HB   LEU  60          1HB       LEU  60  -0.625   5.479   1.589
  433   2HB   LEU  60          2HB       LEU  60  -1.903   5.386   0.372
  434    HG   LEU  60           HG       LEU  60  -1.945   7.381   2.553
  435   1HD1  LEU  60          1HD1      LEU  60  -0.600   7.581  -0.140
  436   2HD1  LEU  60          2HD1      LEU  60   0.101   7.868   1.448
  437   3HD1  LEU  60          3HD1      LEU  60  -1.085   8.992   0.781
  438   1HD2  LEU  60          1HD2      LEU  60  -3.245   7.220  -0.137
  439   2HD2  LEU  60          2HD2      LEU  60  -3.402   8.584   0.981
  440   3HD2  LEU  60          3HD2      LEU  60  -4.004   6.983   1.436
  441    H    THR  61           H        THR  61  -0.531   3.623   3.250
  442    HA   THR  61           HA       THR  61  -0.698   1.183   1.855
  443    HB   THR  61           HB       THR  61   0.343   1.567   4.685
  444    HG1  THR  61           1HG      THR  61   1.474   2.912   3.289
  445   1HG2  THR  61          1HG2      THR  61   0.011  -0.807   4.088
  446   2HG2  THR  61          2HG2      THR  61   1.727  -0.418   4.214
  447   3HG2  THR  61          3HG2      THR  61   0.978  -0.576   2.631
  448    H    HIS  62           H        HIS  62  -2.090   2.278   4.796
  449    HA   HIS  62           HA       HIS  62  -3.265  -0.218   5.508
  450   1HB   HIS  62          1HB       HIS  62  -2.709   1.557   7.171
  451   2HB   HIS  62          2HB       HIS  62  -3.907   2.593   6.411
  452    HD1  HIS  62           1HD      HIS  62  -3.475   0.143   9.104
  453    HD2  HIS  62           2HD      HIS  62  -6.651   1.704   6.921
  454    HE1  HIS  62           1HE      HIS  62  -5.523  -0.390  10.426
  455    H    GLY  63           H        GLY  63  -4.474   2.516   3.619
  456   1HA   GLY  63          1HA       GLY  63  -7.149   1.571   3.631
  457   2HA   GLY  63          2HA       GLY  63  -6.500   2.809   2.585
  458    H    VAL  64           H        VAL  64  -4.445   1.178   1.341
  459    HA   VAL  64           HA       VAL  64  -6.063  -0.090  -0.698
  460    HB   VAL  64           HB       VAL  64  -3.064  -0.315  -0.224
  461   1HG1  VAL  64          1HG1      VAL  64  -3.894  -2.164  -1.664
  462   2HG1  VAL  64          2HG1      VAL  64  -2.922  -1.069  -2.616
  463   3HG1  VAL  64          3HG1      VAL  64  -4.664  -1.003  -2.728
  464   1HG2  VAL  64          1HG2      VAL  64  -3.717   1.992  -0.631
  465   2HG2  VAL  64          2HG2      VAL  64  -4.585   1.504  -2.092
  466   3HG2  VAL  64          3HG2      VAL  64  -2.831   1.350  -2.016
  467    H    MET  65           H        MET  65  -4.237  -1.030   1.944
  468    HA   MET  65           HA       MET  65  -4.193  -3.843   1.582
  469   1HB   MET  65          1HB       MET  65  -2.630  -2.816   3.103
  470   2HB   MET  65          2HB       MET  65  -3.926  -2.153   4.059
  471   1HG   MET  65          1HG       MET  65  -4.501  -4.226   4.925
  472   2HG   MET  65          2HG       MET  65  -3.412  -5.086   3.842
  473   1HE   MET  65          1HE       MET  65  -3.645  -4.898   7.070
  474   2HE   MET  65          2HE       MET  65  -1.957  -5.108   7.575
  475   3HE   MET  65          3HE       MET  65  -2.647  -6.147   6.292
  476    H    ASN  66           H        ASN  66  -6.298  -1.742   3.450
  477    HA   ASN  66           HA       ASN  66  -8.129  -3.752   4.309
  478   1HB   ASN  66          1HB       ASN  66  -7.988  -0.834   4.284
  479   2HB   ASN  66          2HB       ASN  66  -9.620  -1.468   4.281
  480   1HD2  ASN  66          1HD2      ASN  66  -6.664  -1.091   5.927
  481   2HD2  ASN  66          2HD2      ASN  66  -7.199  -1.592   7.494
  482    H    LYS  67           H        LYS  67  -8.133  -1.710   1.496
  483    HA   LYS  67           HA       LYS  67 -10.659  -2.506   0.608
  484   1HB   LYS  67          1HB       LYS  67  -8.322  -1.359  -0.877
  485   2HB   LYS  67          2HB       LYS  67  -9.755  -1.893  -1.737
  486   1HG   LYS  67          1HG       LYS  67 -11.099  -0.323  -0.393
  487   2HG   LYS  67          2HG       LYS  67  -9.615   0.242   0.378
  488   1HD   LYS  67          1HD       LYS  67  -8.766   1.091  -1.665
  489   2HD   LYS  67          2HD       LYS  67 -10.012   0.270  -2.605
  490   1HE   LYS  67          1HE       LYS  67 -10.465   2.664  -2.417
  491   2HE   LYS  67          2HE       LYS  67 -11.719   1.719  -1.626
  492   1HZ   LYS  67          1HZ       LYS  67 -10.611   2.192   0.508
  493   2HZ   LYS  67          2HZ       LYS  67 -11.103   3.590  -0.303
  494   3HZ   LYS  67          3HZ       LYS  67  -9.488   3.147  -0.322
  495    H    GLU  68           H        GLU  68  -7.443  -3.845  -0.149
  496    HA   GLU  68           HA       GLU  68  -8.758  -5.673  -1.794
  497   1HB   GLU  68          1HB       GLU  68  -6.584  -6.689  -2.132
  498   2HB   GLU  68          2HB       GLU  68  -6.659  -4.942  -2.422
  499   1HG   GLU  68          1HG       GLU  68  -5.565  -4.531  -0.323
  500   2HG   GLU  68          2HG       GLU  68  -5.431  -6.268  -0.033
  501    H    LEU  69           H        LEU  69  -7.406  -5.874   1.505
  502    HA   LEU  69           HA       LEU  69  -8.089  -8.525   1.789
  503   1HB   LEU  69          1HB       LEU  69  -8.071  -6.287   3.790
  504   2HB   LEU  69          2HB       LEU  69  -8.473  -7.925   4.251
  505    HG   LEU  69           HG       LEU  69  -5.846  -7.077   3.034
  506   1HD1  LEU  69          1HD1      LEU  69  -6.574  -7.731   5.888
  507   2HD1  LEU  69          2HD1      LEU  69  -6.154  -6.133   5.260
  508   3HD1  LEU  69          3HD1      LEU  69  -4.947  -7.419   5.278
  509   1HD2  LEU  69          1HD2      LEU  69  -5.150  -9.317   3.843
  510   2HD2  LEU  69          2HD2      LEU  69  -6.317  -9.363   2.526
  511   3HD2  LEU  69          3HD2      LEU  69  -6.843  -9.674   4.184
  512    H    LYS  70           H        LYS  70 -10.314  -5.792   1.609
  513    HA   LYS  70           HA       LYS  70 -12.371  -7.446   2.712
  514   1HB   LYS  70          1HB       LYS  70 -13.863  -5.598   2.564
  515   2HB   LYS  70          2HB       LYS  70 -12.318  -5.084   3.230
  516   1HG   LYS  70          1HG       LYS  70 -11.693  -4.100   1.219
  517   2HG   LYS  70          2HG       LYS  70 -13.147  -4.697   0.414
  518   1HD   LYS  70          1HD       LYS  70 -14.518  -3.473   1.939
  519   2HD   LYS  70          2HD       LYS  70 -13.044  -2.837   2.750
  520   1HE   LYS  70          1HE       LYS  70 -12.358  -1.874   0.734
  521   2HE   LYS  70          2HE       LYS  70 -13.771  -2.552  -0.087
  522   1HZ   LYS  70          1HZ       LYS  70 -13.857  -0.505   2.095
  523   2HZ   LYS  70          2HZ       LYS  70 -15.194  -1.097   1.237
  524   3HZ   LYS  70          3HZ       LYS  70 -14.046  -0.170   0.467
  525    H    TYR  71           H        TYR  71 -11.265  -6.623  -0.427
  526    HA   TYR  71           HA       TYR  71 -13.619  -7.933  -1.674
  527   1HB   TYR  71          1HB       TYR  71 -11.245  -6.503  -2.877
  528   2HB   TYR  71          2HB       TYR  71 -12.553  -7.236  -3.800
  529    HD1  TYR  71           1HD      TYR  71 -14.155  -6.072  -0.988
  530    HD2  TYR  71           2HD      TYR  71 -12.220  -4.568  -4.461
  531    HE1  TYR  71           1HE      TYR  71 -15.414  -4.093  -0.762
  532    HE2  TYR  71           2HE      TYR  71 -13.520  -2.480  -4.260
  533    HH   TYR  71           HH       TYR  71 -15.648  -1.748  -3.256
  534    H    CYS  72           H        CYS  72 -10.268  -8.441  -1.094
  535    HA   CYS  72           HA       CYS  72 -10.379 -11.002  -2.423
  536   1HB   CYS  72          1HB       CYS  72  -8.146  -9.354  -1.275
  537   2HB   CYS  72          2HB       CYS  72  -7.876 -10.975  -1.870
  538    HG   CYS  72           HG       CYS  72  -7.140  -9.918  -4.167
  539    H    LYS  73           H        LYS  73 -11.450 -12.190  -1.142
  540    HA   LYS  73           HA       LYS  73 -11.494 -11.989   1.659
  541   1HB   LYS  73          1HB       LYS  73 -12.480 -14.097  -0.228
  542   2HB   LYS  73          2HB       LYS  73 -12.871 -14.037   1.489
  543   1HG   LYS  73          1HG       LYS  73 -13.460 -11.761  -0.409
  544   2HG   LYS  73          2HG       LYS  73 -14.654 -13.017  -0.007
  545   1HD   LYS  73          1HD       LYS  73 -14.316 -12.324   2.390
  546   2HD   LYS  73          2HD       LYS  73 -13.305 -11.011   1.786
  547   1HE   LYS  73          1HE       LYS  73 -15.140 -10.107   0.526
  548   2HE   LYS  73          2HE       LYS  73 -16.168 -11.461   0.997
  549   1HZ   LYS  73          1HZ       LYS  73 -15.972 -10.738   3.295
  550   2HZ   LYS  73          2HZ       LYS  73 -16.629  -9.540   2.335
  551   3HZ   LYS  73          3HZ       LYS  73 -15.040  -9.412   2.837
  552    H    ASN  74           H        ASN  74  -9.479 -13.647  -0.512
  553    HA   ASN  74           HA       ASN  74  -8.258 -14.974   1.776
  554   1HB   ASN  74          1HB       ASN  74  -7.136 -16.522   0.163
  555   2HB   ASN  74          2HB       ASN  74  -8.886 -16.657   0.122
  556   1HD2  ASN  74          1HD2      ASN  74  -9.977 -16.011  -1.709
  557   2HD2  ASN  74          2HD2      ASN  74  -9.208 -15.706  -3.203
  558    HA   PRO  75           HA       PRO  75  -5.036 -11.919   1.111
  559   1HB   PRO  75          1HB       PRO  75  -3.382 -12.865   2.880
  560   2HB   PRO  75          2HB       PRO  75  -4.669 -11.702   3.189
  561   1HG   PRO  75          1HG       PRO  75  -4.544 -14.702   3.770
  562   2HG   PRO  75          2HG       PRO  75  -5.405 -13.478   4.727
  563   1HD   PRO  75          1HD       PRO  75  -6.558 -15.228   2.979
  564   2HD   PRO  75          2HD       PRO  75  -7.260 -13.654   3.406
  565    H    GLU  76           H        GLU  76  -5.021 -15.018   0.566
  566    HA   GLU  76           HA       GLU  76  -2.419 -15.624  -0.237
  567   1HB   GLU  76          1HB       GLU  76  -4.296 -17.226   0.045
  568   2HB   GLU  76          2HB       GLU  76  -5.083 -16.515  -1.343
  569   1HG   GLU  76          1HG       GLU  76  -3.136 -17.264  -2.706
  570   2HG   GLU  76          2HG       GLU  76  -2.584 -18.163  -1.287
  571    H    ASP  77           H        ASP  77  -4.616 -13.436  -1.206
  572    HA   ASP  77           HA       ASP  77  -3.499 -12.999  -3.940
  573   1HB   ASP  77          1HB       ASP  77  -5.990 -13.628  -3.745
  574   2HB   ASP  77          2HB       ASP  77  -6.200 -12.071  -2.955
  575    H    LEU  78           H        LEU  78  -3.242 -11.981  -0.854
  576    HA   LEU  78           HA       LEU  78  -3.339  -9.150  -1.304
  577   1HB   LEU  78          1HB       LEU  78  -4.224 -10.171   0.733
  578   2HB   LEU  78          2HB       LEU  78  -2.656 -10.938   0.969
  579    HG   LEU  78           HG       LEU  78  -1.746  -8.698   1.039
  580   1HD1  LEU  78          1HD1      LEU  78  -4.624  -7.992   1.574
  581   2HD1  LEU  78          2HD1      LEU  78  -3.593  -7.342   0.288
  582   3HD1  LEU  78          3HD1      LEU  78  -3.276  -6.939   1.980
  583   1HD2  LEU  78          1HD2      LEU  78  -1.699  -9.989   2.886
  584   2HD2  LEU  78          2HD2      LEU  78  -3.421  -9.800   3.196
  585   3HD2  LEU  78          3HD2      LEU  78  -2.316  -8.429   3.444
  586    H    GLU  79           H        GLU  79  -1.657  -8.751  -2.579
  587    HA   GLU  79           HA       GLU  79   1.111  -9.329  -1.793
  588   1HB   GLU  79          1HB       GLU  79   0.204 -11.077  -3.368
  589   2HB   GLU  79          2HB       GLU  79  -0.274  -9.716  -4.381
  590   1HG   GLU  79          1HG       GLU  79   1.617 -10.741  -5.200
  591   2HG   GLU  79          2HG       GLU  79   1.972  -9.089  -4.721
  592    H    CYS  80           H        CYS  80   2.414  -7.702  -2.456
  593    HA   CYS  80           HA       CYS  80   1.081  -5.342  -3.445
  594   1HB   CYS  80          1HB       CYS  80   2.686  -4.906  -1.685
  595   2HB   CYS  80          2HB       CYS  80   3.981  -5.755  -2.459
  596    HG   CYS  80           HG       CYS  80   4.931  -3.701  -3.630
  597    H    ASN  81           H        ASN  81   0.501  -6.499  -5.287
  598    HA   ASN  81           HA       ASN  81   2.728  -7.041  -7.018
  599   1HB   ASN  81          1HB       ASN  81   1.270  -8.394  -8.458
  600   2HB   ASN  81          2HB       ASN  81   0.974  -8.859  -6.783
  601   1HD2  ASN  81          1HD2      ASN  81  -1.032  -8.463  -5.991
  602   2HD2  ASN  81          2HD2      ASN  81  -2.344  -7.884  -6.912
  603    H    GLU  82           H        GLU  82   2.007  -6.760  -9.356
  604    HA   GLU  82           HA       GLU  82   2.227  -4.284 -10.135
  605   1HB   GLU  82          1HB       GLU  82   2.420  -6.415 -11.303
  606   2HB   GLU  82          2HB       GLU  82   0.670  -6.406 -11.430
  607   1HG   GLU  82          1HG       GLU  82   0.751  -4.346 -12.685
  608   2HG   GLU  82          2HG       GLU  82   2.518  -4.353 -12.526
  609    H    ASN  83           H        ASN  83  -0.789  -6.120 -10.119
  610    HA   ASN  83           HA       ASN  83  -2.715  -4.257 -10.894
  611   1HB   ASN  83          1HB       ASN  83  -2.851  -6.630  -9.014
  612   2HB   ASN  83          2HB       ASN  83  -4.286  -5.730  -9.496
  613   1HD2  ASN  83          1HD2      ASN  83  -1.863  -8.020 -10.479
  614   2HD2  ASN  83          2HD2      ASN  83  -2.586  -8.428 -11.990
  615    H    VAL  84           H        VAL  84  -1.561  -5.261  -7.645
  616    HA   VAL  84           HA       VAL  84  -3.237  -3.498  -6.303
  617    HB   VAL  84           HB       VAL  84  -0.671  -4.859  -5.494
  618   1HG1  VAL  84          1HG1      VAL  84  -1.202  -4.259  -3.193
  619   2HG1  VAL  84          2HG1      VAL  84  -2.494  -3.194  -3.747
  620   3HG1  VAL  84          3HG1      VAL  84  -0.806  -2.842  -4.158
  621   1HG2  VAL  84          1HG2      VAL  84  -3.543  -5.236  -4.763
  622   2HG2  VAL  84          2HG2      VAL  84  -2.181  -6.174  -4.153
  623   3HG2  VAL  84          3HG2      VAL  84  -2.603  -6.242  -5.871
  624    H    LYS  85           H        LYS  85   0.084  -3.201  -7.292
  625    HA   LYS  85           HA       LYS  85   0.737  -0.648  -6.335
  626   1HB   LYS  85          1HB       LYS  85   1.599  -1.951  -8.897
  627   2HB   LYS  85          2HB       LYS  85   2.312  -0.499  -8.208
  628   1HG   LYS  85          1HG       LYS  85   3.024  -1.671  -6.321
  629   2HG   LYS  85          2HG       LYS  85   2.245  -3.173  -6.876
  630   1HD   LYS  85          1HD       LYS  85   3.701  -2.877  -8.956
  631   2HD   LYS  85          2HD       LYS  85   4.607  -1.704  -7.990
  632   1HE   LYS  85          1HE       LYS  85   4.744  -3.461  -6.231
  633   2HE   LYS  85          2HE       LYS  85   4.081  -4.556  -7.440
  634   1HZ   LYS  85          1HZ       LYS  85   5.987  -4.091  -8.878
  635   2HZ   LYS  85          2HZ       LYS  85   6.503  -4.694  -7.389
  636   3HZ   LYS  85          3HZ       LYS  85   6.623  -3.043  -7.710
  637    H    HIS  86           H        HIS  86  -0.595  -1.592  -9.360
  638    HA   HIS  86           HA       HIS  86  -0.762   0.890 -10.611
  639   1HB   HIS  86          1HB       HIS  86  -1.242  -1.330 -11.707
  640   2HB   HIS  86          2HB       HIS  86  -2.821  -1.305 -10.939
  641    HD1  HIS  86           1HD      HIS  86  -3.138  -1.509 -13.770
  642    HD2  HIS  86           2HD      HIS  86  -2.395   2.206 -12.087
  643    HE1  HIS  86           1HE      HIS  86  -3.909   0.169 -15.478
  644    H    LYS  87           H        LYS  87  -3.187  -0.794  -8.715
  645    HA   LYS  87           HA       LYS  87  -5.122   1.283  -8.708
  646   1HB   LYS  87          1HB       LYS  87  -4.670  -0.995  -6.813
  647   2HB   LYS  87          2HB       LYS  87  -6.080   0.057  -6.794
  648   1HG   LYS  87          1HG       LYS  87  -6.832  -0.740  -8.874
  649   2HG   LYS  87          2HG       LYS  87  -5.281  -1.511  -9.215
  650   1HD   LYS  87          1HD       LYS  87  -6.879  -3.159  -8.572
  651   2HD   LYS  87          2HD       LYS  87  -5.590  -2.959  -7.362
  652   1HE   LYS  87          1HE       LYS  87  -7.729  -3.227  -6.219
  653   2HE   LYS  87          2HE       LYS  87  -7.125  -1.595  -5.987
  654   1HZ   LYS  87          1HZ       LYS  87  -9.186  -2.394  -7.961
  655   2HZ   LYS  87          2HZ       LYS  87  -8.659  -0.818  -7.706
  656   3HZ   LYS  87          3HZ       LYS  87  -9.492  -1.639  -6.497
  657    H    THR  88           H        THR  88  -2.427   0.673  -6.801
  658    HA   THR  88           HA       THR  88  -3.143   2.305  -4.599
  659    HB   THR  88           HB       THR  88  -0.675   0.982  -5.541
  660    HG1  THR  88           1HG      THR  88  -2.031  -0.429  -4.663
  661   1HG2  THR  88          1HG2      THR  88  -0.052   2.994  -4.527
  662   2HG2  THR  88          2HG2      THR  88   0.368   1.656  -3.429
  663   3HG2  THR  88          3HG2      THR  88  -1.046   2.702  -3.091
  664    H    LYS  89           H        LYS  89  -0.650   2.646  -7.066
  665    HA   LYS  89           HA       LYS  89  -0.107   5.141  -6.184
  666   1HB   LYS  89          1HB       LYS  89   1.050   5.447  -8.542
  667   2HB   LYS  89          2HB       LYS  89   1.680   4.397  -7.298
  668   1HG   LYS  89          1HG       LYS  89   1.802   3.198  -9.347
  669   2HG   LYS  89          2HG       LYS  89   0.486   2.498  -8.392
  670   1HD   LYS  89          1HD       LYS  89  -0.165   2.591 -10.552
  671   2HD   LYS  89          2HD       LYS  89  -1.006   3.831  -9.639
  672   1HE   LYS  89          1HE       LYS  89  -0.306   4.816 -11.796
  673   2HE   LYS  89          2HE       LYS  89   0.649   5.495 -10.472
  674   1HZ   LYS  89          1HZ       LYS  89   2.052   4.957 -12.346
  675   2HZ   LYS  89          2HZ       LYS  89   1.546   3.368 -12.342
  676   3HZ   LYS  89          3HZ       LYS  89   2.461   3.962 -11.047
  677    H    GLU  90           H        GLU  90  -2.351   4.020  -8.589
  678    HA   GLU  90           HA       GLU  90  -3.148   6.584  -9.574
  679   1HB   GLU  90          1HB       GLU  90  -4.535   3.929  -9.549
  680   2HB   GLU  90          2HB       GLU  90  -5.285   5.367 -10.233
  681   1HG   GLU  90          1HG       GLU  90  -2.659   4.192 -11.123
  682   2HG   GLU  90          2HG       GLU  90  -4.204   3.937 -11.933
  683    H    TYR  91           H        TYR  91  -4.079   4.673  -6.769
  684    HA   TYR  91           HA       TYR  91  -6.424   6.155  -6.111
  685   1HB   TYR  91          1HB       TYR  91  -6.401   4.056  -5.061
  686   2HB   TYR  91          2HB       TYR  91  -4.683   4.137  -4.732
  687    HD1  TYR  91           1HD      TYR  91  -7.836   5.899  -3.727
  688    HD2  TYR  91           2HD      TYR  91  -4.022   4.434  -2.566
  689    HE1  TYR  91           1HE      TYR  91  -8.287   6.558  -1.398
  690    HE2  TYR  91           2HE      TYR  91  -4.440   5.082  -0.274
  691    HH   TYR  91           HH       TYR  91  -5.895   6.711   0.953
  692    H    ILE  92           H        ILE  92  -3.089   6.027  -5.060
  693    HA   ILE  92           HA       ILE  92  -2.959   8.136  -3.272
  694    HB   ILE  92           HB       ILE  92  -0.934   7.421  -5.396
  695   1HG1  ILE  92          1HG1      ILE  92  -1.813   5.748  -3.612
  696   2HG1  ILE  92          2HG1      ILE  92  -0.072   5.746  -3.981
  697   1HG2  ILE  92          1HG2      ILE  92   0.744   8.518  -3.965
  698   2HG2  ILE  92          2HG2      ILE  92  -0.560   8.974  -2.853
  699   3HG2  ILE  92          3HG2      ILE  92  -0.548   9.623  -4.482
  700   1HD1  ILE  92          1HD1      ILE  92  -0.527   5.522  -1.662
  701   2HD1  ILE  92          2HD1      ILE  92  -1.593   6.939  -1.724
  702   3HD1  ILE  92          3HD1      ILE  92   0.166   7.118  -1.987
  703    H    LYS  93           H        LYS  93  -2.458   8.380  -6.767
  704    HA   LYS  93           HA       LYS  93  -2.085  11.095  -6.863
  705   1HB   LYS  93          1HB       LYS  93  -3.534   9.361  -8.868
  706   2HB   LYS  93          2HB       LYS  93  -3.008  11.007  -9.181
  707   1HG   LYS  93          1HG       LYS  93  -0.713  10.369  -8.923
  708   2HG   LYS  93          2HG       LYS  93  -1.188   8.736  -8.452
  709   1HD   LYS  93          1HD       LYS  93  -2.235   8.446 -10.671
  710   2HD   LYS  93          2HD       LYS  93  -1.644  10.047 -11.128
  711   1HE   LYS  93          1HE       LYS  93   0.634   9.335 -10.807
  712   2HE   LYS  93          2HE       LYS  93   0.095   7.761 -10.229
  713   1HZ   LYS  93          1HZ       LYS  93  -0.252   8.849 -12.968
  714   2HZ   LYS  93          2HZ       LYS  93  -0.911   7.389 -12.416
  715   3HZ   LYS  93          3HZ       LYS  93   0.764   7.585 -12.506
  716    H    LYS  94           H        LYS  94  -5.100   9.279  -7.068
  717    HA   LYS  94           HA       LYS  94  -6.640  11.608  -7.551
  718   1HB   LYS  94          1HB       LYS  94  -7.518   8.917  -6.529
  719   2HB   LYS  94          2HB       LYS  94  -8.618  10.139  -7.159
  720   1HG   LYS  94          1HG       LYS  94  -7.600   9.866  -9.371
  721   2HG   LYS  94          2HG       LYS  94  -6.487   8.666  -8.705
  722   1HD   LYS  94          1HD       LYS  94  -8.540   7.375  -7.957
  723   2HD   LYS  94          2HD       LYS  94  -9.477   8.482  -8.955
  724   1HE   LYS  94          1HE       LYS  94  -7.255   6.683  -9.913
  725   2HE   LYS  94          2HE       LYS  94  -8.976   6.390 -10.126
  726   1HZ   LYS  94          1HZ       LYS  94  -9.102   8.375 -11.504
  727   2HZ   LYS  94          2HZ       LYS  94  -7.953   7.292 -12.096
  728   3HZ   LYS  94          3HZ       LYS  94  -7.453   8.666 -11.273
  729    H    TYR  95           H        TYR  95  -5.734   9.755  -4.753
  730    HA   TYR  95           HA       TYR  95  -7.384  10.988  -2.894
  731   1HB   TYR  95          1HB       TYR  95  -6.308   8.953  -2.423
  732   2HB   TYR  95          2HB       TYR  95  -4.730   9.674  -2.772
  733    HD1  TYR  95           1HD      TYR  95  -3.495  10.527  -0.947
  734    HD2  TYR  95           2HD      TYR  95  -7.697  10.013  -0.509
  735    HE1  TYR  95           1HE      TYR  95  -3.361  11.259   1.366
  736    HE2  TYR  95           2HE      TYR  95  -7.542  10.721   1.827
  737    HH   TYR  95           HH       TYR  95  -6.012  11.015   3.597
  738    H    MET  96           H        MET  96  -4.035  11.694  -3.718
  739    HA   MET  96           HA       MET  96  -3.873  13.854  -1.959
  740   1HB   MET  96          1HB       MET  96  -2.191  13.362  -4.372
  741   2HB   MET  96          2HB       MET  96  -1.780  14.398  -3.007
  742   1HG   MET  96          1HG       MET  96  -2.244  12.171  -1.639
  743   2HG   MET  96          2HG       MET  96  -1.855  11.450  -3.210
  744   1HE   MET  96          1HE       MET  96  -0.334  14.678  -1.840
  745   2HE   MET  96          2HE       MET  96   0.907  14.058  -0.727
  746   3HE   MET  96          3HE       MET  96  -0.824  13.739  -0.434
  747    H    GLN  97           H        GLN  97  -5.165  13.626  -5.030
  748    HA   GLN  97           HA       GLN  97  -5.062  16.360  -5.809
  749   1HB   GLN  97          1HB       GLN  97  -7.374  14.548  -6.513
  750   2HB   GLN  97          2HB       GLN  97  -6.867  15.990  -7.367
  751   1HG   GLN  97          1HG       GLN  97  -5.531  13.320  -7.247
  752   2HG   GLN  97          2HG       GLN  97  -6.158  14.150  -8.660
  753   1HE2  GLN  97          1HE2      GLN  97  -3.606  13.748  -6.470
  754   2HE2  GLN  97          2HE2      GLN  97  -2.400  14.706  -7.200
  755    H    LYS  98           H        LYS  98  -6.879  14.831  -3.391
  756    HA   LYS  98           HA       LYS  98  -8.962  16.809  -3.292
  757   1HB   LYS  98          1HB       LYS  98  -9.863  15.721  -1.433
  758   2HB   LYS  98          2HB       LYS  98  -9.237  14.469  -2.492
  759   1HG   LYS  98          1HG       LYS  98  -7.840  13.703  -0.950
  760   2HG   LYS  98          2HG       LYS  98  -7.320  15.318  -0.485
  761   1HD   LYS  98          1HD       LYS  98  -9.974  14.130   0.326
  762   2HD   LYS  98          2HD       LYS  98  -8.512  13.946   1.288
  763   1HE   LYS  98          1HE       LYS  98  -9.829  15.753   2.172
  764   2HE   LYS  98          2HE       LYS  98  -8.360  16.422   1.472
  765   1HZ   LYS  98          1HZ       LYS  98 -11.089  16.481   0.250
  766   2HZ   LYS  98          2HZ       LYS  98  -9.697  17.287  -0.343
  767   3HZ   LYS  98          3HZ       LYS  98 -10.350  17.710   1.108
  768    H    PHE  99           H        PHE  99  -5.772  16.632  -2.056
  769    HA   PHE  99           HA       PHE  99  -6.293  18.405   0.169
  770   1HB   PHE  99          1HB       PHE  99  -3.650  17.465  -0.962
  771   2HB   PHE  99          2HB       PHE  99  -3.826  18.510   0.443
  772    HD1  PHE  99           1HD      PHE  99  -5.591  17.495   2.255
  773    HD2  PHE  99           2HD      PHE  99  -3.204  15.248  -0.506
  774    HE1  PHE  99           1HE      PHE  99  -5.652  15.567   3.755
  775    HE2  PHE  99           2HE      PHE  99  -3.300  13.292   1.053
  776    HZ   PHE  99           HZ       PHE  99  -4.553  13.463   3.108
  777    H    GLY 100           H        GLY 100  -5.348  18.793  -3.121
  778   1HA   GLY 100          1HA       GLY 100  -5.758  20.870  -4.190
  779   2HA   GLY 100          2HA       GLY 100  -5.404  21.669  -2.661
  780    H    ALA 101           H        ALA 101  -3.589  22.610  -2.622
  781    HA   ALA 101           HA       ALA 101  -1.463  21.793  -4.474
  782   1HB   ALA 101          1HB       ALA 101  -1.642  24.198  -2.680
  783   2HB   ALA 101          2HB       ALA 101  -2.094  24.157  -4.387
  784   3HB   ALA 101          3HB       ALA 101  -0.410  23.900  -3.912
  785    H    VAL 102           H        VAL 102  -2.067  22.138  -1.018
  786    HA   VAL 102           HA       VAL 102   0.489  20.751  -0.602
  787    HB   VAL 102           HB       VAL 102  -0.702  22.430   1.550
  788   1HG1  VAL 102          1HG1      VAL 102   2.144  21.858   0.832
  789   2HG1  VAL 102          2HG1      VAL 102   1.190  21.078   2.097
  790   3HG1  VAL 102          3HG1      VAL 102   1.604  22.791   2.229
  791   1HG2  VAL 102          1HG2      VAL 102  -0.770  23.908  -0.292
  792   2HG2  VAL 102          2HG2      VAL 102   0.932  23.603  -0.673
  793   3HG2  VAL 102          3HG2      VAL 102   0.485  24.433   0.837
  794    H    TYR 103           H        TYR 103   0.537  19.437   1.214
  795    HA   TYR 103           HA       TYR 103  -1.876  17.968   1.422
  796   1HB   TYR 103          1HB       TYR 103  -0.021  16.615   0.919
  797   2HB   TYR 103          2HB       TYR 103   0.985  17.461   2.082
  798    HD1  TYR 103           1HD      TYR 103  -2.326  15.911   2.583
  799    HD2  TYR 103           2HD      TYR 103   1.774  15.798   3.429
  800    HE1  TYR 103           1HE      TYR 103  -2.747  14.185   4.193
  801    HE2  TYR 103           2HE      TYR 103   1.387  13.983   5.086
  802    HH   TYR 103           HH       TYR 103  -1.524  12.354   5.297
  803    H    LYS 104           H        LYS 104  -3.161  18.829   2.745
  804    HA   LYS 104           HA       LYS 104  -2.342  19.249   5.513
  805   1HB   LYS 104          1HB       LYS 104  -4.449  20.515   3.814
  806   2HB   LYS 104          2HB       LYS 104  -4.667  20.475   5.549
  807   1HG   LYS 104          1HG       LYS 104  -2.661  21.767   5.885
  808   2HG   LYS 104          2HG       LYS 104  -2.259  21.650   4.171
  809   1HD   LYS 104          1HD       LYS 104  -4.840  22.891   5.075
  810   2HD   LYS 104          2HD       LYS 104  -3.347  23.830   5.026
  811   1HE   LYS 104          1HE       LYS 104  -4.289  22.254   2.649
  812   2HE   LYS 104          2HE       LYS 104  -4.855  23.907   2.942
  813   1HZ   LYS 104          1HZ       LYS 104  -2.622  24.676   2.795
  814   2HZ   LYS 104          2HZ       LYS 104  -2.892  23.748   1.437
  815   3HZ   LYS 104          3HZ       LYS 104  -1.997  23.128   2.749
  816    HA   PRO 105           HA       PRO 105  -4.632  15.257   5.499
  817   1HB   PRO 105          1HB       PRO 105  -3.692  14.500   7.963
  818   2HB   PRO 105          2HB       PRO 105  -2.885  14.162   6.434
  819   1HG   PRO 105          1HG       PRO 105  -2.410  16.322   8.391
  820   2HG   PRO 105          2HG       PRO 105  -1.214  15.334   7.493
  821   1HD   PRO 105          1HD       PRO 105  -1.791  17.870   6.826
  822   2HD   PRO 105          2HD       PRO 105  -1.455  16.657   5.578
  823    H    LYS 106           H        LYS 106  -4.517  17.753   7.913
  824    HA   LYS 106           HA       LYS 106  -6.649  17.106   9.435
  825   1HB   LYS 106          1HB       LYS 106  -7.020  19.504   9.821
  826   2HB   LYS 106          2HB       LYS 106  -5.334  19.037   9.960
  827   1HG   LYS 106          1HG       LYS 106  -5.013  19.878   7.619
  828   2HG   LYS 106          2HG       LYS 106  -6.654  20.527   7.698
  829   1HD   LYS 106          1HD       LYS 106  -4.449  21.151   9.627
  830   2HD   LYS 106          2HD       LYS 106  -4.896  22.196   8.268
  831   1HE   LYS 106          1HE       LYS 106  -6.718  21.408  10.558
  832   2HE   LYS 106          2HE       LYS 106  -5.840  22.922  10.457
  833   1HZ   LYS 106          1HZ       LYS 106  -7.075  23.499   8.482
  834   2HZ   LYS 106          2HZ       LYS 106  -8.122  23.167   9.735
  835   3HZ   LYS 106          3HZ       LYS 106  -7.920  22.046   8.504
  836    H    GLU 107           H        GLU 107  -6.820  17.849   6.143
  837    HA   GLU 107           HA       GLU 107  -9.744  17.835   6.403
  838   1HB   GLU 107          1HB       GLU 107  -9.936  18.903   4.281
  839   2HB   GLU 107          2HB       GLU 107  -8.671  19.682   5.257
  840   1HG   GLU 107          1HG       GLU 107  -6.987  18.855   3.976
  841   2HG   GLU 107          2HG       GLU 107  -8.057  17.671   3.207
  842    H    ASP 108           H        ASP 108  -7.636  15.592   6.257
  843    HA   ASP 108           HA       ASP 108  -8.285  14.085   3.959
  844   1HB   ASP 108          1HB       ASP 108  -6.184  13.475   4.571
  845   2HB   ASP 108          2HB       ASP 108  -6.443  13.898   6.246
  846    H    THR 109           H        THR 109  -8.941  11.819   4.265
  847    HA   THR 109           HA       THR 109 -11.675  11.826   5.255
  848    HB   THR 109           HB       THR 109 -11.362  11.129   2.953
  849    HG1  THR 109           1HG      THR 109 -12.794   9.781   4.443
  850   1HG2  THR 109          1HG2      THR 109  -9.428   9.072   4.010
  851   2HG2  THR 109          2HG2      THR 109  -9.035  10.512   3.084
  852   3HG2  THR 109          3HG2      THR 109  -9.946   9.205   2.319
  Start of MODEL   12
    1    H    THR  10           H        THR  10  -3.740 -23.222   3.080
    2    HA   THR  10           HA       THR  10  -3.321 -22.686   5.232
    3    HB   THR  10           HB       THR  10  -0.877 -22.877   5.990
    4    HG1  THR  10           1HG      THR  10  -0.424 -22.394   3.446
    5   1HG2  THR  10          1HG2      THR  10  -2.320 -24.843   5.877
    6   2HG2  THR  10          2HG2      THR  10  -0.660 -25.252   5.447
    7   3HG2  THR  10          3HG2      THR  10  -1.878 -25.076   4.185
    8    H    SER  11           H        SER  11  -4.125 -20.684   4.120
    9    HA   SER  11           HA       SER  11  -2.339 -18.455   3.767
   10   1HB   SER  11          1HB       SER  11  -5.235 -18.741   3.591
   11   2HB   SER  11          2HB       SER  11  -4.235 -17.475   2.822
   12    HG   SER  11           HG       SER  11  -4.685 -19.220   1.235
   13    H    SER  12           H        SER  12  -3.822 -19.643   6.401
   14    HA   SER  12           HA       SER  12  -4.407 -17.113   7.462
   15   1HB   SER  12          1HB       SER  12  -4.484 -18.446   9.562
   16   2HB   SER  12          2HB       SER  12  -5.409 -19.075   8.166
   17    HG   SER  12           HG       SER  12  -4.335 -20.837   8.957
   18    H    GLU  13           H        GLU  13  -1.643 -19.484   7.841
   19    HA   GLU  13           HA       GLU  13  -0.103 -17.575   9.062
   20   1HB   GLU  13          1HB       GLU  13   1.600 -19.505   8.929
   21   2HB   GLU  13          2HB       GLU  13   0.141 -19.748   9.880
   22   1HG   GLU  13          1HG       GLU  13  -0.866 -21.061   8.102
   23   2HG   GLU  13          2HG       GLU  13   0.462 -20.696   7.032
   24    H    LEU  14           H        LEU  14  -0.146 -19.080   5.856
   25    HA   LEU  14           HA       LEU  14   2.296 -18.210   4.779
   26   1HB   LEU  14          1HB       LEU  14   0.581 -19.763   3.783
   27   2HB   LEU  14          2HB       LEU  14  -0.326 -18.349   3.348
   28    HG   LEU  14           HG       LEU  14   1.559 -17.531   1.971
   29   1HD1  LEU  14          1HD1      LEU  14   2.768 -20.224   2.556
   30   2HD1  LEU  14          2HD1      LEU  14   3.409 -18.652   3.040
   31   3HD1  LEU  14          3HD1      LEU  14   3.337 -19.089   1.335
   32   1HD2  LEU  14          1HD2      LEU  14   1.234 -19.109   0.125
   33   2HD2  LEU  14          2HD2      LEU  14  -0.286 -18.724   0.935
   34   3HD2  LEU  14          3HD2      LEU  14   0.514 -20.264   1.250
   35    H    ALA  15           H        ALA  15  -0.709 -16.802   5.128
   36    HA   ALA  15           HA       ALA  15   0.023 -14.475   3.611
   37   1HB   ALA  15          1HB       ALA  15  -2.168 -15.135   3.137
   38   2HB   ALA  15          2HB       ALA  15  -2.195 -13.608   4.078
   39   3HB   ALA  15          3HB       ALA  15  -2.573 -15.136   4.860
   40    H    LYS  16           H        LYS  16  -0.055 -15.429   6.892
   41    HA   LYS  16           HA       LYS  16  -0.183 -12.857   8.078
   42   1HB   LYS  16          1HB       LYS  16  -0.253 -14.919   9.442
   43   2HB   LYS  16          2HB       LYS  16   1.373 -15.322   8.926
   44   1HG   LYS  16          1HG       LYS  16   1.440 -14.447  11.164
   45   2HG   LYS  16          2HG       LYS  16   2.211 -13.298  10.070
   46   1HD   LYS  16          1HD       LYS  16   0.126 -11.973  10.035
   47   2HD   LYS  16          2HD       LYS  16  -0.587 -13.102  11.187
   48   1HE   LYS  16          1HE       LYS  16   1.789 -11.298  11.627
   49   2HE   LYS  16          2HE       LYS  16   0.205 -11.169  12.372
   50   1HZ   LYS  16          1HZ       LYS  16   1.766 -12.175  13.895
   51   2HZ   LYS  16          2HZ       LYS  16   2.156 -13.357  12.778
   52   3HZ   LYS  16          3HZ       LYS  16   0.614 -13.343  13.449
   53    H    LYS  17           H        LYS  17   2.258 -14.744   6.553
   54    HA   LYS  17           HA       LYS  17   4.323 -12.809   6.975
   55   1HB   LYS  17          1HB       LYS  17   4.347 -14.957   4.858
   56   2HB   LYS  17          2HB       LYS  17   5.717 -14.250   5.698
   57   1HG   LYS  17          1HG       LYS  17   3.697 -16.184   6.816
   58   2HG   LYS  17          2HG       LYS  17   5.385 -16.510   6.452
   59   1HD   LYS  17          1HD       LYS  17   5.987 -14.786   8.190
   60   2HD   LYS  17          2HD       LYS  17   4.260 -14.705   8.568
   61   1HE   LYS  17          1HE       LYS  17   5.485 -16.222  10.108
   62   2HE   LYS  17          2HE       LYS  17   4.227 -17.040   9.183
   63   1HZ   LYS  17          1HZ       LYS  17   7.107 -17.063   8.421
   64   2HZ   LYS  17          2HZ       LYS  17   5.861 -17.964   7.750
   65   3HZ   LYS  17          3HZ       LYS  17   6.352 -18.272   9.313
   66    H    SER  18           H        SER  18   2.106 -13.695   4.362
   67    HA   SER  18           HA       SER  18   3.228 -11.916   2.532
   68   1HB   SER  18          1HB       SER  18   1.621 -13.824   1.950
   69   2HB   SER  18          2HB       SER  18   0.313 -12.776   2.498
   70    HG   SER  18           HG       SER  18   0.580 -11.481   0.760
   71    H    LYS  19           H        LYS  19   1.064 -11.358   5.217
   72    HA   LYS  19           HA       LYS  19   0.023  -8.745   4.527
   73   1HB   LYS  19          1HB       LYS  19   0.678  -9.927   7.279
   74   2HB   LYS  19          2HB       LYS  19  -0.288  -8.499   6.937
   75   1HG   LYS  19          1HG       LYS  19  -1.164 -11.177   6.007
   76   2HG   LYS  19          2HG       LYS  19  -1.409 -10.639   7.661
   77   1HD   LYS  19          1HD       LYS  19  -2.524  -8.629   6.830
   78   2HD   LYS  19          2HD       LYS  19  -2.326  -9.234   5.180
   79   1HE   LYS  19          1HE       LYS  19  -4.495  -9.806   5.897
   80   2HE   LYS  19          2HE       LYS  19  -3.445 -11.247   5.856
   81   1HZ   LYS  19          1HZ       LYS  19  -4.800 -11.265   7.851
   82   2HZ   LYS  19          2HZ       LYS  19  -4.251  -9.754   8.290
   83   3HZ   LYS  19          3HZ       LYS  19  -3.186 -11.053   8.280
   84    H    GLU  20           H        GLU  20   2.750  -9.734   6.498
   85    HA   GLU  20           HA       GLU  20   3.551  -7.054   6.637
   86   1HB   GLU  20          1HB       GLU  20   5.670  -7.897   7.615
   87   2HB   GLU  20          2HB       GLU  20   4.202  -8.385   8.435
   88   1HG   GLU  20          1HG       GLU  20   4.362 -10.582   7.369
   89   2HG   GLU  20          2HG       GLU  20   5.871 -10.074   6.602
   90    H    VAL  21           H        VAL  21   4.546  -9.679   4.486
   91    HA   VAL  21           HA       VAL  21   6.657  -8.158   3.338
   92    HB   VAL  21           HB       VAL  21   5.054 -10.440   2.132
   93   1HG1  VAL  21          1HG1      VAL  21   7.771  -9.339   1.383
   94   2HG1  VAL  21          2HG1      VAL  21   6.287  -9.094   0.468
   95   3HG1  VAL  21          3HG1      VAL  21   6.972 -10.716   0.624
   96   1HG2  VAL  21          1HG2      VAL  21   7.683 -10.477   3.602
   97   2HG2  VAL  21          2HG2      VAL  21   6.958 -11.855   2.776
   98   3HG2  VAL  21          3HG2      VAL  21   6.151 -11.140   4.173
   99    H    PHE  22           H        PHE  22   3.247  -8.561   2.393
  100    HA   PHE  22           HA       PHE  22   3.357  -6.851   0.146
  101   1HB   PHE  22          1HB       PHE  22   1.394  -8.108   0.248
  102   2HB   PHE  22          2HB       PHE  22   1.232  -7.843   1.984
  103    HD1  PHE  22           1HD      PHE  22   1.118  -5.898  -1.227
  104    HD2  PHE  22           2HD      PHE  22  -0.447  -6.356   2.691
  105    HE1  PHE  22           1HE      PHE  22  -0.447  -4.060  -1.625
  106    HE2  PHE  22           2HE      PHE  22  -2.010  -4.539   2.277
  107    HZ   PHE  22           HZ       PHE  22  -2.050  -3.389   0.125
  108    H    ARG  23           H        ARG  23   2.338  -6.219   3.486
  109    HA   ARG  23           HA       ARG  23   2.005  -3.493   2.910
  110   1HB   ARG  23          1HB       ARG  23   1.780  -3.023   5.278
  111   2HB   ARG  23          2HB       ARG  23   0.979  -4.527   4.838
  112   1HG   ARG  23          1HG       ARG  23   1.975  -5.336   6.683
  113   2HG   ARG  23          2HG       ARG  23   3.334  -5.445   5.561
  114   1HD   ARG  23          1HD       ARG  23   4.335  -3.480   6.363
  115   2HD   ARG  23          2HD       ARG  23   2.912  -3.059   7.325
  116    HE   ARG  23           HE       ARG  23   3.475  -5.407   8.326
  117   1HH1  ARG  23          1HH1      ARG  23   5.623  -2.634   7.759
  118   2HH1  ARG  23          2HH1      ARG  23   6.740  -3.095   8.959
  119   1HH2  ARG  23          1HH2      ARG  23   5.034  -6.034   9.971
  120   2HH2  ARG  23          2HH2      ARG  23   6.392  -5.062  10.252
  121    H    LYS  24           H        LYS  24   4.961  -5.187   3.682
  122    HA   LYS  24           HA       LYS  24   6.375  -2.868   4.297
  123   1HB   LYS  24          1HB       LYS  24   7.286  -5.547   3.358
  124   2HB   LYS  24          2HB       LYS  24   8.415  -4.214   3.561
  125   1HG   LYS  24          1HG       LYS  24   7.780  -4.038   5.916
  126   2HG   LYS  24          2HG       LYS  24   6.630  -5.358   5.693
  127   1HD   LYS  24          1HD       LYS  24   8.611  -6.237   6.657
  128   2HD   LYS  24          2HD       LYS  24   8.461  -6.781   4.976
  129   1HE   LYS  24          1HE       LYS  24  10.786  -6.167   5.453
  130   2HE   LYS  24          2HE       LYS  24  10.094  -5.060   4.279
  131   1HZ   LYS  24          1HZ       LYS  24   9.748  -3.458   6.100
  132   2HZ   LYS  24          2HZ       LYS  24  11.368  -3.905   5.943
  133   3HZ   LYS  24          3HZ       LYS  24  10.444  -4.564   7.181
  134    H    GLU  25           H        GLU  25   6.006  -4.754   1.215
  135    HA   GLU  25           HA       GLU  25   7.656  -2.912  -0.178
  136   1HB   GLU  25          1HB       GLU  25   6.418  -4.177  -2.126
  137   2HB   GLU  25          2HB       GLU  25   7.848  -4.898  -1.329
  138   1HG   GLU  25          1HG       GLU  25   6.127  -6.146  -0.010
  139   2HG   GLU  25          2HG       GLU  25   4.915  -5.447  -1.065
  140    H    MET  26           H        MET  26   4.280  -3.139   0.384
  141    HA   MET  26           HA       MET  26   3.609  -1.228  -1.606
  142   1HB   MET  26          1HB       MET  26   2.026  -2.757  -0.719
  143   2HB   MET  26          2HB       MET  26   2.190  -2.057   0.891
  144   1HG   MET  26          1HG       MET  26   0.444  -0.735   0.397
  145   2HG   MET  26          2HG       MET  26   1.516   0.104  -0.708
  146   1HE   MET  26          1HE       MET  26   0.332  -1.379  -4.182
  147   2HE   MET  26          2HE       MET  26   1.754  -1.948  -3.340
  148   3HE   MET  26          3HE       MET  26   1.417  -0.207  -3.482
  149    H    SER  27           H        SER  27   4.387  -1.066   1.789
  150    HA   SER  27           HA       SER  27   3.889   1.667   2.191
  151   1HB   SER  27          1HB       SER  27   6.013  -0.017   3.568
  152   2HB   SER  27          2HB       SER  27   5.545   1.604   4.065
  153    HG   SER  27           HG       SER  27   3.920  -0.692   3.954
  154    H    GLN  28           H        GLN  28   6.693  -0.115   1.085
  155    HA   GLN  28           HA       GLN  28   8.335   2.202   0.896
  156   1HB   GLN  28          1HB       GLN  28   8.658  -0.540  -0.316
  157   2HB   GLN  28          2HB       GLN  28   9.893   0.711  -0.357
  158   1HG   GLN  28          1HG       GLN  28   9.967   0.725   2.089
  159   2HG   GLN  28          2HG       GLN  28   8.723  -0.520   2.128
  160   1HE2  GLN  28          1HE2      GLN  28  11.424  -0.574   3.187
  161   2HE2  GLN  28          2HE2      GLN  28  12.191  -1.920   2.429
  162    H    PHE  29           H        PHE  29   6.454   0.341  -1.393
  163    HA   PHE  29           HA       PHE  29   7.013   1.715  -3.725
  164   1HB   PHE  29          1HB       PHE  29   5.804  -0.386  -3.698
  165   2HB   PHE  29          2HB       PHE  29   4.500   0.334  -2.779
  166    HD1  PHE  29           1HD      PHE  29   2.726   1.421  -3.840
  167    HD2  PHE  29           2HD      PHE  29   6.160   0.252  -6.056
  168    HE1  PHE  29           1HE      PHE  29   1.524   1.836  -5.926
  169    HE2  PHE  29           2HE      PHE  29   4.936   0.681  -8.146
  170    HZ   PHE  29           HZ       PHE  29   2.576   1.460  -8.025
  171    H    ILE  30           H        ILE  30   4.464   2.260  -1.344
  172    HA   ILE  30           HA       ILE  30   3.378   4.548  -2.527
  173    HB   ILE  30           HB       ILE  30   3.240   3.497   0.294
  174   1HG1  ILE  30          1HG1      ILE  30   1.174   3.690  -1.902
  175   2HG1  ILE  30          2HG1      ILE  30   2.168   2.274  -1.599
  176   1HG2  ILE  30          1HG2      ILE  30   3.037   5.957   0.336
  177   2HG2  ILE  30          2HG2      ILE  30   1.508   5.176   0.761
  178   3HG2  ILE  30          3HG2      ILE  30   1.746   5.868  -0.851
  179   1HD1  ILE  30          1HD1      ILE  30  -0.057   2.029  -0.654
  180   2HD1  ILE  30          2HD1      ILE  30   0.187   3.465   0.336
  181   3HD1  ILE  30          3HD1      ILE  30   1.175   2.038   0.588
  182    H    VAL  31           H        VAL  31   5.775   4.185   0.097
  183    HA   VAL  31           HA       VAL  31   6.354   6.821   0.527
  184    HB   VAL  31           HB       VAL  31   8.153   4.384   0.465
  185   1HG1  VAL  31          1HG1      VAL  31   9.950   5.649   1.486
  186   2HG1  VAL  31          2HG1      VAL  31   8.990   7.114   1.465
  187   3HG1  VAL  31          3HG1      VAL  31   9.555   6.414  -0.059
  188   1HG2  VAL  31          1HG2      VAL  31   8.129   4.685   2.896
  189   2HG2  VAL  31          2HG2      VAL  31   6.487   4.568   2.246
  190   3HG2  VAL  31          3HG2      VAL  31   7.136   6.130   2.703
  191    H    GLN  32           H        GLN  32   7.695   4.783  -2.087
  192    HA   GLN  32           HA       GLN  32   9.274   6.623  -3.263
  193   1HB   GLN  32          1HB       GLN  32   9.356   4.284  -3.693
  194   2HB   GLN  32          2HB       GLN  32   7.758   4.295  -4.399
  195   1HG   GLN  32          1HG       GLN  32   9.444   4.079  -6.072
  196   2HG   GLN  32          2HG       GLN  32   8.548   5.590  -6.240
  197   1HE2  GLN  32          1HE2      GLN  32  10.161   6.525  -7.429
  198   2HE2  GLN  32          2HE2      GLN  32  11.667   7.047  -6.785
  199    H    CYS  33           H        CYS  33   5.890   5.807  -3.716
  200    HA   CYS  33           HA       CYS  33   5.279   7.419  -5.907
  201   1HB   CYS  33          1HB       CYS  33   3.595   6.295  -3.716
  202   2HB   CYS  33          2HB       CYS  33   2.904   7.108  -5.128
  203    HG   CYS  33           HG       CYS  33   4.656   4.205  -4.977
  204    H    LEU  34           H        LEU  34   5.165   7.999  -2.489
  205    HA   LEU  34           HA       LEU  34   4.032  10.625  -2.699
  206   1HB   LEU  34          1HB       LEU  34   5.351   9.259  -0.377
  207   2HB   LEU  34          2HB       LEU  34   4.539  10.806  -0.292
  208    HG   LEU  34           HG       LEU  34   3.250   8.180  -0.976
  209   1HD1  LEU  34          1HD1      LEU  34   2.177   8.439   1.224
  210   2HD1  LEU  34          2HD1      LEU  34   3.120   9.904   1.500
  211   3HD1  LEU  34          3HD1      LEU  34   3.931   8.346   1.360
  212   1HD2  LEU  34          1HD2      LEU  34   1.144   9.421  -0.752
  213   2HD2  LEU  34          2HD2      LEU  34   2.125  10.010  -2.088
  214   3HD2  LEU  34          3HD2      LEU  34   2.055  10.918  -0.576
  215    H    ASN  35           H        ASN  35   7.242   9.346  -2.722
  216    HA   ASN  35           HA       ASN  35   8.893  11.287  -2.024
  217   1HB   ASN  35          1HB       ASN  35   9.050   9.395  -4.210
  218   2HB   ASN  35          2HB       ASN  35  10.178  10.771  -4.398
  219   1HD2  ASN  35          1HD2      ASN  35   8.888   9.392  -1.534
  220   2HD2  ASN  35          2HD2      ASN  35  10.342   8.732  -0.977
  221    HA   PRO  36           HA       PRO  36   8.337  14.138  -5.917
  222   1HB   PRO  36          1HB       PRO  36   6.072  13.856  -7.405
  223   2HB   PRO  36          2HB       PRO  36   7.576  13.028  -7.800
  224   1HG   PRO  36          1HG       PRO  36   5.178  11.979  -6.362
  225   2HG   PRO  36          2HG       PRO  36   6.174  11.196  -7.602
  226   1HD   PRO  36          1HD       PRO  36   6.405  10.667  -4.979
  227   2HD   PRO  36          2HD       PRO  36   7.795  10.584  -6.062
  228    H    TYR  37           H        TYR  37   5.819  13.248  -3.776
  229    HA   TYR  37           HA       TYR  37   4.402  15.762  -4.119
  230   1HB   TYR  37          1HB       TYR  37   3.905  13.448  -2.243
  231   2HB   TYR  37          2HB       TYR  37   2.904  14.889  -2.325
  232    HD1  TYR  37           1HD      TYR  37   4.004  11.916  -4.199
  233    HD2  TYR  37           2HD      TYR  37   1.230  15.118  -4.004
  234    HE1  TYR  37           1HE      TYR  37   2.699  10.840  -5.916
  235    HE2  TYR  37           2HE      TYR  37  -0.107  14.124  -5.732
  236    HH   TYR  37           HH       TYR  37   0.348  10.872  -6.721
  237    H    ARG  38           H        ARG  38   6.808  14.460  -2.077
  238    HA   ARG  38           HA       ARG  38   6.366  16.507  -0.045
  239   1HB   ARG  38          1HB       ARG  38   8.238  15.529   1.146
  240   2HB   ARG  38          2HB       ARG  38   7.123  14.265   0.636
  241   1HG   ARG  38          1HG       ARG  38   8.538  13.696  -1.197
  242   2HG   ARG  38          2HG       ARG  38   9.628  15.021  -0.815
  243   1HD   ARG  38          1HD       ARG  38  10.033  13.931   1.403
  244   2HD   ARG  38          2HD       ARG  38   9.011  12.594   0.850
  245    HE   ARG  38           HE       ARG  38  11.127  13.210  -0.940
  246   1HH1  ARG  38          1HH1      ARG  38  10.408  11.421   2.048
  247   2HH1  ARG  38          2HH1      ARG  38  11.599  10.239   1.785
  248   1HH2  ARG  38          1HH2      ARG  38  12.815  11.603  -1.255
  249   2HH2  ARG  38          2HH2      ARG  38  13.001  10.353  -0.105
  250    H    LYS  39           H        LYS  39   7.652  16.557  -2.973
  251    HA   LYS  39           HA       LYS  39  10.073  18.040  -2.619
  252   1HB   LYS  39          1HB       LYS  39   8.194  18.042  -5.001
  253   2HB   LYS  39          2HB       LYS  39   9.870  18.553  -4.988
  254   1HG   LYS  39          1HG       LYS  39   8.924  15.743  -4.511
  255   2HG   LYS  39          2HG       LYS  39   9.520  16.363  -6.048
  256   1HD   LYS  39          1HD       LYS  39  11.685  16.804  -5.033
  257   2HD   LYS  39          2HD       LYS  39  11.082  16.236  -3.473
  258   1HE   LYS  39          1HE       LYS  39  10.642  14.046  -4.438
  259   2HE   LYS  39          2HE       LYS  39  11.246  14.599  -5.997
  260   1HZ   LYS  39          1HZ       LYS  39  13.421  14.946  -4.957
  261   2HZ   LYS  39          2HZ       LYS  39  12.917  13.342  -4.815
  262   3HZ   LYS  39          3HZ       LYS  39  12.818  14.369  -3.490
  263    HA   PRO  40           HA       PRO  40   8.055  21.776  -1.388
  264   1HB   PRO  40          1HB       PRO  40   9.964  23.580  -2.200
  265   2HB   PRO  40          2HB       PRO  40   9.992  22.682  -0.677
  266   1HG   PRO  40          1HG       PRO  40  11.460  22.176  -3.219
  267   2HG   PRO  40          2HG       PRO  40  11.990  21.927  -1.550
  268   1HD   PRO  40          1HD       PRO  40  11.191  19.901  -3.171
  269   2HD   PRO  40          2HD       PRO  40  10.989  19.867  -1.406
  270    H    ASP  41           H        ASP  41   8.768  21.107  -4.633
  271    HA   ASP  41           HA       ASP  41   7.169  23.429  -5.477
  272   1HB   ASP  41          1HB       ASP  41   9.494  23.341  -6.368
  273   2HB   ASP  41          2HB       ASP  41   9.103  21.819  -7.153
  274    H    CYS  42           H        CYS  42   6.616  20.573  -4.617
  275    HA   CYS  42           HA       CYS  42   5.260  19.196  -6.645
  276   1HB   CYS  42          1HB       CYS  42   5.571  18.197  -4.420
  277   2HB   CYS  42          2HB       CYS  42   4.434  19.358  -3.757
  278    HG   CYS  42           HG       CYS  42   2.708  17.369  -3.834
  279    H    LYS  43           H        LYS  43   3.453  19.451  -7.713
  280    HA   LYS  43           HA       LYS  43   2.196  21.998  -7.699
  281   1HB   LYS  43          1HB       LYS  43   2.900  20.691  -9.650
  282   2HB   LYS  43          2HB       LYS  43   1.634  19.538  -9.284
  283   1HG   LYS  43          1HG       LYS  43  -0.036  21.259  -9.548
  284   2HG   LYS  43          2HG       LYS  43   1.228  22.436  -9.901
  285   1HD   LYS  43          1HD       LYS  43   0.888  19.919 -11.404
  286   2HD   LYS  43          2HD       LYS  43  -0.009  21.381 -11.873
  287   1HE   LYS  43          1HE       LYS  43   1.915  21.301 -13.312
  288   2HE   LYS  43          2HE       LYS  43   2.310  22.475 -12.070
  289   1HZ   LYS  43          1HZ       LYS  43   3.228  19.640 -12.017
  290   2HZ   LYS  43          2HZ       LYS  43   3.784  20.905 -11.026
  291   3HZ   LYS  43          3HZ       LYS  43   4.109  20.903 -12.650
  292    H    VAL  44           H        VAL  44   1.305  18.711  -6.766
  293    HA   VAL  44           HA       VAL  44  -1.140  19.771  -5.628
  294    HB   VAL  44           HB       VAL  44  -1.804  19.031  -7.875
  295   1HG1  VAL  44          1HG1      VAL  44  -1.747  16.692  -8.548
  296   2HG1  VAL  44          2HG1      VAL  44  -0.754  16.330  -7.137
  297   3HG1  VAL  44          3HG1      VAL  44  -0.148  17.418  -8.388
  298   1HG2  VAL  44          1HG2      VAL  44  -3.622  17.499  -7.258
  299   2HG2  VAL  44          2HG2      VAL  44  -3.440  18.814  -6.095
  300   3HG2  VAL  44          3HG2      VAL  44  -2.829  17.203  -5.712
  301    H    GLY  45           H        GLY  45  -1.488  18.998  -3.700
  302   1HA   GLY  45          1HA       GLY  45  -1.418  17.652  -1.854
  303   2HA   GLY  45          2HA       GLY  45  -0.978  16.307  -2.903
  304    H    ARG  46           H        ARG  46   0.721  19.463  -2.063
  305    HA   ARG  46           HA       ARG  46   3.158  18.072  -1.986
  306   1HB   ARG  46          1HB       ARG  46   2.886  20.402  -2.788
  307   2HB   ARG  46          2HB       ARG  46   2.420  20.858  -1.157
  308   1HG   ARG  46          1HG       ARG  46   4.578  20.389  -0.301
  309   2HG   ARG  46          2HG       ARG  46   5.083  19.638  -1.807
  310   1HD   ARG  46          1HD       ARG  46   5.993  21.870  -1.661
  311   2HD   ARG  46          2HD       ARG  46   4.819  21.769  -2.963
  312    HE   ARG  46           HE       ARG  46   4.109  22.846  -0.335
  313   1HH1  ARG  46          1HH1      ARG  46   4.260  23.193  -3.874
  314   2HH1  ARG  46          2HH1      ARG  46   3.578  24.739  -3.907
  315   1HH2  ARG  46          1HH2      ARG  46   3.101  25.007  -0.409
  316   2HH2  ARG  46          2HH2      ARG  46   2.914  25.793  -1.913
  317    H    ILE  47           H        ILE  47   3.888  17.032  -0.385
  318    HA   ILE  47           HA       ILE  47   2.621  17.008   2.163
  319    HB   ILE  47           HB       ILE  47   5.232  15.594   1.410
  320   1HG1  ILE  47          1HG1      ILE  47   2.363  14.589   1.409
  321   2HG1  ILE  47          2HG1      ILE  47   3.259  15.017  -0.031
  322   1HG2  ILE  47          1HG2      ILE  47   3.404  15.229   3.740
  323   2HG2  ILE  47          2HG2      ILE  47   5.057  15.827   3.738
  324   3HG2  ILE  47          3HG2      ILE  47   4.714  14.171   3.250
  325   1HD1  ILE  47          1HD1      ILE  47   3.186  12.620   0.343
  326   2HD1  ILE  47          2HD1      ILE  47   4.017  12.831   1.888
  327   3HD1  ILE  47          3HD1      ILE  47   4.831  13.244   0.376
  328    H    THR  48           H        THR  48   2.857  18.269   3.701
  329    HA   THR  48           HA       THR  48   4.464  20.474   3.827
  330    HB   THR  48           HB       THR  48   3.566  20.526   6.204
  331    HG1  THR  48           1HG      THR  48   3.035  18.453   6.796
  332   1HG2  THR  48          1HG2      THR  48   2.405  21.487   4.254
  333   2HG2  THR  48          2HG2      THR  48   1.277  20.744   5.426
  334   3HG2  THR  48          3HG2      THR  48   1.773  19.859   3.969
  335    H    THR  49           H        THR  49   4.730  17.469   5.576
  336    HA   THR  49           HA       THR  49   7.554  18.113   6.211
  337    HB   THR  49           HB       THR  49   5.783  17.108   8.429
  338    HG1  THR  49           1HG      THR  49   4.827  18.970   8.268
  339   1HG2  THR  49          1HG2      THR  49   8.188  16.976   8.787
  340   2HG2  THR  49          2HG2      THR  49   7.489  18.191   9.854
  341   3HG2  THR  49          3HG2      THR  49   8.370  18.688   8.411
  342    H    THR  50           H        THR  50   8.747  16.270   7.036
  343    HA   THR  50           HA       THR  50   8.405  13.854   5.731
  344    HB   THR  50           HB       THR  50  10.430  14.754   6.506
  345    HG1  THR  50           1HG      THR  50  10.675  12.629   6.230
  346   1HG2  THR  50          1HG2      THR  50   9.515  14.133   9.298
  347   2HG2  THR  50          2HG2      THR  50   9.788  15.720   8.592
  348   3HG2  THR  50          3HG2      THR  50  11.165  14.638   8.883
  349    H    GLU  51           H        GLU  51   7.598  14.812   9.040
  350    HA   GLU  51           HA       GLU  51   6.544  12.349   9.972
  351   1HB   GLU  51          1HB       GLU  51   5.246  13.710  11.596
  352   2HB   GLU  51          2HB       GLU  51   6.931  14.208  11.537
  353   1HG   GLU  51          1HG       GLU  51   6.383  16.132  10.237
  354   2HG   GLU  51          2HG       GLU  51   4.717  15.595  10.041
  355    H    ASP  52           H        ASP  52   5.022  14.828   7.959
  356    HA   ASP  52           HA       ASP  52   2.419  13.678   8.030
  357   1HB   ASP  52          1HB       ASP  52   3.876  15.647   6.323
  358   2HB   ASP  52          2HB       ASP  52   2.191  15.247   6.102
  359    H    PHE  53           H        PHE  53   5.230  13.608   6.001
  360    HA   PHE  53           HA       PHE  53   4.218  12.157   3.848
  361   1HB   PHE  53          1HB       PHE  53   6.431  13.277   3.748
  362   2HB   PHE  53          2HB       PHE  53   6.990  12.290   5.080
  363    HD1  PHE  53           1HD      PHE  53   6.344  12.423   1.522
  364    HD2  PHE  53           2HD      PHE  53   7.611   9.983   4.746
  365    HE1  PHE  53           1HE      PHE  53   7.248  10.795  -0.072
  366    HE2  PHE  53           2HE      PHE  53   8.501   8.344   3.185
  367    HZ   PHE  53           HZ       PHE  53   8.327   8.769   0.725
  368    H    LYS  54           H        LYS  54   5.815  11.125   6.793
  369    HA   LYS  54           HA       LYS  54   5.672   8.300   6.418
  370   1HB   LYS  54          1HB       LYS  54   5.893   9.972   8.905
  371   2HB   LYS  54          2HB       LYS  54   6.007   8.213   8.865
  372   1HG   LYS  54          1HG       LYS  54   7.958   8.341   7.434
  373   2HG   LYS  54          2HG       LYS  54   7.817  10.095   7.367
  374   1HD   LYS  54          1HD       LYS  54   9.547   9.362   8.912
  375   2HD   LYS  54          2HD       LYS  54   8.258  10.243   9.742
  376   1HE   LYS  54          1HE       LYS  54   7.310   8.132  10.521
  377   2HE   LYS  54          2HE       LYS  54   8.525   7.230   9.615
  378   1HZ   LYS  54          1HZ       LYS  54   9.105   9.103  11.840
  379   2HZ   LYS  54          2HZ       LYS  54  10.225   8.137  11.025
  380   3HZ   LYS  54          3HZ       LYS  54   9.044   7.429  11.982
  381    H    HIS  55           H        HIS  55   3.465  10.616   7.962
  382    HA   HIS  55           HA       HIS  55   1.628   8.712   9.032
  383   1HB   HIS  55          1HB       HIS  55   1.726  11.116   9.750
  384   2HB   HIS  55          2HB       HIS  55   1.329  11.593   8.127
  385    HD1  HIS  55           1HD      HIS  55  -0.300  10.529  11.311
  386    HD2  HIS  55           2HD      HIS  55  -1.397  11.176   7.354
  387    HE1  HIS  55           1HE      HIS  55  -2.790  10.689  11.323
  388    H    LEU  56           H        LEU  56   1.722  10.536   6.051
  389    HA   LEU  56           HA       LEU  56  -0.679   9.356   5.079
  390   1HB   LEU  56          1HB       LEU  56   0.940  11.437   4.262
  391   2HB   LEU  56          2HB       LEU  56   1.121  10.235   3.009
  392    HG   LEU  56           HG       LEU  56  -1.051  11.992   3.721
  393   1HD1  LEU  56          1HD1      LEU  56  -1.506  12.006   1.361
  394   2HD1  LEU  56          2HD1      LEU  56  -0.239  10.795   1.134
  395   3HD1  LEU  56          3HD1      LEU  56   0.156  12.374   1.793
  396   1HD2  LEU  56          1HD2      LEU  56  -2.878  10.536   2.866
  397   2HD2  LEU  56          2HD2      LEU  56  -2.250  10.003   4.364
  398   3HD2  LEU  56          3HD2      LEU  56  -1.758   9.177   2.871
  399    H    ALA  57           H        ALA  57   2.754   8.504   4.528
  400    HA   ALA  57           HA       ALA  57   2.156   6.500   2.689
  401   1HB   ALA  57          1HB       ALA  57   4.416   6.479   4.713
  402   2HB   ALA  57          2HB       ALA  57   4.484   7.287   3.151
  403   3HB   ALA  57          3HB       ALA  57   4.359   5.528   3.230
  404    H    ARG  58           H        ARG  58   2.133   6.498   6.104
  405    HA   ARG  58           HA       ARG  58   1.593   3.746   6.610
  406   1HB   ARG  58          1HB       ARG  58   0.778   6.227   8.128
  407   2HB   ARG  58          2HB       ARG  58   0.376   4.615   8.687
  408   1HG   ARG  58          1HG       ARG  58   3.151   5.683   8.253
  409   2HG   ARG  58          2HG       ARG  58   2.338   5.506   9.815
  410   1HD   ARG  58          1HD       ARG  58   2.033   3.126   9.296
  411   2HD   ARG  58          2HD       ARG  58   3.004   3.397   7.848
  412    HE   ARG  58           HE       ARG  58   4.474   4.293  10.016
  413   1HH1  ARG  58          1HH1      ARG  58   3.319   1.222   8.698
  414   2HH1  ARG  58          2HH1      ARG  58   4.526   0.273   9.431
  415   1HH2  ARG  58          1HH2      ARG  58   6.216   3.010  10.934
  416   2HH2  ARG  58          2HH2      ARG  58   6.256   1.332  10.680
  417    H    LYS  59           H        LYS  59  -0.549   6.411   6.433
  418    HA   LYS  59           HA       LYS  59  -3.015   5.184   6.658
  419   1HB   LYS  59          1HB       LYS  59  -2.217   7.655   5.148
  420   2HB   LYS  59          2HB       LYS  59  -3.883   7.190   5.439
  421   1HG   LYS  59          1HG       LYS  59  -2.051   7.405   7.775
  422   2HG   LYS  59          2HG       LYS  59  -2.595   8.893   7.012
  423   1HD   LYS  59          1HD       LYS  59  -4.456   6.724   7.984
  424   2HD   LYS  59          2HD       LYS  59  -4.001   8.143   8.939
  425   1HE   LYS  59          1HE       LYS  59  -4.853   9.589   7.137
  426   2HE   LYS  59          2HE       LYS  59  -5.375   8.162   6.254
  427   1HZ   LYS  59          1HZ       LYS  59  -6.877   7.660   8.124
  428   2HZ   LYS  59          2HZ       LYS  59  -7.141   9.130   7.336
  429   3HZ   LYS  59          3HZ       LYS  59  -6.456   9.159   8.834
  430    H    LEU  60           H        LEU  60  -1.275   6.000   3.647
  431    HA   LEU  60           HA       LEU  60  -3.285   5.119   2.106
  432   1HB   LEU  60          1HB       LEU  60  -0.419   5.544   1.443
  433   2HB   LEU  60          2HB       LEU  60  -1.662   5.351   0.194
  434    HG   LEU  60           HG       LEU  60  -1.905   7.297   2.381
  435   1HD1  LEU  60          1HD1      LEU  60  -0.575   7.743  -0.312
  436   2HD1  LEU  60          2HD1      LEU  60   0.115   7.992   1.291
  437   3HD1  LEU  60          3HD1      LEU  60  -1.176   9.040   0.707
  438   1HD2  LEU  60          1HD2      LEU  60  -3.442   8.421   0.794
  439   2HD2  LEU  60          2HD2      LEU  60  -3.932   6.798   1.268
  440   3HD2  LEU  60          3HD2      LEU  60  -3.197   7.070  -0.315
  441    H    THR  61           H        THR  61  -0.273   3.609   3.091
  442    HA   THR  61           HA       THR  61  -0.349   1.190   1.636
  443    HB   THR  61           HB       THR  61   0.606   1.551   4.492
  444    HG1  THR  61           1HG      THR  61   1.766   2.935   3.235
  445   1HG2  THR  61          1HG2      THR  61   0.327  -0.810   3.833
  446   2HG2  THR  61          2HG2      THR  61   2.027  -0.393   4.039
  447   3HG2  THR  61          3HG2      THR  61   1.348  -0.530   2.420
  448    H    HIS  62           H        HIS  62  -1.803   2.194   4.568
  449    HA   HIS  62           HA       HIS  62  -2.941  -0.344   5.152
  450   1HB   HIS  62          1HB       HIS  62  -2.338   1.332   6.873
  451   2HB   HIS  62          2HB       HIS  62  -3.580   2.388   6.227
  452    HD1  HIS  62           1HD      HIS  62  -3.358  -1.059   7.823
  453    HD2  HIS  62           2HD      HIS  62  -5.919   2.193   7.518
  454    HE1  HIS  62           1HE      HIS  62  -5.267  -1.588   9.320
  455    H    GLY  63           H        GLY  63  -4.176   2.539   3.470
  456   1HA   GLY  63          1HA       GLY  63  -6.843   1.647   3.500
  457   2HA   GLY  63          2HA       GLY  63  -6.217   2.904   2.469
  458    H    VAL  64           H        VAL  64  -4.255   1.243   1.102
  459    HA   VAL  64           HA       VAL  64  -5.993   0.033  -0.900
  460    HB   VAL  64           HB       VAL  64  -2.983  -0.252  -0.531
  461   1HG1  VAL  64          1HG1      VAL  64  -4.683  -0.919  -2.970
  462   2HG1  VAL  64          2HG1      VAL  64  -3.915  -2.092  -1.912
  463   3HG1  VAL  64          3HG1      VAL  64  -2.926  -1.030  -2.891
  464   1HG2  VAL  64          1HG2      VAL  64  -2.802   1.405  -2.340
  465   2HG2  VAL  64          2HG2      VAL  64  -3.624   2.060  -0.924
  466   3HG2  VAL  64          3HG2      VAL  64  -4.554   1.578  -2.343
  467    H    MET  65           H        MET  65  -4.200  -0.946   1.672
  468    HA   MET  65           HA       MET  65  -4.251  -3.772   1.355
  469   1HB   MET  65          1HB       MET  65  -2.642  -2.693   2.846
  470   2HB   MET  65          2HB       MET  65  -3.936  -2.091   3.843
  471   1HG   MET  65          1HG       MET  65  -4.477  -4.180   4.626
  472   2HG   MET  65          2HG       MET  65  -3.400  -4.996   3.512
  473   1HE   MET  65          1HE       MET  65  -1.783  -5.242   7.128
  474   2HE   MET  65          2HE       MET  65  -2.567  -6.143   5.798
  475   3HE   MET  65          3HE       MET  65  -3.495  -4.981   6.770
  476    H    ASN  66           H        ASN  66  -6.268  -1.497   3.245
  477    HA   ASN  66           HA       ASN  66  -8.184  -3.352   4.144
  478   1HB   ASN  66          1HB       ASN  66  -8.118  -0.401   3.685
  479   2HB   ASN  66          2HB       ASN  66  -9.577  -1.164   4.234
  480   1HD2  ASN  66          1HD2      ASN  66  -8.042   0.840   5.465
  481   2HD2  ASN  66          2HD2      ASN  66  -7.441   0.192   6.948
  482    H    LYS  67           H        LYS  67  -8.009  -1.426   1.186
  483    HA   LYS  67           HA       LYS  67 -10.593  -1.940   0.294
  484   1HB   LYS  67          1HB       LYS  67  -8.062  -1.436  -1.276
  485   2HB   LYS  67          2HB       LYS  67  -9.652  -1.527  -2.007
  486   1HG   LYS  67          1HG       LYS  67  -8.853   0.475   0.097
  487   2HG   LYS  67          2HG       LYS  67  -8.819   0.778  -1.636
  488   1HD   LYS  67          1HD       LYS  67 -11.247   0.361  -1.744
  489   2HD   LYS  67          2HD       LYS  67 -11.266   0.090   0.001
  490   1HE   LYS  67          1HE       LYS  67 -10.529   2.343   0.406
  491   2HE   LYS  67          2HE       LYS  67 -10.343   2.637  -1.318
  492   1HZ   LYS  67          1HZ       LYS  67 -12.925   2.105   0.079
  493   2HZ   LYS  67          2HZ       LYS  67 -12.740   2.393  -1.572
  494   3HZ   LYS  67          3HZ       LYS  67 -12.372   3.594  -0.471
  495    H    GLU  68           H        GLU  68  -7.560  -3.723  -0.378
  496    HA   GLU  68           HA       GLU  68  -9.178  -5.519  -1.773
  497   1HB   GLU  68          1HB       GLU  68  -7.109  -6.778  -2.183
  498   2HB   GLU  68          2HB       GLU  68  -7.193  -5.073  -2.655
  499   1HG   GLU  68          1HG       GLU  68  -5.829  -4.451  -0.775
  500   2HG   GLU  68          2HG       GLU  68  -5.569  -6.145  -0.354
  501    H    LEU  69           H        LEU  69  -7.676  -5.615   1.410
  502    HA   LEU  69           HA       LEU  69  -8.583  -8.163   1.867
  503   1HB   LEU  69          1HB       LEU  69  -8.137  -5.895   3.789
  504   2HB   LEU  69          2HB       LEU  69  -8.577  -7.507   4.316
  505    HG   LEU  69           HG       LEU  69  -6.094  -6.798   2.767
  506   1HD1  LEU  69          1HD1      LEU  69  -4.909  -7.286   4.832
  507   2HD1  LEU  69          2HD1      LEU  69  -6.447  -7.532   5.666
  508   3HD1  LEU  69          3HD1      LEU  69  -6.028  -5.939   5.025
  509   1HD2  LEU  69          1HD2      LEU  69  -5.440  -9.135   3.339
  510   2HD2  LEU  69          2HD2      LEU  69  -6.778  -9.020   2.219
  511   3HD2  LEU  69          3HD2      LEU  69  -7.084  -9.411   3.912
  512    H    LYS  70           H        LYS  70 -10.561  -5.277   1.633
  513    HA   LYS  70           HA       LYS  70 -12.742  -6.685   2.912
  514   1HB   LYS  70          1HB       LYS  70 -13.983  -4.685   2.720
  515   2HB   LYS  70          2HB       LYS  70 -12.368  -4.261   3.293
  516   1HG   LYS  70          1HG       LYS  70 -11.772  -3.584   1.068
  517   2HG   LYS  70          2HG       LYS  70 -13.383  -3.998   0.510
  518   1HD   LYS  70          1HD       LYS  70 -12.693  -1.903   2.541
  519   2HD   LYS  70          2HD       LYS  70 -13.088  -1.658   0.825
  520   1HE   LYS  70          1HE       LYS  70 -15.064  -1.098   2.002
  521   2HE   LYS  70          2HE       LYS  70 -15.340  -2.685   1.322
  522   1HZ   LYS  70          1HZ       LYS  70 -15.038  -3.677   3.507
  523   2HZ   LYS  70          2HZ       LYS  70 -16.135  -2.418   3.628
  524   3HZ   LYS  70          3HZ       LYS  70 -14.559  -2.197   4.155
  525    H    TYR  71           H        TYR  71 -11.560  -6.089  -0.316
  526    HA   TYR  71           HA       TYR  71 -14.086  -7.117  -1.538
  527   1HB   TYR  71          1HB       TYR  71 -11.523  -6.162  -2.825
  528   2HB   TYR  71          2HB       TYR  71 -12.995  -6.612  -3.671
  529    HD1  TYR  71           1HD      TYR  71 -11.958  -4.066  -4.359
  530    HD2  TYR  71           2HD      TYR  71 -14.311  -5.047  -0.951
  531    HE1  TYR  71           1HE      TYR  71 -12.712  -1.728  -4.176
  532    HE2  TYR  71           2HE      TYR  71 -15.037  -2.851  -0.737
  533    HH   TYR  71           HH       TYR  71 -14.566  -0.467  -3.217
  534    H    CYS  72           H        CYS  72 -10.991  -8.200  -0.724
  535    HA   CYS  72           HA       CYS  72 -11.215 -10.636  -2.360
  536   1HB   CYS  72          1HB       CYS  72  -8.983  -9.356  -0.842
  537   2HB   CYS  72          2HB       CYS  72  -8.744 -10.874  -1.643
  538    HG   CYS  72           HG       CYS  72  -7.600  -9.358  -3.460
  539    H    LYS  73           H        LYS  73 -10.460  -9.389   0.830
  540    HA   LYS  73           HA       LYS  73 -10.865 -10.029   2.907
  541   1HB   LYS  73          1HB       LYS  73 -12.556 -12.196   1.683
  542   2HB   LYS  73          2HB       LYS  73 -12.532 -11.763   3.389
  543   1HG   LYS  73          1HG       LYS  73 -13.359  -9.553   2.932
  544   2HG   LYS  73          2HG       LYS  73 -13.218  -9.817   1.198
  545   1HD   LYS  73          1HD       LYS  73 -15.480  -9.972   1.889
  546   2HD   LYS  73          2HD       LYS  73 -14.895 -11.537   1.322
  547   1HE   LYS  73          1HE       LYS  73 -14.559 -12.273   3.654
  548   2HE   LYS  73          2HE       LYS  73 -15.112 -10.704   4.227
  549   1HZ   LYS  73          1HZ       LYS  73 -17.298 -11.187   3.334
  550   2HZ   LYS  73          2HZ       LYS  73 -16.803 -12.439   4.364
  551   3HZ   LYS  73          3HZ       LYS  73 -16.740 -12.652   2.708
  552    H    ASN  74           H        ASN  74 -10.129 -12.690   0.844
  553    HA   ASN  74           HA       ASN  74  -8.579 -14.013   2.898
  554   1HB   ASN  74          1HB       ASN  74  -9.091 -14.667  -0.015
  555   2HB   ASN  74          2HB       ASN  74  -8.195 -15.693   1.100
  556   1HD2  ASN  74          1HD2      ASN  74 -10.806 -15.943  -0.411
  557   2HD2  ASN  74          2HD2      ASN  74 -11.930 -16.441   0.793
  558    HA   PRO  75           HA       PRO  75  -5.129 -11.451   1.542
  559   1HB   PRO  75          1HB       PRO  75  -3.349 -12.564   3.043
  560   2HB   PRO  75          2HB       PRO  75  -4.406 -11.210   3.505
  561   1HG   PRO  75          1HG       PRO  75  -4.516 -14.166   4.271
  562   2HG   PRO  75          2HG       PRO  75  -5.075 -12.806   5.245
  563   1HD   PRO  75          1HD       PRO  75  -6.692 -14.473   3.806
  564   2HD   PRO  75          2HD       PRO  75  -7.129 -12.811   4.250
  565    H    GLU  76           H        GLU  76  -5.592 -14.431   0.867
  566    HA   GLU  76           HA       GLU  76  -3.066 -15.397   0.150
  567   1HB   GLU  76          1HB       GLU  76  -5.098 -16.752   0.588
  568   2HB   GLU  76          2HB       GLU  76  -5.811 -16.121  -0.877
  569   1HG   GLU  76          1HG       GLU  76  -4.079 -17.277  -2.173
  570   2HG   GLU  76          2HG       GLU  76  -3.441 -17.955  -0.665
  571    H    ASP  77           H        ASP  77  -4.890 -12.990  -0.888
  572    HA   ASP  77           HA       ASP  77  -3.965 -12.875  -3.736
  573   1HB   ASP  77          1HB       ASP  77  -6.399 -12.936  -3.577
  574   2HB   ASP  77          2HB       ASP  77  -6.379 -11.622  -2.410
  575    H    LEU  78           H        LEU  78  -3.601 -11.605  -0.611
  576    HA   LEU  78           HA       LEU  78  -3.328  -8.874  -1.226
  577   1HB   LEU  78          1HB       LEU  78  -4.257  -9.790   0.866
  578   2HB   LEU  78          2HB       LEU  78  -2.686 -10.531   1.168
  579    HG   LEU  78           HG       LEU  78  -1.766  -8.314   1.026
  580   1HD1  LEU  78          1HD1      LEU  78  -3.584  -7.084   0.029
  581   2HD1  LEU  78          2HD1      LEU  78  -3.314  -6.410   1.638
  582   3HD1  LEU  78          3HD1      LEU  78  -4.660  -7.518   1.357
  583   1HD2  LEU  78          1HD2      LEU  78  -2.339  -7.730   3.381
  584   2HD2  LEU  78          2HD2      LEU  78  -1.845  -9.397   3.093
  585   3HD2  LEU  78          3HD2      LEU  78  -3.547  -9.017   3.330
  586    H    GLU  79           H        GLU  79  -1.685  -8.675  -2.533
  587    HA   GLU  79           HA       GLU  79   1.058  -9.280  -1.705
  588   1HB   GLU  79          1HB       GLU  79   0.080 -11.087  -3.155
  589   2HB   GLU  79          2HB       GLU  79  -0.311  -9.788  -4.279
  590   1HG   GLU  79          1HG       GLU  79   1.550 -10.986  -4.931
  591   2HG   GLU  79          2HG       GLU  79   1.942  -9.301  -4.633
  592    H    CYS  80           H        CYS  80   2.386  -7.712  -2.472
  593    HA   CYS  80           HA       CYS  80   1.059  -5.376  -3.580
  594   1HB   CYS  80          1HB       CYS  80   2.733  -4.907  -1.821
  595   2HB   CYS  80          2HB       CYS  80   3.991  -5.712  -2.689
  596    HG   CYS  80           HG       CYS  80   4.765  -3.676  -4.015
  597    H    ASN  81           H        ASN  81   0.484  -6.613  -5.334
  598    HA   ASN  81           HA       ASN  81   2.659  -7.336  -6.991
  599   1HB   ASN  81          1HB       ASN  81   1.091  -8.671  -8.389
  600   2HB   ASN  81          2HB       ASN  81   0.900  -9.055  -6.683
  601   1HD2  ASN  81          1HD2      ASN  81  -1.017  -8.628  -5.806
  602   2HD2  ASN  81          2HD2      ASN  81  -2.412  -8.061  -6.617
  603    H    GLU  82           H        GLU  82   1.393  -7.212  -9.524
  604    HA   GLU  82           HA       GLU  82   1.924  -4.701 -10.384
  605   1HB   GLU  82          1HB       GLU  82   0.233  -6.877 -11.284
  606   2HB   GLU  82          2HB       GLU  82   0.696  -5.581 -12.420
  607   1HG   GLU  82          1HG       GLU  82   3.045  -6.280 -12.090
  608   2HG   GLU  82          2HG       GLU  82   2.496  -7.551 -10.993
  609    H    ASN  83           H        ASN  83  -1.129  -6.428 -10.095
  610    HA   ASN  83           HA       ASN  83  -3.100  -4.601 -10.740
  611   1HB   ASN  83          1HB       ASN  83  -3.546  -6.994 -10.307
  612   2HB   ASN  83          2HB       ASN  83  -3.075  -6.794  -8.626
  613   1HD2  ASN  83          1HD2      ASN  83  -5.069  -7.499  -7.847
  614   2HD2  ASN  83          2HD2      ASN  83  -6.498  -6.541  -7.994
  615    H    VAL  84           H        VAL  84  -1.634  -5.422  -7.607
  616    HA   VAL  84           HA       VAL  84  -3.181  -3.569  -6.273
  617    HB   VAL  84           HB       VAL  84  -0.647  -4.944  -5.444
  618   1HG1  VAL  84          1HG1      VAL  84  -0.759  -2.996  -4.013
  619   2HG1  VAL  84          2HG1      VAL  84  -1.438  -4.379  -3.127
  620   3HG1  VAL  84          3HG1      VAL  84  -2.506  -3.186  -3.846
  621   1HG2  VAL  84          1HG2      VAL  84  -2.147  -6.243  -4.146
  622   2HG2  VAL  84          2HG2      VAL  84  -2.565  -6.301  -5.875
  623   3HG2  VAL  84          3HG2      VAL  84  -3.505  -5.298  -4.746
  624    H    LYS  85           H        LYS  85   0.132  -3.418  -7.388
  625    HA   LYS  85           HA       LYS  85   0.862  -0.887  -6.498
  626   1HB   LYS  85          1HB       LYS  85   1.631  -2.274  -9.050
  627   2HB   LYS  85          2HB       LYS  85   2.392  -0.795  -8.466
  628   1HG   LYS  85          1HG       LYS  85   3.132  -1.890  -6.501
  629   2HG   LYS  85          2HG       LYS  85   2.252  -3.353  -6.934
  630   1HD   LYS  85          1HD       LYS  85   3.688  -3.430  -9.005
  631   2HD   LYS  85          2HD       LYS  85   4.682  -2.173  -8.238
  632   1HE   LYS  85          1HE       LYS  85   4.860  -3.554  -6.265
  633   2HE   LYS  85          2HE       LYS  85   3.905  -4.778  -7.099
  634   1HZ   LYS  85          1HZ       LYS  85   6.604  -3.845  -7.969
  635   2HZ   LYS  85          2HZ       LYS  85   5.679  -5.038  -8.718
  636   3HZ   LYS  85          3HZ       LYS  85   6.285  -5.289  -7.164
  637    H    HIS  86           H        HIS  86  -0.644  -1.830  -9.415
  638    HA   HIS  86           HA       HIS  86  -0.877   0.571 -10.778
  639   1HB   HIS  86          1HB       HIS  86  -1.471  -1.508 -11.857
  640   2HB   HIS  86          2HB       HIS  86  -2.793  -1.778 -10.737
  641    HD1  HIS  86           1HD      HIS  86  -4.804  -1.731 -12.214
  642    HD2  HIS  86           2HD      HIS  86  -2.220   1.418 -13.012
  643    HE1  HIS  86           1HE      HIS  86  -5.982  -0.324 -13.902
  644    H    LYS  87           H        LYS  87  -3.180  -0.962  -8.641
  645    HA   LYS  87           HA       LYS  87  -5.168   1.116  -8.461
  646   1HB   LYS  87          1HB       LYS  87  -4.407  -1.010  -6.484
  647   2HB   LYS  87          2HB       LYS  87  -5.828   0.009  -6.389
  648   1HG   LYS  87          1HG       LYS  87  -6.948  -1.171  -7.954
  649   2HG   LYS  87          2HG       LYS  87  -5.473  -1.640  -8.816
  650   1HD   LYS  87          1HD       LYS  87  -6.447  -3.546  -7.698
  651   2HD   LYS  87          2HD       LYS  87  -4.864  -3.060  -7.058
  652   1HE   LYS  87          1HE       LYS  87  -5.992  -1.948  -5.151
  653   2HE   LYS  87          2HE       LYS  87  -7.548  -2.488  -5.772
  654   1HZ   LYS  87          1HZ       LYS  87  -6.597  -4.838  -5.494
  655   2HZ   LYS  87          2HZ       LYS  87  -7.036  -3.975  -4.144
  656   3HZ   LYS  87          3HZ       LYS  87  -5.429  -4.155  -4.453
  657    H    THR  88           H        THR  88  -2.312   0.554  -6.796
  658    HA   THR  88           HA       THR  88  -2.947   2.251  -4.637
  659    HB   THR  88           HB       THR  88  -0.509   0.904  -5.620
  660    HG1  THR  88           1HG      THR  88  -1.840  -0.523  -4.744
  661   1HG2  THR  88          1HG2      THR  88  -0.881   2.560  -3.132
  662   2HG2  THR  88          2HG2      THR  88   0.103   2.914  -4.569
  663   3HG2  THR  88          3HG2      THR  88   0.547   1.557  -3.519
  664    H    LYS  89           H        LYS  89  -0.486   2.527  -7.123
  665    HA   LYS  89           HA       LYS  89   0.060   5.064  -6.343
  666   1HB   LYS  89          1HB       LYS  89   1.151   5.259  -8.773
  667   2HB   LYS  89          2HB       LYS  89   1.831   4.318  -7.454
  668   1HG   LYS  89          1HG       LYS  89   1.940   2.950  -9.340
  669   2HG   LYS  89          2HG       LYS  89   0.597   2.342  -8.374
  670   1HD   LYS  89          1HD       LYS  89  -0.261   2.275 -10.351
  671   2HD   LYS  89          2HD       LYS  89  -0.738   3.875  -9.816
  672   1HE   LYS  89          1HE       LYS  89   1.108   4.956 -11.010
  673   2HE   LYS  89          2HE       LYS  89   1.753   3.395 -11.493
  674   1HZ   LYS  89          1HZ       LYS  89  -0.762   4.645 -12.437
  675   2HZ   LYS  89          2HZ       LYS  89  -0.251   3.102 -12.900
  676   3HZ   LYS  89          3HZ       LYS  89   0.656   4.461 -13.306
  677    H    GLU  90           H        GLU  90  -2.189   3.916  -8.773
  678    HA   GLU  90           HA       GLU  90  -2.956   6.531  -9.675
  679   1HB   GLU  90          1HB       GLU  90  -4.481   3.956  -9.751
  680   2HB   GLU  90          2HB       GLU  90  -5.089   5.442 -10.464
  681   1HG   GLU  90          1HG       GLU  90  -2.630   3.906 -11.261
  682   2HG   GLU  90          2HG       GLU  90  -4.095   4.165 -12.209
  683    H    TYR  91           H        TYR  91  -3.932   4.609  -6.936
  684    HA   TYR  91           HA       TYR  91  -6.277   6.122  -6.332
  685   1HB   TYR  91          1HB       TYR  91  -6.343   4.011  -5.313
  686   2HB   TYR  91          2HB       TYR  91  -4.646   4.062  -4.879
  687    HD1  TYR  91           1HD      TYR  91  -7.902   5.716  -4.039
  688    HD2  TYR  91           2HD      TYR  91  -4.055   4.483  -2.719
  689    HE1  TYR  91           1HE      TYR  91  -8.490   6.351  -1.729
  690    HE2  TYR  91           2HE      TYR  91  -4.579   5.098  -0.461
  691    HH   TYR  91           HH       TYR  91  -6.133   6.524   0.780
  692    H    ILE  92           H        ILE  92  -2.961   5.937  -5.204
  693    HA   ILE  92           HA       ILE  92  -2.849   8.019  -3.386
  694    HB   ILE  92           HB       ILE  92  -0.798   7.299  -5.481
  695   1HG1  ILE  92          1HG1      ILE  92  -1.691   5.627  -3.653
  696   2HG1  ILE  92          2HG1      ILE  92   0.038   5.615  -4.075
  697   1HG2  ILE  92          1HG2      ILE  92   0.874   8.391  -4.031
  698   2HG2  ILE  92          2HG2      ILE  92  -0.449   8.874  -2.950
  699   3HG2  ILE  92          3HG2      ILE  92  -0.403   9.496  -4.590
  700   1HD1  ILE  92          1HD1      ILE  92  -0.332   5.421  -1.741
  701   2HD1  ILE  92          2HD1      ILE  92  -1.424   6.812  -1.783
  702   3HD1  ILE  92          3HD1      ILE  92   0.323   7.029  -2.087
  703    H    LYS  93           H        LYS  93  -2.259   8.306  -6.870
  704    HA   LYS  93           HA       LYS  93  -1.880  11.029  -6.956
  705   1HB   LYS  93          1HB       LYS  93  -3.320   9.284  -8.946
  706   2HB   LYS  93          2HB       LYS  93  -2.840  10.941  -9.267
  707   1HG   LYS  93          1HG       LYS  93  -0.525  10.359  -9.058
  708   2HG   LYS  93          2HG       LYS  93  -0.948   8.714  -8.570
  709   1HD   LYS  93          1HD       LYS  93  -2.017   8.344 -10.728
  710   2HD   LYS  93          2HD       LYS  93  -1.603   9.986 -11.218
  711   1HE   LYS  93          1HE       LYS  93   0.742   9.480 -11.080
  712   2HE   LYS  93          2HE       LYS  93   0.394   7.875 -10.439
  713   1HZ   LYS  93          1HZ       LYS  93  -0.407   8.844 -13.122
  714   2HZ   LYS  93          2HZ       LYS  93  -0.691   7.310 -12.486
  715   3HZ   LYS  93          3HZ       LYS  93   0.895   7.825 -12.806
  716    H    LYS  94           H        LYS  94  -4.891   9.227  -7.245
  717    HA   LYS  94           HA       LYS  94  -6.448  11.549  -7.688
  718   1HB   LYS  94          1HB       LYS  94  -7.291   9.352  -8.412
  719   2HB   LYS  94          2HB       LYS  94  -7.319   8.795  -6.744
  720   1HG   LYS  94          1HG       LYS  94  -8.973  10.668  -6.300
  721   2HG   LYS  94          2HG       LYS  94  -9.100  10.827  -8.048
  722   1HD   LYS  94          1HD       LYS  94  -9.830   8.506  -8.215
  723   2HD   LYS  94          2HD       LYS  94  -9.658   8.317  -6.466
  724   1HE   LYS  94          1HE       LYS  94 -11.295  10.181  -6.181
  725   2HE   LYS  94          2HE       LYS  94 -11.554  10.137  -7.925
  726   1HZ   LYS  94          1HZ       LYS  94 -12.064   7.905  -6.041
  727   2HZ   LYS  94          2HZ       LYS  94 -12.337   7.840  -7.692
  728   3HZ   LYS  94          3HZ       LYS  94 -13.238   8.885  -6.718
  729    H    TYR  95           H        TYR  95  -5.597   9.661  -4.895
  730    HA   TYR  95           HA       TYR  95  -7.270  10.870  -3.053
  731   1HB   TYR  95          1HB       TYR  95  -6.226   8.811  -2.641
  732   2HB   TYR  95          2HB       TYR  95  -4.637   9.535  -2.943
  733    HD1  TYR  95           1HD      TYR  95  -3.447  10.431  -1.147
  734    HD2  TYR  95           2HD      TYR  95  -7.602   9.682  -0.677
  735    HE1  TYR  95           1HE      TYR  95  -3.292  11.064   1.149
  736    HE2  TYR  95           2HE      TYR  95  -7.452  10.296   1.676
  737    HH   TYR  95           HH       TYR  95  -5.982  10.654   3.379
  738    H    MET  96           H        MET  96  -3.919  11.591  -3.841
  739    HA   MET  96           HA       MET  96  -3.799  13.717  -2.028
  740   1HB   MET  96          1HB       MET  96  -2.121  13.302  -4.440
  741   2HB   MET  96          2HB       MET  96  -1.731  14.344  -3.070
  742   1HG   MET  96          1HG       MET  96  -2.171  12.036  -1.749
  743   2HG   MET  96          2HG       MET  96  -1.657  11.395  -3.317
  744   1HE   MET  96          1HE       MET  96  -0.391  14.665  -1.786
  745   2HE   MET  96          2HE       MET  96   0.831  14.084  -0.630
  746   3HE   MET  96          3HE       MET  96  -0.889  13.673  -0.415
  747    H    GLN  97           H        GLN  97  -5.093  13.526  -5.081
  748    HA   GLN  97           HA       GLN  97  -4.991  16.294  -5.799
  749   1HB   GLN  97          1HB       GLN  97  -7.253  14.474  -6.611
  750   2HB   GLN  97          2HB       GLN  97  -6.745  15.948  -7.409
  751   1HG   GLN  97          1HG       GLN  97  -5.374  13.294  -7.322
  752   2HG   GLN  97          2HG       GLN  97  -5.990  14.142  -8.729
  753   1HE2  GLN  97          1HE2      GLN  97  -3.475  13.715  -6.520
  754   2HE2  GLN  97          2HE2      GLN  97  -2.273  14.712  -7.207
  755    H    LYS  98           H        LYS  98  -6.851  14.692  -3.439
  756    HA   LYS  98           HA       LYS  98  -8.970  16.626  -3.395
  757   1HB   LYS  98          1HB       LYS  98  -9.904  15.403  -1.580
  758   2HB   LYS  98          2HB       LYS  98  -9.297  14.288  -2.770
  759   1HG   LYS  98          1HG       LYS  98  -8.513  13.231  -0.918
  760   2HG   LYS  98          2HG       LYS  98  -7.216  14.265  -1.308
  761   1HD   LYS  98          1HD       LYS  98  -7.710  14.305   1.128
  762   2HD   LYS  98          2HD       LYS  98  -7.677  15.878   0.349
  763   1HE   LYS  98          1HE       LYS  98 -10.280  14.433   0.733
  764   2HE   LYS  98          2HE       LYS  98  -9.512  15.299   2.058
  765   1HZ   LYS  98          1HZ       LYS  98 -10.326  16.599  -0.513
  766   2HZ   LYS  98          2HZ       LYS  98  -9.613  17.328   0.818
  767   3HZ   LYS  98          3HZ       LYS  98 -11.135  16.667   0.960
  768    H    PHE  99           H        PHE  99  -5.891  16.383  -1.874
  769    HA   PHE  99           HA       PHE  99  -6.528  18.143   0.304
  770   1HB   PHE  99          1HB       PHE  99  -3.831  17.341  -0.803
  771   2HB   PHE  99          2HB       PHE  99  -4.054  18.340   0.622
  772    HD1  PHE  99           1HD      PHE  99  -3.371  15.127  -0.459
  773    HD2  PHE  99           2HD      PHE  99  -5.731  17.208   2.456
  774    HE1  PHE  99           1HE      PHE  99  -3.434  13.096   0.970
  775    HE2  PHE  99           2HE      PHE  99  -5.814  15.123   3.822
  776    HZ   PHE  99           HZ       PHE  99  -4.682  13.114   3.041
  777    H    GLY 100           H        GLY 100  -5.222  18.554  -2.914
  778   1HA   GLY 100          1HA       GLY 100  -5.706  20.512  -4.117
  779   2HA   GLY 100          2HA       GLY 100  -5.586  21.426  -2.613
  780    H    ALA 101           H        ALA 101  -3.883  22.559  -2.533
  781    HA   ALA 101           HA       ALA 101  -1.577  22.011  -4.207
  782   1HB   ALA 101          1HB       ALA 101  -2.395  24.301  -3.863
  783   2HB   ALA 101          2HB       ALA 101  -0.723  24.111  -3.318
  784   3HB   ALA 101          3HB       ALA 101  -2.043  24.152  -2.143
  785    H    VAL 102           H        VAL 102  -2.294  22.009  -0.711
  786    HA   VAL 102           HA       VAL 102   0.167  20.552  -0.394
  787    HB   VAL 102           HB       VAL 102  -0.129  21.462   2.018
  788   1HG1  VAL 102          1HG1      VAL 102   1.861  21.781   0.710
  789   2HG1  VAL 102          2HG1      VAL 102   1.431  23.309   1.484
  790   3HG1  VAL 102          3HG1      VAL 102   1.090  23.062  -0.241
  791   1HG2  VAL 102          1HG2      VAL 102  -1.359  23.664   0.388
  792   2HG2  VAL 102          2HG2      VAL 102  -0.808  23.842   2.054
  793   3HG2  VAL 102          3HG2      VAL 102  -2.127  22.736   1.676
  794    H    TYR 103           H        TYR 103   0.235  19.080   1.302
  795    HA   TYR 103           HA       TYR 103  -2.152  17.586   1.421
  796   1HB   TYR 103          1HB       TYR 103  -0.272  16.277   0.966
  797   2HB   TYR 103          2HB       TYR 103   0.722  17.180   2.096
  798    HD1  TYR 103           1HD      TYR 103  -2.520  15.512   2.694
  799    HD2  TYR 103           2HD      TYR 103   1.610  15.545   3.427
  800    HE1  TYR 103           1HE      TYR 103  -2.832  13.771   4.339
  801    HE2  TYR 103           2HE      TYR 103   1.321  13.737   5.115
  802    HH   TYR 103           HH       TYR 103  -1.567  12.069   5.445
  803    H    LYS 104           H        LYS 104  -3.566  17.999   2.867
  804    HA   LYS 104           HA       LYS 104  -2.742  18.669   5.561
  805   1HB   LYS 104          1HB       LYS 104  -4.857  20.062   5.639
  806   2HB   LYS 104          2HB       LYS 104  -3.503  20.630   4.647
  807   1HG   LYS 104          1HG       LYS 104  -4.614  19.820   2.660
  808   2HG   LYS 104          2HG       LYS 104  -5.972  19.292   3.647
  809   1HD   LYS 104          1HD       LYS 104  -6.649  21.386   2.803
  810   2HD   LYS 104          2HD       LYS 104  -6.092  21.678   4.453
  811   1HE   LYS 104          1HE       LYS 104  -4.346  22.127   2.034
  812   2HE   LYS 104          2HE       LYS 104  -5.370  23.380   2.713
  813   1HZ   LYS 104          1HZ       LYS 104  -4.107  23.106   4.827
  814   2HZ   LYS 104          2HZ       LYS 104  -3.195  23.660   3.555
  815   3HZ   LYS 104          3HZ       LYS 104  -3.027  22.076   4.036
  816    HA   PRO 105           HA       PRO 105  -4.882  14.622   5.554
  817   1HB   PRO 105          1HB       PRO 105  -3.978  13.922   8.063
  818   2HB   PRO 105          2HB       PRO 105  -3.103  13.611   6.562
  819   1HG   PRO 105          1HG       PRO 105  -2.757  15.793   8.545
  820   2HG   PRO 105          2HG       PRO 105  -1.510  14.909   7.627
  821   1HD   PRO 105          1HD       PRO 105  -2.312  17.420   7.038
  822   2HD   PRO 105          2HD       PRO 105  -1.799  16.332   5.743
  823    H    LYS 106           H        LYS 106  -5.065  16.994   7.981
  824    HA   LYS 106           HA       LYS 106  -7.230  16.264   9.457
  825   1HB   LYS 106          1HB       LYS 106  -6.704  18.999   8.339
  826   2HB   LYS 106          2HB       LYS 106  -7.669  18.652   9.773
  827   1HG   LYS 106          1HG       LYS 106  -5.651  17.784  10.890
  828   2HG   LYS 106          2HG       LYS 106  -4.714  18.131   9.441
  829   1HD   LYS 106          1HD       LYS 106  -4.393  19.879  11.078
  830   2HD   LYS 106          2HD       LYS 106  -5.263  20.513   9.683
  831   1HE   LYS 106          1HE       LYS 106  -7.375  20.295  10.922
  832   2HE   LYS 106          2HE       LYS 106  -6.486  19.665  12.307
  833   1HZ   LYS 106          1HZ       LYS 106  -5.290  21.784  12.397
  834   2HZ   LYS 106          2HZ       LYS 106  -6.953  21.958  12.585
  835   3HZ   LYS 106          3HZ       LYS 106  -6.245  22.373  11.128
  836    H    GLU 107           H        GLU 107  -7.325  17.022   6.139
  837    HA   GLU 107           HA       GLU 107 -10.256  16.804   6.289
  838   1HB   GLU 107          1HB       GLU 107 -10.411  17.871   4.162
  839   2HB   GLU 107          2HB       GLU 107  -9.301  18.733   5.246
  840   1HG   GLU 107          1HG       GLU 107  -7.438  17.968   4.132
  841   2HG   GLU 107          2HG       GLU 107  -8.407  16.864   3.148
  842    H    ASP 108           H        ASP 108  -7.984  14.711   6.125
  843    HA   ASP 108           HA       ASP 108  -8.338  13.300   3.736
  844   1HB   ASP 108          1HB       ASP 108  -6.408  12.595   4.651
  845   2HB   ASP 108          2HB       ASP 108  -6.963  12.704   6.298
  846    H    THR 109           H        THR 109  -9.120  11.211   3.492
  847    HA   THR 109           HA       THR 109 -11.853  11.053   3.621
  848    HB   THR 109           HB       THR 109 -11.464   8.804   2.621
  849    HG1  THR 109           1HG      THR 109  -8.806   9.410   3.533
  850   1HG2  THR 109          1HG2      THR 109 -11.515  10.847   1.299
  851   2HG2  THR 109          2HG2      THR 109 -10.250   9.766   0.667
  852   3HG2  THR 109          3HG2      THR 109  -9.832  11.131   1.726
  Start of MODEL   13
    1    H    THR  10           H        THR  10  -1.656 -23.358   4.592
    2    HA   THR  10           HA       THR  10  -4.122 -22.294   5.664
    3    HB   THR  10           HB       THR  10  -2.511 -21.862   7.707
    4    HG1  THR  10           1HG      THR  10  -1.744 -24.450   6.824
    5   1HG2  THR  10          1HG2      THR  10  -4.697 -22.975   7.787
    6   2HG2  THR  10          2HG2      THR  10  -3.521 -23.842   8.763
    7   3HG2  THR  10          3HG2      THR  10  -3.969 -24.461   7.173
    8    H    SER  11           H        SER  11  -4.252 -20.645   4.435
    9    HA   SER  11           HA       SER  11  -2.198 -18.679   3.938
   10   1HB   SER  11          1HB       SER  11  -5.125 -18.573   3.736
   11   2HB   SER  11          2HB       SER  11  -3.950 -17.581   2.834
   12    HG   SER  11           HG       SER  11  -3.231 -19.462   1.805
   13    H    SER  12           H        SER  12  -4.313 -19.359   6.433
   14    HA   SER  12           HA       SER  12  -4.738 -16.861   7.479
   15   1HB   SER  12          1HB       SER  12  -4.847 -18.227   9.613
   16   2HB   SER  12          2HB       SER  12  -5.837 -18.774   8.238
   17    HG   SER  12           HG       SER  12  -4.424 -20.341   9.483
   18    H    GLU  13           H        GLU  13  -2.004 -19.220   8.159
   19    HA   GLU  13           HA       GLU  13  -0.573 -17.220   9.476
   20   1HB   GLU  13          1HB       GLU  13   1.111 -19.044   9.647
   21   2HB   GLU  13          2HB       GLU  13  -0.460 -19.399  10.355
   22   1HG   GLU  13          1HG       GLU  13  -1.058 -20.741   8.463
   23   2HG   GLU  13          2HG       GLU  13   0.408 -20.301   7.625
   24    H    LEU  14           H        LEU  14  -0.601 -18.655   6.275
   25    HA   LEU  14           HA       LEU  14   1.975 -17.978   5.373
   26   1HB   LEU  14          1HB       LEU  14  -0.083 -19.321   4.325
   27   2HB   LEU  14          2HB       LEU  14  -0.368 -17.783   3.543
   28    HG   LEU  14           HG       LEU  14   0.828 -19.274   2.058
   29   1HD1  LEU  14          1HD1      LEU  14   2.628 -17.066   3.005
   30   2HD1  LEU  14          2HD1      LEU  14   1.371 -16.957   1.767
   31   3HD1  LEU  14          3HD1      LEU  14   2.798 -17.951   1.491
   32   1HD2  LEU  14          1HD2      LEU  14   1.887 -20.708   3.692
   33   2HD2  LEU  14          2HD2      LEU  14   2.973 -19.403   4.174
   34   3HD2  LEU  14          3HD2      LEU  14   3.077 -20.085   2.553
   35    H    ALA  15           H        ALA  15  -0.903 -16.338   5.724
   36    HA   ALA  15           HA       ALA  15  -0.035 -14.033   4.231
   37   1HB   ALA  15          1HB       ALA  15  -2.682 -14.359   5.588
   38   2HB   ALA  15          2HB       ALA  15  -2.345 -14.585   3.865
   39   3HB   ALA  15          3HB       ALA  15  -2.184 -12.994   4.601
   40    H    LYS  16           H        LYS  16   0.086 -15.067   7.410
   41    HA   LYS  16           HA       LYS  16   0.091 -12.561   8.648
   42   1HB   LYS  16          1HB       LYS  16   1.438 -15.152   9.356
   43   2HB   LYS  16          2HB       LYS  16   1.671 -13.719  10.346
   44   1HG   LYS  16          1HG       LYS  16  -0.736 -13.616  10.759
   45   2HG   LYS  16          2HG       LYS  16  -0.968 -15.042   9.750
   46   1HD   LYS  16          1HD       LYS  16   0.258 -16.414  11.272
   47   2HD   LYS  16          2HD       LYS  16   0.810 -15.007  12.175
   48   1HE   LYS  16          1HE       LYS  16  -2.071 -15.869  11.944
   49   2HE   LYS  16          2HE       LYS  16  -1.018 -16.258  13.303
   50   1HZ   LYS  16          1HZ       LYS  16  -0.748 -13.862  13.692
   51   2HZ   LYS  16          2HZ       LYS  16  -2.331 -14.339  13.837
   52   3HZ   LYS  16          3HZ       LYS  16  -1.833 -13.520  12.452
   53    H    LYS  17           H        LYS  17   2.451 -14.443   6.938
   54    HA   LYS  17           HA       LYS  17   4.463 -12.422   7.202
   55   1HB   LYS  17          1HB       LYS  17   4.391 -14.983   5.608
   56   2HB   LYS  17          2HB       LYS  17   5.658 -13.799   5.375
   57   1HG   LYS  17          1HG       LYS  17   6.553 -15.403   6.837
   58   2HG   LYS  17          2HG       LYS  17   6.162 -14.012   7.838
   59   1HD   LYS  17          1HD       LYS  17   5.496 -15.936   9.051
   60   2HD   LYS  17          2HD       LYS  17   4.014 -15.213   8.423
   61   1HE   LYS  17          1HE       LYS  17   3.954 -16.846   6.617
   62   2HE   LYS  17          2HE       LYS  17   5.486 -17.530   7.166
   63   1HZ   LYS  17          1HZ       LYS  17   3.623 -18.857   7.924
   64   2HZ   LYS  17          2HZ       LYS  17   2.948 -17.502   8.684
   65   3HZ   LYS  17          3HZ       LYS  17   4.377 -18.138   9.252
   66    H    SER  18           H        SER  18   2.142 -13.454   4.692
   67    HA   SER  18           HA       SER  18   3.268 -11.774   2.798
   68   1HB   SER  18          1HB       SER  18   0.425 -12.803   2.825
   69   2HB   SER  18          2HB       SER  18   1.269 -12.120   1.450
   70    HG   SER  18           HG       SER  18   1.318 -14.626   2.313
   71    H    LYS  19           H        LYS  19   0.828 -11.057   5.268
   72    HA   LYS  19           HA       LYS  19   0.098  -8.555   4.059
   73   1HB   LYS  19          1HB       LYS  19  -0.136  -9.239   7.002
   74   2HB   LYS  19          2HB       LYS  19  -0.956  -7.939   6.161
   75   1HG   LYS  19          1HG       LYS  19  -2.032  -9.858   4.770
   76   2HG   LYS  19          2HG       LYS  19  -1.494 -10.877   6.090
   77   1HD   LYS  19          1HD       LYS  19  -3.359  -8.510   6.285
   78   2HD   LYS  19          2HD       LYS  19  -3.803 -10.206   6.426
   79   1HE   LYS  19          1HE       LYS  19  -1.987  -8.682   8.254
   80   2HE   LYS  19          2HE       LYS  19  -3.676  -9.074   8.576
   81   1HZ   LYS  19          1HZ       LYS  19  -3.114 -11.427   8.611
   82   2HZ   LYS  19          2HZ       LYS  19  -2.099 -10.593   9.675
   83   3HZ   LYS  19          3HZ       LYS  19  -1.511 -11.091   8.191
   84    H    GLU  20           H        GLU  20   2.579  -9.491   6.372
   85    HA   GLU  20           HA       GLU  20   3.253  -6.743   6.684
   86   1HB   GLU  20          1HB       GLU  20   5.233  -7.509   7.952
   87   2HB   GLU  20          2HB       GLU  20   3.736  -8.182   8.555
   88   1HG   GLU  20          1HG       GLU  20   4.229 -10.300   7.553
   89   2HG   GLU  20          2HG       GLU  20   5.665  -9.634   6.772
   90    H    VAL  21           H        VAL  21   4.469  -9.355   4.638
   91    HA   VAL  21           HA       VAL  21   6.585  -7.794   3.544
   92    HB   VAL  21           HB       VAL  21   5.115 -10.186   2.362
   93   1HG1  VAL  21          1HG1      VAL  21   7.054 -10.405   0.854
   94   2HG1  VAL  21          2HG1      VAL  21   7.734  -8.920   1.518
   95   3HG1  VAL  21          3HG1      VAL  21   6.224  -8.869   0.610
   96   1HG2  VAL  21          1HG2      VAL  21   6.275 -10.716   4.437
   97   2HG2  VAL  21          2HG2      VAL  21   7.763 -10.020   3.799
   98   3HG2  VAL  21          3HG2      VAL  21   7.079 -11.470   3.064
   99    H    PHE  22           H        PHE  22   3.225  -8.322   2.514
  100    HA   PHE  22           HA       PHE  22   3.360  -6.738   0.180
  101   1HB   PHE  22          1HB       PHE  22   1.421  -8.014   0.224
  102   2HB   PHE  22          2HB       PHE  22   1.206  -7.798   1.957
  103    HD1  PHE  22           1HD      PHE  22   1.057  -5.845  -1.234
  104    HD2  PHE  22           2HD      PHE  22  -0.456  -6.363   2.700
  105    HE1  PHE  22           1HE      PHE  22  -0.554  -4.020  -1.600
  106    HE2  PHE  22           2HE      PHE  22  -2.079  -4.571   2.312
  107    HZ   PHE  22           HZ       PHE  22  -2.133  -3.393   0.164
  108    H    ARG  23           H        ARG  23   2.343  -6.020   3.460
  109    HA   ARG  23           HA       ARG  23   1.827  -3.320   2.859
  110   1HB   ARG  23          1HB       ARG  23   1.530  -2.869   5.167
  111   2HB   ARG  23          2HB       ARG  23   1.037  -4.538   4.956
  112   1HG   ARG  23          1HG       ARG  23   2.299  -4.877   6.778
  113   2HG   ARG  23          2HG       ARG  23   3.608  -4.878   5.619
  114   1HD   ARG  23          1HD       ARG  23   3.930  -2.452   5.931
  115   2HD   ARG  23          2HD       ARG  23   2.702  -2.468   7.192
  116    HE   ARG  23           HE       ARG  23   5.011  -4.213   7.493
  117   1HH1  ARG  23          1HH1      ARG  23   3.249  -1.326   8.582
  118   2HH1  ARG  23          2HH1      ARG  23   4.265  -1.045   9.906
  119   1HH2  ARG  23          1HH2      ARG  23   6.419  -3.802   9.291
  120   2HH2  ARG  23          2HH2      ARG  23   6.123  -2.480  10.316
  121    H    LYS  24           H        LYS  24   4.851  -4.930   3.632
  122    HA   LYS  24           HA       LYS  24   6.277  -2.550   4.146
  123   1HB   LYS  24          1HB       LYS  24   7.131  -4.771   4.832
  124   2HB   LYS  24          2HB       LYS  24   7.375  -5.181   3.141
  125   1HG   LYS  24          1HG       LYS  24   9.480  -4.512   4.133
  126   2HG   LYS  24          2HG       LYS  24   8.981  -3.324   2.928
  127   1HD   LYS  24          1HD       LYS  24   8.033  -1.940   4.797
  128   2HD   LYS  24          2HD       LYS  24   8.744  -3.085   5.930
  129   1HE   LYS  24          1HE       LYS  24  10.232  -1.392   3.920
  130   2HE   LYS  24          2HE       LYS  24  10.123  -1.089   5.647
  131   1HZ   LYS  24          1HZ       LYS  24  12.191  -2.095   5.137
  132   2HZ   LYS  24          2HZ       LYS  24  11.471  -3.389   4.333
  133   3HZ   LYS  24          3HZ       LYS  24  11.284  -3.227   6.000
  134    H    GLU  25           H        GLU  25   5.856  -4.544   1.135
  135    HA   GLU  25           HA       GLU  25   7.500  -2.718  -0.274
  136   1HB   GLU  25          1HB       GLU  25   6.300  -4.033  -2.211
  137   2HB   GLU  25          2HB       GLU  25   7.722  -4.717  -1.363
  138   1HG   GLU  25          1HG       GLU  25   6.002  -5.932  -0.034
  139   2HG   GLU  25          2HG       GLU  25   4.792  -5.283  -1.133
  140    H    MET  26           H        MET  26   4.150  -3.020   0.308
  141    HA   MET  26           HA       MET  26   3.399  -1.121  -1.662
  142   1HB   MET  26          1HB       MET  26   1.851  -2.660  -0.622
  143   2HB   MET  26          2HB       MET  26   2.088  -1.876   0.929
  144   1HG   MET  26          1HG       MET  26   0.227  -0.701   0.433
  145   2HG   MET  26          2HG       MET  26   1.301   0.235  -0.591
  146   1HE   MET  26          1HE       MET  26   0.246  -1.065  -4.189
  147   2HE   MET  26          2HE       MET  26   1.569  -1.820  -3.339
  148   3HE   MET  26          3HE       MET  26   1.397  -0.042  -3.357
  149    H    SER  27           H        SER  27   4.309  -0.936   1.685
  150    HA   SER  27           HA       SER  27   3.971   1.833   2.027
  151   1HB   SER  27          1HB       SER  27   6.013   0.049   3.406
  152   2HB   SER  27          2HB       SER  27   5.710   1.727   3.848
  153    HG   SER  27           HG       SER  27   3.852  -0.395   3.881
  154    H    GLN  28           H        GLN  28   6.659  -0.113   0.842
  155    HA   GLN  28           HA       GLN  28   8.399   2.124   0.454
  156   1HB   GLN  28          1HB       GLN  28   8.425  -0.651  -0.748
  157   2HB   GLN  28          2HB       GLN  28   9.689   0.537  -1.013
  158   1HG   GLN  28          1HG       GLN  28   8.908  -0.404   1.716
  159   2HG   GLN  28          2HG       GLN  28  10.107  -1.237   0.742
  160   1HE2  GLN  28          1HE2      GLN  28  11.764  -0.815   2.137
  161   2HE2  GLN  28          2HE2      GLN  28  12.443   0.747   2.401
  162    H    PHE  29           H        PHE  29   6.305   0.374  -1.681
  163    HA   PHE  29           HA       PHE  29   6.773   1.768  -4.012
  164   1HB   PHE  29          1HB       PHE  29   5.481  -0.291  -3.952
  165   2HB   PHE  29          2HB       PHE  29   4.261   0.469  -2.952
  166    HD1  PHE  29           1HD      PHE  29   5.727   0.326  -6.308
  167    HD2  PHE  29           2HD      PHE  29   2.512   1.701  -3.897
  168    HE1  PHE  29           1HE      PHE  29   4.411   0.855  -8.319
  169    HE2  PHE  29           2HE      PHE  29   1.232   2.226  -5.909
  170    HZ   PHE  29           HZ       PHE  29   2.138   1.800  -8.058
  171    H    ILE  30           H        ILE  30   4.337   2.328  -1.528
  172    HA   ILE  30           HA       ILE  30   3.258   4.653  -2.630
  173    HB   ILE  30           HB       ILE  30   3.177   3.530   0.158
  174   1HG1  ILE  30          1HG1      ILE  30   1.068   3.797  -1.987
  175   2HG1  ILE  30          2HG1      ILE  30   2.044   2.363  -1.716
  176   1HG2  ILE  30          1HG2      ILE  30   1.673   5.945  -0.860
  177   2HG2  ILE  30          2HG2      ILE  30   3.006   5.991   0.270
  178   3HG2  ILE  30          3HG2      ILE  30   1.488   5.201   0.736
  179   1HD1  ILE  30          1HD1      ILE  30  -0.155   2.127  -0.723
  180   2HD1  ILE  30          2HD1      ILE  30   0.119   3.562   0.257
  181   3HD1  ILE  30          3HD1      ILE  30   1.107   2.133   0.493
  182    H    VAL  31           H        VAL  31   5.697   4.239  -0.058
  183    HA   VAL  31           HA       VAL  31   6.256   6.874   0.381
  184    HB   VAL  31           HB       VAL  31   7.999   4.412   0.379
  185   1HG1  VAL  31          1HG1      VAL  31   9.850   5.634   1.354
  186   2HG1  VAL  31          2HG1      VAL  31   8.950   7.129   1.325
  187   3HG1  VAL  31          3HG1      VAL  31   9.471   6.390  -0.198
  188   1HG2  VAL  31          1HG2      VAL  31   6.359   4.677   2.157
  189   2HG2  VAL  31          2HG2      VAL  31   7.013   6.253   2.558
  190   3HG2  VAL  31          3HG2      VAL  31   7.994   4.805   2.813
  191    H    GLN  32           H        GLN  32   7.600   4.819  -2.216
  192    HA   GLN  32           HA       GLN  32   9.215   6.650  -3.360
  193   1HB   GLN  32          1HB       GLN  32   9.171   4.277  -3.837
  194   2HB   GLN  32          2HB       GLN  32   7.621   4.444  -4.627
  195   1HG   GLN  32          1HG       GLN  32   9.372   4.229  -6.230
  196   2HG   GLN  32          2HG       GLN  32   8.598   5.817  -6.310
  197   1HE2  GLN  32          1HE2      GLN  32  10.408   6.628  -7.374
  198   2HE2  GLN  32          2HE2      GLN  32  11.861   7.042  -6.534
  199    H    CYS  33           H        CYS  33   5.837   5.855  -3.957
  200    HA   CYS  33           HA       CYS  33   5.287   7.580  -6.091
  201   1HB   CYS  33          1HB       CYS  33   3.578   6.307  -4.017
  202   2HB   CYS  33          2HB       CYS  33   2.911   7.194  -5.394
  203    HG   CYS  33           HG       CYS  33   4.740   4.335  -5.378
  204    H    LEU  34           H        LEU  34   5.091   8.011  -2.638
  205    HA   LEU  34           HA       LEU  34   3.875  10.602  -2.772
  206   1HB   LEU  34          1HB       LEU  34   5.198   9.206  -0.475
  207   2HB   LEU  34          2HB       LEU  34   4.391  10.750  -0.359
  208    HG   LEU  34           HG       LEU  34   3.125   8.111  -1.019
  209   1HD1  LEU  34          1HD1      LEU  34   2.934   9.924   1.392
  210   2HD1  LEU  34          2HD1      LEU  34   3.792   8.390   1.315
  211   3HD1  LEU  34          3HD1      LEU  34   2.037   8.422   1.160
  212   1HD2  LEU  34          1HD2      LEU  34   1.905  10.851  -0.737
  213   2HD2  LEU  34          2HD2      LEU  34   1.005   9.344  -0.860
  214   3HD2  LEU  34          3HD2      LEU  34   1.990   9.891  -2.214
  215    H    ASN  35           H        ASN  35   7.175   9.458  -2.675
  216    HA   ASN  35           HA       ASN  35   8.544  11.492  -1.848
  217   1HB   ASN  35          1HB       ASN  35   9.143   9.551  -3.855
  218   2HB   ASN  35          2HB       ASN  35  10.103  11.042  -4.028
  219   1HD2  ASN  35          1HD2      ASN  35   8.959   8.689  -1.794
  220   2HD2  ASN  35          2HD2      ASN  35  10.169   9.012  -0.634
  221    HA   PRO  36           HA       PRO  36   8.236  14.273  -5.850
  222   1HB   PRO  36          1HB       PRO  36   5.901  13.967  -7.289
  223   2HB   PRO  36          2HB       PRO  36   7.432  13.242  -7.766
  224   1HG   PRO  36          1HG       PRO  36   5.117  12.022  -6.361
  225   2HG   PRO  36          2HG       PRO  36   6.183  11.327  -7.592
  226   1HD   PRO  36          1HD       PRO  36   6.394  10.744  -4.964
  227   2HD   PRO  36          2HD       PRO  36   7.806  10.752  -6.022
  228    H    TYR  37           H        TYR  37   5.708  13.303  -3.754
  229    HA   TYR  37           HA       TYR  37   4.227  15.758  -4.023
  230   1HB   TYR  37          1HB       TYR  37   3.879  13.416  -2.159
  231   2HB   TYR  37          2HB       TYR  37   2.841  14.835  -2.170
  232    HD1  TYR  37           1HD      TYR  37   3.976  11.981  -4.195
  233    HD2  TYR  37           2HD      TYR  37   1.059  15.012  -3.707
  234    HE1  TYR  37           1HE      TYR  37   2.624  10.914  -5.879
  235    HE2  TYR  37           2HE      TYR  37  -0.321  14.012  -5.396
  236    HH   TYR  37           HH       TYR  37   0.204  10.860  -6.468
  237    H    ARG  38           H        ARG  38   6.689  14.448  -2.012
  238    HA   ARG  38           HA       ARG  38   6.216  16.485   0.019
  239   1HB   ARG  38          1HB       ARG  38   7.997  15.476   1.276
  240   2HB   ARG  38          2HB       ARG  38   6.908  14.225   0.696
  241   1HG   ARG  38          1HG       ARG  38   8.419  13.642  -1.043
  242   2HG   ARG  38          2HG       ARG  38   9.499  14.962  -0.610
  243   1HD   ARG  38          1HD       ARG  38   9.670  13.904   1.683
  244   2HD   ARG  38          2HD       ARG  38   8.722  12.573   1.020
  245    HE   ARG  38           HE       ARG  38  10.625  12.275  -0.585
  246   1HH1  ARG  38          1HH1      ARG  38  11.231  13.753   2.616
  247   2HH1  ARG  38          2HH1      ARG  38  12.796  13.099   2.731
  248   1HH2  ARG  38          1HH2      ARG  38  12.747  11.424  -0.375
  249   2HH2  ARG  38          2HH2      ARG  38  13.675  11.765   1.026
  250    H    LYS  39           H        LYS  39   7.551  16.519  -2.828
  251    HA   LYS  39           HA       LYS  39   9.961  18.053  -2.377
  252   1HB   LYS  39          1HB       LYS  39   8.269  17.863  -4.885
  253   2HB   LYS  39          2HB       LYS  39   9.924  18.438  -4.787
  254   1HG   LYS  39          1HG       LYS  39   9.003  15.628  -4.244
  255   2HG   LYS  39          2HG       LYS  39   9.765  16.191  -5.728
  256   1HD   LYS  39          1HD       LYS  39  11.797  16.726  -4.492
  257   2HD   LYS  39          2HD       LYS  39  11.004  16.240  -2.988
  258   1HE   LYS  39          1HE       LYS  39  10.761  14.002  -3.771
  259   2HE   LYS  39          2HE       LYS  39  11.414  14.426  -5.349
  260   1HZ   LYS  39          1HZ       LYS  39  13.058  13.328  -3.979
  261   2HZ   LYS  39          2HZ       LYS  39  12.913  14.469  -2.769
  262   3HZ   LYS  39          3HZ       LYS  39  13.551  14.905  -4.269
  263    HA   PRO  40           HA       PRO  40   7.762  21.891  -1.697
  264   1HB   PRO  40          1HB       PRO  40   9.683  23.673  -2.421
  265   2HB   PRO  40          2HB       PRO  40   9.671  22.823  -0.874
  266   1HG   PRO  40          1HG       PRO  40  11.239  22.218  -3.348
  267   2HG   PRO  40          2HG       PRO  40  11.760  22.140  -1.655
  268   1HD   PRO  40          1HD       PRO  40  11.080  19.934  -3.081
  269   2HD   PRO  40          2HD       PRO  40  10.801  20.063  -1.333
  270    H    ASP  41           H        ASP  41   8.809  20.816  -4.796
  271    HA   ASP  41           HA       ASP  41   7.596  23.027  -6.156
  272   1HB   ASP  41          1HB       ASP  41   8.641  21.952  -8.070
  273   2HB   ASP  41          2HB       ASP  41   9.827  22.469  -6.870
  274    H    CYS  42           H        CYS  42   6.700  20.308  -4.786
  275    HA   CYS  42           HA       CYS  42   5.293  18.752  -6.626
  276   1HB   CYS  42          1HB       CYS  42   5.486  18.016  -4.351
  277   2HB   CYS  42          2HB       CYS  42   4.504  19.362  -3.780
  278    HG   CYS  42           HG       CYS  42   2.847  17.227  -3.545
  279    H    LYS  43           H        LYS  43   3.498  18.907  -7.737
  280    HA   LYS  43           HA       LYS  43   2.237  21.451  -8.064
  281   1HB   LYS  43          1HB       LYS  43   1.701  18.752  -9.264
  282   2HB   LYS  43          2HB       LYS  43   0.796  20.187  -9.697
  283   1HG   LYS  43          1HG       LYS  43   3.782  19.907 -10.000
  284   2HG   LYS  43          2HG       LYS  43   2.612  19.568 -11.272
  285   1HD   LYS  43          1HD       LYS  43   2.947  22.238  -9.891
  286   2HD   LYS  43          2HD       LYS  43   3.617  21.826 -11.465
  287   1HE   LYS  43          1HE       LYS  43   0.674  21.931 -10.748
  288   2HE   LYS  43          2HE       LYS  43   1.558  23.113 -11.698
  289   1HZ   LYS  43          1HZ       LYS  43   1.972  21.413 -13.368
  290   2HZ   LYS  43          2HZ       LYS  43   0.336  21.655 -13.132
  291   3HZ   LYS  43          3HZ       LYS  43   1.066  20.279 -12.494
  292    H    VAL  44           H        VAL  44   1.216  18.338  -6.729
  293    HA   VAL  44           HA       VAL  44  -1.080  19.647  -5.539
  294    HB   VAL  44           HB       VAL  44  -1.918  18.878  -7.713
  295   1HG1  VAL  44          1HG1      VAL  44  -0.957  16.156  -6.957
  296   2HG1  VAL  44          2HG1      VAL  44  -0.350  17.183  -8.258
  297   3HG1  VAL  44          3HG1      VAL  44  -1.988  16.532  -8.339
  298   1HG2  VAL  44          1HG2      VAL  44  -3.768  17.445  -6.977
  299   2HG2  VAL  44          2HG2      VAL  44  -3.468  18.759  -5.838
  300   3HG2  VAL  44          3HG2      VAL  44  -2.907  17.126  -5.471
  301    H    GLY  45           H        GLY  45  -1.484  18.942  -3.610
  302   1HA   GLY  45          1HA       GLY  45  -1.419  17.690  -1.707
  303   2HA   GLY  45          2HA       GLY  45  -1.015  16.287  -2.697
  304    H    ARG  46           H        ARG  46   0.761  19.454  -1.922
  305    HA   ARG  46           HA       ARG  46   3.172  18.022  -1.831
  306   1HB   ARG  46          1HB       ARG  46   3.134  20.362  -2.520
  307   2HB   ARG  46          2HB       ARG  46   2.496  20.824  -0.946
  308   1HG   ARG  46          1HG       ARG  46   4.506  20.103   0.154
  309   2HG   ARG  46          2HG       ARG  46   5.160  19.498  -1.363
  310   1HD   ARG  46          1HD       ARG  46   6.123  21.642  -0.740
  311   2HD   ARG  46          2HD       ARG  46   5.196  21.729  -2.254
  312    HE   ARG  46           HE       ARG  46   3.709  23.111  -1.253
  313   1HH1  ARG  46          1HH1      ARG  46   5.914  21.901   1.264
  314   2HH1  ARG  46          2HH1      ARG  46   5.488  23.098   2.390
  315   1HH2  ARG  46          1HH2      ARG  46   3.139  24.755   0.312
  316   2HH2  ARG  46          2HH2      ARG  46   3.883  24.738   1.846
  317    H    ILE  47           H        ILE  47   3.920  16.902  -0.270
  318    HA   ILE  47           HA       ILE  47   2.728  16.934   2.347
  319    HB   ILE  47           HB       ILE  47   5.164  15.336   1.427
  320   1HG1  ILE  47          1HG1      ILE  47   2.238  14.548   1.581
  321   2HG1  ILE  47          2HG1      ILE  47   3.127  14.902   0.101
  322   1HG2  ILE  47          1HG2      ILE  47   5.128  15.584   3.762
  323   2HG2  ILE  47          2HG2      ILE  47   4.677  13.943   3.297
  324   3HG2  ILE  47          3HG2      ILE  47   3.451  15.065   3.853
  325   1HD1  ILE  47          1HD1      ILE  47   3.773  12.676   2.009
  326   2HD1  ILE  47          2HD1      ILE  47   4.543  12.999   0.448
  327   3HD1  ILE  47          3HD1      ILE  47   2.853  12.506   0.516
  328    H    THR  48           H        THR  48   3.242  18.234   3.855
  329    HA   THR  48           HA       THR  48   5.240  20.163   3.730
  330    HB   THR  48           HB       THR  48   4.539  20.618   6.082
  331    HG1  THR  48           1HG      THR  48   2.747  19.288   6.813
  332   1HG2  THR  48          1HG2      THR  48   3.330  21.507   4.138
  333   2HG2  THR  48          2HG2      THR  48   2.249  21.132   5.508
  334   3HG2  THR  48          3HG2      THR  48   2.402  20.000   4.147
  335    H    THR  49           H        THR  49   4.965  17.280   5.778
  336    HA   THR  49           HA       THR  49   7.775  17.744   6.569
  337    HB   THR  49           HB       THR  49   5.738  16.642   8.484
  338    HG1  THR  49           1HG      THR  49   5.140  18.742   7.551
  339   1HG2  THR  49          1HG2      THR  49   7.260  17.612  10.158
  340   2HG2  THR  49          2HG2      THR  49   8.283  18.241   8.866
  341   3HG2  THR  49          3HG2      THR  49   8.116  16.500   9.090
  342    H    THR  50           H        THR  50   8.903  15.861   7.174
  343    HA   THR  50           HA       THR  50   8.511  13.475   5.859
  344    HB   THR  50           HB       THR  50  10.537  14.229   6.686
  345    HG1  THR  50           1HG      THR  50  10.957  12.142   8.161
  346   1HG2  THR  50          1HG2      THR  50  11.204  14.137   9.098
  347   2HG2  THR  50          2HG2      THR  50   9.513  13.773   9.472
  348   3HG2  THR  50          3HG2      THR  50   9.933  15.318   8.735
  349    H    GLU  51           H        GLU  51   7.636  14.434   9.115
  350    HA   GLU  51           HA       GLU  51   6.509  12.006  10.066
  351   1HB   GLU  51          1HB       GLU  51   5.575  14.807  10.620
  352   2HB   GLU  51          2HB       GLU  51   5.288  13.391  11.616
  353   1HG   GLU  51          1HG       GLU  51   7.612  13.288  12.205
  354   2HG   GLU  51          2HG       GLU  51   7.976  14.617  11.096
  355    H    ASP  52           H        ASP  52   5.092  14.636   8.068
  356    HA   ASP  52           HA       ASP  52   2.487  13.553   8.101
  357   1HB   ASP  52          1HB       ASP  52   4.022  15.636   6.595
  358   2HB   ASP  52          2HB       ASP  52   2.419  15.188   6.067
  359    H    PHE  53           H        PHE  53   5.275  13.409   6.028
  360    HA   PHE  53           HA       PHE  53   4.175  12.023   3.912
  361   1HB   PHE  53          1HB       PHE  53   6.387  13.111   3.818
  362   2HB   PHE  53          2HB       PHE  53   6.949  12.074   5.111
  363    HD1  PHE  53           1HD      PHE  53   6.138  12.297   1.592
  364    HD2  PHE  53           2HD      PHE  53   7.590   9.828   4.700
  365    HE1  PHE  53           1HE      PHE  53   6.947  10.702  -0.072
  366    HE2  PHE  53           2HE      PHE  53   8.391   8.215   3.079
  367    HZ   PHE  53           HZ       PHE  53   8.078   8.670   0.631
  368    H    LYS  54           H        LYS  54   5.803  10.888   6.749
  369    HA   LYS  54           HA       LYS  54   5.650   8.050   6.339
  370   1HB   LYS  54          1HB       LYS  54   5.887   9.691   8.845
  371   2HB   LYS  54          2HB       LYS  54   6.007   7.935   8.788
  372   1HG   LYS  54          1HG       LYS  54   7.983   8.016   7.484
  373   2HG   LYS  54          2HG       LYS  54   7.776   9.738   7.161
  374   1HD   LYS  54          1HD       LYS  54   9.519   9.364   8.803
  375   2HD   LYS  54          2HD       LYS  54   8.156  10.222   9.520
  376   1HE   LYS  54          1HE       LYS  54   7.358   8.057  10.452
  377   2HE   LYS  54          2HE       LYS  54   8.809   7.290   9.810
  378   1HZ   LYS  54          1HZ       LYS  54  10.152   8.722  11.211
  379   2HZ   LYS  54          2HZ       LYS  54   9.027   7.908  12.163
  380   3HZ   LYS  54          3HZ       LYS  54   8.784   9.519  11.754
  381    H    HIS  55           H        HIS  55   3.478  10.343   7.926
  382    HA   HIS  55           HA       HIS  55   1.673   8.427   9.070
  383   1HB   HIS  55          1HB       HIS  55   1.958  10.811   9.821
  384   2HB   HIS  55          2HB       HIS  55   1.376  11.339   8.268
  385    HD1  HIS  55           1HD      HIS  55   0.240  10.344  11.623
  386    HD2  HIS  55           2HD      HIS  55  -1.474  11.030   7.887
  387    HE1  HIS  55           1HE      HIS  55  -2.207  10.588  12.044
  388    H    LEU  56           H        LEU  56   1.599  10.358   6.145
  389    HA   LEU  56           HA       LEU  56  -0.875   9.173   5.230
  390   1HB   LEU  56          1HB       LEU  56   0.266  11.388   4.553
  391   2HB   LEU  56          2HB       LEU  56   1.114  10.374   3.435
  392    HG   LEU  56           HG       LEU  56  -0.988   9.440   2.610
  393   1HD1  LEU  56          1HD1      LEU  56  -2.270  11.649   4.184
  394   2HD1  LEU  56          2HD1      LEU  56  -2.490   9.911   4.412
  395   3HD1  LEU  56          3HD1      LEU  56  -3.057  10.681   2.944
  396   1HD2  LEU  56          1HD2      LEU  56  -0.586  12.380   2.313
  397   2HD2  LEU  56          2HD2      LEU  56  -1.523  11.315   1.225
  398   3HD2  LEU  56          3HD2      LEU  56   0.223  11.067   1.435
  399    H    ALA  57           H        ALA  57   2.557   8.489   4.518
  400    HA   ALA  57           HA       ALA  57   1.989   6.525   2.605
  401   1HB   ALA  57          1HB       ALA  57   4.311   7.341   3.094
  402   2HB   ALA  57          2HB       ALA  57   4.203   5.580   3.109
  403   3HB   ALA  57          3HB       ALA  57   4.250   6.474   4.628
  404    H    ARG  58           H        ARG  58   1.961   6.379   6.062
  405    HA   ARG  58           HA       ARG  58   1.444   3.566   6.266
  406   1HB   ARG  58          1HB       ARG  58   0.697   5.756   8.215
  407   2HB   ARG  58          2HB       ARG  58   0.543   4.038   8.534
  408   1HG   ARG  58          1HG       ARG  58   3.043   5.643   8.175
  409   2HG   ARG  58          2HG       ARG  58   2.520   4.715   9.588
  410   1HD   ARG  58          1HD       ARG  58   2.592   2.693   8.191
  411   2HD   ARG  58          2HD       ARG  58   3.240   3.721   6.908
  412    HE   ARG  58           HE       ARG  58   4.764   3.961   9.284
  413   1HH1  ARG  58          1HH1      ARG  58   4.441   1.829   6.426
  414   2HH1  ARG  58          2HH1      ARG  58   6.037   1.288   6.513
  415   1HH2  ARG  58          1HH2      ARG  58   6.960   3.169   9.378
  416   2HH2  ARG  58          2HH2      ARG  58   7.509   2.061   8.222
  417    H    LYS  59           H        LYS  59  -0.609   6.377   6.038
  418    HA   LYS  59           HA       LYS  59  -2.974   4.997   6.560
  419   1HB   LYS  59          1HB       LYS  59  -2.423   7.503   5.089
  420   2HB   LYS  59          2HB       LYS  59  -4.027   6.827   5.068
  421   1HG   LYS  59          1HG       LYS  59  -3.822   6.944   7.660
  422   2HG   LYS  59          2HG       LYS  59  -2.471   8.044   7.332
  423   1HD   LYS  59          1HD       LYS  59  -4.482   9.366   7.560
  424   2HD   LYS  59          2HD       LYS  59  -3.996   9.373   5.861
  425   1HE   LYS  59          1HE       LYS  59  -5.657   7.385   5.566
  426   2HE   LYS  59          2HE       LYS  59  -6.222   7.819   7.160
  427   1HZ   LYS  59          1HZ       LYS  59  -6.786  10.047   6.233
  428   2HZ   LYS  59          2HZ       LYS  59  -7.581   8.790   5.537
  429   3HZ   LYS  59          3HZ       LYS  59  -6.285   9.491   4.724
  430    H    LEU  60           H        LEU  60  -1.435   5.897   3.560
  431    HA   LEU  60           HA       LEU  60  -3.416   5.067   1.974
  432   1HB   LEU  60          1HB       LEU  60  -0.523   5.428   1.416
  433   2HB   LEU  60          2HB       LEU  60  -1.736   5.290   0.133
  434    HG   LEU  60           HG       LEU  60  -1.994   7.220   2.345
  435   1HD1  LEU  60          1HD1      LEU  60   0.045   7.897   1.388
  436   2HD1  LEU  60          2HD1      LEU  60  -1.150   8.965   0.636
  437   3HD1  LEU  60          3HD1      LEU  60  -0.484   7.602  -0.247
  438   1HD2  LEU  60          1HD2      LEU  60  -3.445   8.400   0.727
  439   2HD2  LEU  60          2HD2      LEU  60  -3.969   6.777   1.189
  440   3HD2  LEU  60          3HD2      LEU  60  -3.212   7.037  -0.383
  441    H    THR  61           H        THR  61  -0.388   3.555   2.916
  442    HA   THR  61           HA       THR  61  -0.462   1.152   1.519
  443    HB   THR  61           HB       THR  61   0.544   1.649   4.333
  444    HG1  THR  61           1HG      THR  61   1.708   2.937   3.042
  445   1HG2  THR  61          1HG2      THR  61   1.234  -0.557   2.378
  446   2HG2  THR  61          2HG2      THR  61   0.282  -0.750   3.850
  447   3HG2  THR  61          3HG2      THR  61   1.986  -0.304   3.954
  448    H    HIS  62           H        HIS  62  -1.884   2.090   4.555
  449    HA   HIS  62           HA       HIS  62  -2.852  -0.584   4.957
  450   1HB   HIS  62          1HB       HIS  62  -2.198   1.044   6.819
  451   2HB   HIS  62          2HB       HIS  62  -3.740   1.839   6.527
  452    HD1  HIS  62           1HD      HIS  62  -2.258  -0.564   8.684
  453    HD2  HIS  62           2HD      HIS  62  -5.981  -0.236   6.868
  454    HE1  HIS  62           1HE      HIS  62  -3.746  -2.130   9.937
  455    H    GLY  63           H        GLY  63  -4.226   2.327   3.537
  456   1HA   GLY  63          1HA       GLY  63  -6.898   1.380   3.669
  457   2HA   GLY  63          2HA       GLY  63  -6.370   2.703   2.669
  458    H    VAL  64           H        VAL  64  -4.329   1.153   1.261
  459    HA   VAL  64           HA       VAL  64  -5.952  -0.032  -0.839
  460    HB   VAL  64           HB       VAL  64  -2.966  -0.345  -0.298
  461   1HG1  VAL  64          1HG1      VAL  64  -3.881  -2.140  -1.780
  462   2HG1  VAL  64          2HG1      VAL  64  -2.805  -1.076  -2.668
  463   3HG1  VAL  64          3HG1      VAL  64  -4.541  -0.880  -2.814
  464   1HG2  VAL  64          1HG2      VAL  64  -2.659   1.336  -2.058
  465   2HG2  VAL  64          2HG2      VAL  64  -3.564   1.990  -0.691
  466   3HG2  VAL  64          3HG2      VAL  64  -4.406   1.530  -2.173
  467    H    MET  65           H        MET  65  -4.224  -1.046   1.750
  468    HA   MET  65           HA       MET  65  -4.201  -3.854   1.455
  469   1HB   MET  65          1HB       MET  65  -2.752  -2.763   3.069
  470   2HB   MET  65          2HB       MET  65  -4.126  -2.149   3.941
  471   1HG   MET  65          1HG       MET  65  -4.745  -4.336   4.602
  472   2HG   MET  65          2HG       MET  65  -3.340  -5.010   3.777
  473   1HE   MET  65          1HE       MET  65  -2.480  -5.052   7.623
  474   2HE   MET  65          2HE       MET  65  -2.674  -6.036   6.149
  475   3HE   MET  65          3HE       MET  65  -4.070  -5.184   6.845
  476    H    ASN  66           H        ASN  66  -6.424  -1.702   3.277
  477    HA   ASN  66           HA       ASN  66  -8.341  -3.627   4.063
  478   1HB   ASN  66          1HB       ASN  66  -8.357  -0.699   3.534
  479   2HB   ASN  66          2HB       ASN  66  -9.796  -1.482   4.076
  480   1HD2  ASN  66          1HD2      ASN  66  -8.496   0.584   5.212
  481   2HD2  ASN  66          2HD2      ASN  66  -7.918   0.153   6.767
  482    H    LYS  67           H        LYS  67  -8.147  -1.587   1.203
  483    HA   LYS  67           HA       LYS  67 -10.644  -2.229   0.213
  484   1HB   LYS  67          1HB       LYS  67  -8.153  -1.362  -1.261
  485   2HB   LYS  67          2HB       LYS  67  -9.753  -1.418  -1.986
  486   1HG   LYS  67          1HG       LYS  67 -10.564   0.282  -0.501
  487   2HG   LYS  67          2HG       LYS  67  -9.076   0.230   0.442
  488   1HD   LYS  67          1HD       LYS  67  -9.008   2.182  -0.956
  489   2HD   LYS  67          2HD       LYS  67  -7.844   1.021  -1.582
  490   1HE   LYS  67          1HE       LYS  67  -9.065   2.068  -3.397
  491   2HE   LYS  67          2HE       LYS  67  -9.457   0.354  -3.308
  492   1HZ   LYS  67          1HZ       LYS  67 -11.161   2.517  -2.171
  493   2HZ   LYS  67          2HZ       LYS  67 -11.576   0.883  -2.320
  494   3HZ   LYS  67          3HZ       LYS  67 -11.368   1.832  -3.676
  495    H    GLU  68           H        GLU  68  -7.483  -3.763  -0.395
  496    HA   GLU  68           HA       GLU  68  -8.858  -5.569  -2.051
  497   1HB   GLU  68          1HB       GLU  68  -6.717  -6.624  -2.409
  498   2HB   GLU  68          2HB       GLU  68  -6.796  -4.880  -2.702
  499   1HG   GLU  68          1HG       GLU  68  -5.682  -4.455  -0.626
  500   2HG   GLU  68          2HG       GLU  68  -5.492  -6.191  -0.354
  501    H    LEU  69           H        LEU  69  -7.561  -5.733   1.270
  502    HA   LEU  69           HA       LEU  69  -8.278  -8.362   1.559
  503   1HB   LEU  69          1HB       LEU  69  -8.260  -6.116   3.560
  504   2HB   LEU  69          2HB       LEU  69  -8.629  -7.765   4.016
  505    HG   LEU  69           HG       LEU  69  -6.021  -6.854   2.788
  506   1HD1  LEU  69          1HD1      LEU  69  -5.079  -7.257   4.985
  507   2HD1  LEU  69          2HD1      LEU  69  -6.688  -7.595   5.632
  508   3HD1  LEU  69          3HD1      LEU  69  -6.290  -5.978   5.033
  509   1HD2  LEU  69          1HD2      LEU  69  -6.887  -9.510   3.925
  510   2HD2  LEU  69          2HD2      LEU  69  -5.244  -9.079   3.484
  511   3HD2  LEU  69          3HD2      LEU  69  -6.487  -9.166   2.235
  512    H    LYS  70           H        LYS  70 -10.471  -5.625   1.270
  513    HA   LYS  70           HA       LYS  70 -12.630  -7.252   2.233
  514   1HB   LYS  70          1HB       LYS  70 -14.044  -5.396   1.913
  515   2HB   LYS  70          2HB       LYS  70 -12.526  -4.825   2.585
  516   1HG   LYS  70          1HG       LYS  70 -11.828  -4.041   0.488
  517   2HG   LYS  70          2HG       LYS  70 -13.298  -4.663  -0.266
  518   1HD   LYS  70          1HD       LYS  70 -14.636  -3.297   1.115
  519   2HD   LYS  70          2HD       LYS  70 -13.205  -2.641   1.942
  520   1HE   LYS  70          1HE       LYS  70 -12.408  -2.040  -0.327
  521   2HE   LYS  70          2HE       LYS  70 -14.026  -2.450  -0.879
  522   1HZ   LYS  70          1HZ       LYS  70 -13.858  -0.029  -0.430
  523   2HZ   LYS  70          2HZ       LYS  70 -13.400  -0.363   1.143
  524   3HZ   LYS  70          3HZ       LYS  70 -14.949  -0.774   0.624
  525    H    TYR  71           H        TYR  71 -11.262  -6.388  -0.854
  526    HA   TYR  71           HA       TYR  71 -13.419  -7.858  -2.204
  527   1HB   TYR  71          1HB       TYR  71 -11.111  -6.236  -3.242
  528   2HB   TYR  71          2HB       TYR  71 -12.148  -7.198  -4.295
  529    HD1  TYR  71           1HD      TYR  71 -14.074  -6.070  -1.561
  530    HD2  TYR  71           2HD      TYR  71 -12.406  -4.710  -5.235
  531    HE1  TYR  71           1HE      TYR  71 -15.687  -4.353  -1.588
  532    HE2  TYR  71           2HE      TYR  71 -14.082  -2.909  -5.298
  533    HH   TYR  71           HH       TYR  71 -16.099  -2.185  -2.594
  534    H    CYS  72           H        CYS  72 -10.360  -8.486  -1.042
  535    HA   CYS  72           HA       CYS  72 -10.420 -11.150  -2.211
  536   1HB   CYS  72          1HB       CYS  72  -8.095  -9.403  -1.426
  537   2HB   CYS  72          2HB       CYS  72  -7.904 -11.093  -1.835
  538    HG   CYS  72           HG       CYS  72  -7.271 -10.377  -4.251
  539    H    LYS  73           H        LYS  73 -11.540 -12.026  -0.550
  540    HA   LYS  73           HA       LYS  73 -11.018 -11.451   2.194
  541   1HB   LYS  73          1HB       LYS  73 -12.560 -13.691   0.925
  542   2HB   LYS  73          2HB       LYS  73 -12.627 -13.250   2.612
  543   1HG   LYS  73          1HG       LYS  73 -13.428 -11.388   0.360
  544   2HG   LYS  73          2HG       LYS  73 -14.577 -12.340   1.309
  545   1HD   LYS  73          1HD       LYS  73 -12.718 -10.168   2.321
  546   2HD   LYS  73          2HD       LYS  73 -14.445 -10.006   2.035
  547   1HE   LYS  73          1HE       LYS  73 -14.861 -11.732   3.760
  548   2HE   LYS  73          2HE       LYS  73 -13.130 -11.798   4.080
  549   1HZ   LYS  73          1HZ       LYS  73 -14.912  -9.463   4.461
  550   2HZ   LYS  73          2HZ       LYS  73 -13.252  -9.399   4.666
  551   3HZ   LYS  73          3HZ       LYS  73 -14.185 -10.373   5.679
  552    H    ASN  74           H        ASN  74  -9.462 -13.186  -0.057
  553    HA   ASN  74           HA       ASN  74  -8.270 -14.988   1.898
  554   1HB   ASN  74          1HB       ASN  74  -8.421 -15.309  -1.108
  555   2HB   ASN  74          2HB       ASN  74  -7.763 -16.486   0.022
  556   1HD2  ASN  74          1HD2      ASN  74  -9.263 -17.412   1.540
  557   2HD2  ASN  74          2HD2      ASN  74 -10.918 -17.636   1.110
  558    HA   PRO  75           HA       PRO  75  -4.986 -11.921   1.039
  559   1HB   PRO  75          1HB       PRO  75  -3.394 -12.752   2.897
  560   2HB   PRO  75          2HB       PRO  75  -4.655 -11.528   3.084
  561   1HG   PRO  75          1HG       PRO  75  -4.582 -14.443   3.954
  562   2HG   PRO  75          2HG       PRO  75  -5.435 -13.116   4.764
  563   1HD   PRO  75          1HD       PRO  75  -6.609 -15.016   3.184
  564   2HD   PRO  75          2HD       PRO  75  -7.289 -13.397   3.449
  565    H    GLU  76           H        GLU  76  -4.960 -15.080   0.667
  566    HA   GLU  76           HA       GLU  76  -2.253 -15.585   0.060
  567   1HB   GLU  76          1HB       GLU  76  -4.266 -17.217   0.379
  568   2HB   GLU  76          2HB       GLU  76  -4.557 -16.918  -1.328
  569   1HG   GLU  76          1HG       GLU  76  -3.281 -18.937  -1.041
  570   2HG   GLU  76          2HG       GLU  76  -2.290 -17.707  -1.829
  571    H    ASP  77           H        ASP  77  -4.449 -13.581  -1.174
  572    HA   ASP  77           HA       ASP  77  -3.184 -13.334  -3.866
  573   1HB   ASP  77          1HB       ASP  77  -5.597 -14.027  -3.954
  574   2HB   ASP  77          2HB       ASP  77  -6.006 -12.588  -3.034
  575    H    LEU  78           H        LEU  78  -3.146 -12.080  -0.866
  576    HA   LEU  78           HA       LEU  78  -3.297  -9.294  -1.491
  577   1HB   LEU  78          1HB       LEU  78  -4.163 -10.199   0.605
  578   2HB   LEU  78          2HB       LEU  78  -2.582 -10.906   0.911
  579    HG   LEU  78           HG       LEU  78  -1.723  -8.646   0.841
  580   1HD1  LEU  78          1HD1      LEU  78  -3.273  -6.850   1.621
  581   2HD1  LEU  78          2HD1      LEU  78  -4.612  -7.954   1.344
  582   3HD1  LEU  78          3HD1      LEU  78  -3.627  -7.397  -0.025
  583   1HD2  LEU  78          1HD2      LEU  78  -2.323  -8.209   3.206
  584   2HD2  LEU  78          2HD2      LEU  78  -1.679  -9.797   2.780
  585   3HD2  LEU  78          3HD2      LEU  78  -3.411  -9.603   3.074
  586    H    GLU  79           H        GLU  79  -1.644  -8.857  -2.737
  587    HA   GLU  79           HA       GLU  79   1.138  -9.311  -1.931
  588   1HB   GLU  79          1HB       GLU  79   0.356 -11.103  -3.479
  589   2HB   GLU  79          2HB       GLU  79  -0.233  -9.805  -4.513
  590   1HG   GLU  79          1HG       GLU  79   1.699 -10.678  -5.376
  591   2HG   GLU  79          2HG       GLU  79   1.984  -9.021  -4.875
  592    H    CYS  80           H        CYS  80   2.371  -7.641  -2.648
  593    HA   CYS  80           HA       CYS  80   0.953  -5.322  -3.688
  594   1HB   CYS  80          1HB       CYS  80   2.606  -4.782  -1.959
  595   2HB   CYS  80          2HB       CYS  80   3.886  -5.611  -2.768
  596    HG   CYS  80           HG       CYS  80   4.563  -3.743  -4.360
  597    H    ASN  81           H        ASN  81   0.408  -6.570  -5.477
  598    HA   ASN  81           HA       ASN  81   2.588  -7.218  -7.161
  599   1HB   ASN  81          1HB       ASN  81   1.011  -8.523  -8.597
  600   2HB   ASN  81          2HB       ASN  81   0.825  -8.952  -6.898
  601   1HD2  ASN  81          1HD2      ASN  81  -1.071  -8.468  -5.972
  602   2HD2  ASN  81          2HD2      ASN  81  -2.464  -7.882  -6.783
  603    H    GLU  82           H        GLU  82   1.413  -7.021  -9.737
  604    HA   GLU  82           HA       GLU  82   1.785  -4.507 -10.505
  605   1HB   GLU  82          1HB       GLU  82   0.207  -6.726 -11.466
  606   2HB   GLU  82          2HB       GLU  82   0.429  -5.332 -12.548
  607   1HG   GLU  82          1HG       GLU  82   2.933  -5.779 -12.199
  608   2HG   GLU  82          2HG       GLU  82   2.440  -7.314 -11.485
  609    H    ASN  83           H        ASN  83  -1.277  -6.256 -10.221
  610    HA   ASN  83           HA       ASN  83  -3.249  -4.394 -10.768
  611   1HB   ASN  83          1HB       ASN  83  -3.777  -6.766 -10.409
  612   2HB   ASN  83          2HB       ASN  83  -3.185  -6.665  -8.752
  613   1HD2  ASN  83          1HD2      ASN  83  -5.791  -5.780 -10.931
  614   2HD2  ASN  83          2HD2      ASN  83  -6.943  -5.473  -9.684
  615    H    VAL  84           H        VAL  84  -1.680  -5.278  -7.724
  616    HA   VAL  84           HA       VAL  84  -3.205  -3.499  -6.334
  617    HB   VAL  84           HB       VAL  84  -0.647  -4.874  -5.593
  618   1HG1  VAL  84          1HG1      VAL  84  -2.387  -3.150  -3.821
  619   2HG1  VAL  84          2HG1      VAL  84  -0.689  -2.838  -4.243
  620   3HG1  VAL  84          3HG1      VAL  84  -1.135  -4.270  -3.306
  621   1HG2  VAL  84          1HG2      VAL  84  -2.637  -6.167  -5.907
  622   2HG2  VAL  84          2HG2      VAL  84  -3.471  -5.113  -4.740
  623   3HG2  VAL  84          3HG2      VAL  84  -2.111  -6.113  -4.218
  624    H    LYS  85           H        LYS  85   0.080  -3.258  -7.509
  625    HA   LYS  85           HA       LYS  85   0.817  -0.719  -6.596
  626   1HB   LYS  85          1HB       LYS  85   1.485  -2.037  -9.207
  627   2HB   LYS  85          2HB       LYS  85   2.283  -0.602  -8.578
  628   1HG   LYS  85          1HG       LYS  85   3.116  -1.812  -6.718
  629   2HG   LYS  85          2HG       LYS  85   2.178  -3.237  -7.174
  630   1HD   LYS  85          1HD       LYS  85   3.424  -3.233  -9.332
  631   2HD   LYS  85          2HD       LYS  85   4.481  -1.995  -8.635
  632   1HE   LYS  85          1HE       LYS  85   4.990  -3.457  -6.802
  633   2HE   LYS  85          2HE       LYS  85   3.873  -4.649  -7.478
  634   1HZ   LYS  85          1HZ       LYS  85   6.359  -3.692  -8.795
  635   2HZ   LYS  85          2HZ       LYS  85   5.296  -4.866  -9.405
  636   3HZ   LYS  85          3HZ       LYS  85   6.192  -5.176  -8.016
  637    H    HIS  86           H        HIS  86  -0.669  -1.637  -9.545
  638    HA   HIS  86           HA       HIS  86  -0.910   0.762 -10.865
  639   1HB   HIS  86          1HB       HIS  86  -1.424  -1.378 -11.908
  640   2HB   HIS  86          2HB       HIS  86  -2.815  -1.586 -10.866
  641    HD1  HIS  86           1HD      HIS  86  -4.736  -1.500 -12.367
  642    HD2  HIS  86           2HD      HIS  86  -2.010   1.488 -13.193
  643    HE1  HIS  86           1HE      HIS  86  -5.769  -0.176 -14.223
  644    H    LYS  87           H        LYS  87  -3.224  -0.849  -8.828
  645    HA   LYS  87           HA       LYS  87  -5.275   1.151  -8.615
  646   1HB   LYS  87          1HB       LYS  87  -5.514  -1.287  -8.181
  647   2HB   LYS  87          2HB       LYS  87  -4.373  -1.090  -6.868
  648   1HG   LYS  87          1HG       LYS  87  -5.969   0.324  -5.702
  649   2HG   LYS  87          2HG       LYS  87  -7.118   0.104  -7.034
  650   1HD   LYS  87          1HD       LYS  87  -7.645  -1.467  -5.276
  651   2HD   LYS  87          2HD       LYS  87  -6.999  -2.283  -6.718
  652   1HE   LYS  87          1HE       LYS  87  -4.792  -2.476  -5.643
  653   2HE   LYS  87          2HE       LYS  87  -5.420  -1.619  -4.240
  654   1HZ   LYS  87          1HZ       LYS  87  -5.304  -3.936  -3.804
  655   2HZ   LYS  87          2HZ       LYS  87  -6.170  -4.318  -5.187
  656   3HZ   LYS  87          3HZ       LYS  87  -6.944  -3.538  -3.919
  657    H    THR  88           H        THR  88  -2.452   0.610  -6.898
  658    HA   THR  88           HA       THR  88  -3.178   2.277  -4.738
  659    HB   THR  88           HB       THR  88  -0.689   0.989  -5.660
  660    HG1  THR  88           1HG      THR  88  -1.937  -0.489  -4.803
  661   1HG2  THR  88          1HG2      THR  88  -0.167   3.016  -4.586
  662   2HG2  THR  88          2HG2      THR  88   0.292   1.661  -3.527
  663   3HG2  THR  88          3HG2      THR  88  -1.169   2.636  -3.180
  664    H    LYS  89           H        LYS  89  -0.677   2.618  -7.186
  665    HA   LYS  89           HA       LYS  89  -0.214   5.175  -6.397
  666   1HB   LYS  89          1HB       LYS  89   0.859   5.450  -8.807
  667   2HB   LYS  89          2HB       LYS  89   1.577   4.451  -7.555
  668   1HG   LYS  89          1HG       LYS  89   1.628   3.194  -9.566
  669   2HG   LYS  89          2HG       LYS  89   0.352   2.511  -8.548
  670   1HD   LYS  89          1HD       LYS  89  -0.621   2.553 -10.481
  671   2HD   LYS  89          2HD       LYS  89  -1.075   4.074  -9.752
  672   1HE   LYS  89          1HE       LYS  89  -0.421   4.535 -12.108
  673   2HE   LYS  89          2HE       LYS  89   0.679   5.280 -10.940
  674   1HZ   LYS  89          1HZ       LYS  89   1.852   4.203 -12.788
  675   2HZ   LYS  89          2HZ       LYS  89   1.190   2.729 -12.365
  676   3HZ   LYS  89          3HZ       LYS  89   2.266   3.489 -11.314
  677    H    GLU  90           H        GLU  90  -2.522   3.965  -8.775
  678    HA   GLU  90           HA       GLU  90  -3.396   6.519  -9.750
  679   1HB   GLU  90          1HB       GLU  90  -5.074   4.010  -9.488
  680   2HB   GLU  90          2HB       GLU  90  -5.544   5.449 -10.369
  681   1HG   GLU  90          1HG       GLU  90  -3.502   5.062 -11.802
  682   2HG   GLU  90          2HG       GLU  90  -3.384   3.486 -11.029
  683    H    TYR  91           H        TYR  91  -4.162   4.652  -6.868
  684    HA   TYR  91           HA       TYR  91  -6.485   6.093  -6.156
  685   1HB   TYR  91          1HB       TYR  91  -6.388   3.966  -5.198
  686   2HB   TYR  91          2HB       TYR  91  -4.683   4.103  -4.824
  687    HD1  TYR  91           1HD      TYR  91  -7.873   5.821  -3.857
  688    HD2  TYR  91           2HD      TYR  91  -4.146   4.230  -2.599
  689    HE1  TYR  91           1HE      TYR  91  -8.459   6.296  -1.511
  690    HE2  TYR  91           2HE      TYR  91  -4.700   4.714  -0.266
  691    HH   TYR  91           HH       TYR  91  -7.920   5.629   0.641
  692    H    ILE  92           H        ILE  92  -3.147   5.963  -5.198
  693    HA   ILE  92           HA       ILE  92  -2.973   7.986  -3.291
  694    HB   ILE  92           HB       ILE  92  -0.988   7.215  -5.421
  695   1HG1  ILE  92          1HG1      ILE  92  -2.019   5.749  -3.460
  696   2HG1  ILE  92          2HG1      ILE  92  -0.367   5.422  -4.086
  697   1HG2  ILE  92          1HG2      ILE  92  -0.479   9.402  -4.555
  698   2HG2  ILE  92          2HG2      ILE  92   0.748   8.247  -3.998
  699   3HG2  ILE  92          3HG2      ILE  92  -0.533   8.803  -2.904
  700   1HD1  ILE  92          1HD1      ILE  92  -0.430   5.347  -1.727
  701   2HD1  ILE  92          2HD1      ILE  92  -1.409   6.818  -1.703
  702   3HD1  ILE  92          3HD1      ILE  92   0.309   6.902  -2.176
  703    H    LYS  93           H        LYS  93  -2.407   8.386  -6.775
  704    HA   LYS  93           HA       LYS  93  -2.027  11.150  -6.622
  705   1HB   LYS  93          1HB       LYS  93  -3.213   9.523  -8.883
  706   2HB   LYS  93          2HB       LYS  93  -2.737  11.208  -9.020
  707   1HG   LYS  93          1HG       LYS  93  -0.408  10.561  -8.486
  708   2HG   LYS  93          2HG       LYS  93  -0.917   8.873  -8.438
  709   1HD   LYS  93          1HD       LYS  93  -1.611   9.007 -10.773
  710   2HD   LYS  93          2HD       LYS  93  -1.144  10.707 -10.823
  711   1HE   LYS  93          1HE       LYS  93   0.724   8.384 -10.317
  712   2HE   LYS  93          2HE       LYS  93   0.554   9.241 -11.844
  713   1HZ   LYS  93          1HZ       LYS  93   1.339  11.271 -10.712
  714   2HZ   LYS  93          2HZ       LYS  93   2.466  10.037 -10.630
  715   3HZ   LYS  93          3HZ       LYS  93   1.554  10.401  -9.288
  716    H    LYS  94           H        LYS  94  -4.964   9.284  -7.081
  717    HA   LYS  94           HA       LYS  94  -6.585  11.574  -7.500
  718   1HB   LYS  94          1HB       LYS  94  -7.262   9.369  -8.334
  719   2HB   LYS  94          2HB       LYS  94  -7.268   8.750  -6.693
  720   1HG   LYS  94          1HG       LYS  94  -9.187  10.196  -6.177
  721   2HG   LYS  94          2HG       LYS  94  -9.181  10.780  -7.842
  722   1HD   LYS  94          1HD       LYS  94 -10.850   9.034  -7.577
  723   2HD   LYS  94          2HD       LYS  94  -9.559   8.474  -8.637
  724   1HE   LYS  94          1HE       LYS  94  -8.547   7.287  -6.679
  725   2HE   LYS  94          2HE       LYS  94  -9.932   7.791  -5.714
  726   1HZ   LYS  94          1HZ       LYS  94 -10.194   5.570  -6.497
  727   2HZ   LYS  94          2HZ       LYS  94  -9.968   6.045  -8.101
  728   3HZ   LYS  94          3HZ       LYS  94 -11.348   6.540  -7.255
  729    H    TYR  95           H        TYR  95  -5.683   9.638  -4.770
  730    HA   TYR  95           HA       TYR  95  -7.369  10.678  -2.854
  731   1HB   TYR  95          1HB       TYR  95  -6.129   8.683  -2.633
  732   2HB   TYR  95          2HB       TYR  95  -4.607   9.526  -2.774
  733    HD1  TYR  95           1HD      TYR  95  -4.183  11.230  -0.873
  734    HD2  TYR  95           2HD      TYR  95  -7.093   8.242  -0.655
  735    HE1  TYR  95           1HE      TYR  95  -4.236  11.535   1.563
  736    HE2  TYR  95           2HE      TYR  95  -7.167   8.437   1.807
  737    HH   TYR  95           HH       TYR  95  -6.099  10.897   3.464
  738    H    MET  96           H        MET  96  -4.026  11.550  -3.595
  739    HA   MET  96           HA       MET  96  -3.977  13.631  -1.756
  740   1HB   MET  96          1HB       MET  96  -2.191  13.274  -4.119
  741   2HB   MET  96          2HB       MET  96  -1.908  14.308  -2.713
  742   1HG   MET  96          1HG       MET  96  -2.325  12.019  -1.420
  743   2HG   MET  96          2HG       MET  96  -1.751  11.371  -2.964
  744   1HE   MET  96          1HE       MET  96  -0.580  14.734  -1.530
  745   2HE   MET  96          2HE       MET  96   0.584  14.215  -0.291
  746   3HE   MET  96          3HE       MET  96  -1.145  13.790  -0.152
  747    H    GLN  97           H        GLN  97  -5.191  13.533  -4.828
  748    HA   GLN  97           HA       GLN  97  -5.169  16.311  -5.480
  749   1HB   GLN  97          1HB       GLN  97  -7.459  14.491  -6.244
  750   2HB   GLN  97          2HB       GLN  97  -6.979  15.975  -7.044
  751   1HG   GLN  97          1HG       GLN  97  -5.594  13.327  -7.029
  752   2HG   GLN  97          2HG       GLN  97  -6.271  14.177  -8.408
  753   1HE2  GLN  97          1HE2      GLN  97  -3.672  13.800  -6.274
  754   2HE2  GLN  97          2HE2      GLN  97  -2.509  14.822  -6.992
  755    H    LYS  98           H        LYS  98  -6.915  14.596  -3.119
  756    HA   LYS  98           HA       LYS  98  -9.106  16.428  -2.836
  757   1HB   LYS  98          1HB       LYS  98  -9.772  15.146  -1.015
  758   2HB   LYS  98          2HB       LYS  98  -9.035  13.993  -2.110
  759   1HG   LYS  98          1HG       LYS  98  -7.359  13.461  -0.622
  760   2HG   LYS  98          2HG       LYS  98  -7.200  15.137  -0.151
  761   1HD   LYS  98          1HD       LYS  98  -9.470  13.326   0.667
  762   2HD   LYS  98          2HD       LYS  98  -8.012  13.558   1.616
  763   1HE   LYS  98          1HE       LYS  98  -9.770  14.939   2.512
  764   2HE   LYS  98          2HE       LYS  98  -8.537  15.973   1.815
  765   1HZ   LYS  98          1HZ       LYS  98 -10.869  16.636   1.487
  766   2HZ   LYS  98          2HZ       LYS  98 -11.126  15.321   0.456
  767   3HZ   LYS  98          3HZ       LYS  98 -10.027  16.535   0.062
  768    H    PHE  99           H        PHE  99  -5.855  16.450  -1.862
  769    HA   PHE  99           HA       PHE  99  -6.335  18.203   0.389
  770   1HB   PHE  99          1HB       PHE  99  -3.729  17.281  -0.838
  771   2HB   PHE  99          2HB       PHE  99  -3.875  18.303   0.590
  772    HD1  PHE  99           1HD      PHE  99  -5.551  17.254   2.414
  773    HD2  PHE  99           2HD      PHE  99  -3.281  15.071  -0.438
  774    HE1  PHE  99           1HE      PHE  99  -5.598  15.297   3.895
  775    HE2  PHE  99           2HE      PHE  99  -3.332  13.087   1.037
  776    HZ   PHE  99           HZ       PHE  99  -4.547  13.208   3.205
  777    H    GLY 100           H        GLY 100  -5.245  18.470  -2.929
  778   1HA   GLY 100          1HA       GLY 100  -5.631  20.393  -4.183
  779   2HA   GLY 100          2HA       GLY 100  -5.592  21.342  -2.698
  780    H    ALA 101           H        ALA 101  -3.866  22.450  -2.428
  781    HA   ALA 101           HA       ALA 101  -1.543  21.946  -4.082
  782   1HB   ALA 101          1HB       ALA 101  -2.398  24.212  -3.818
  783   2HB   ALA 101          2HB       ALA 101  -0.744  24.070  -3.203
  784   3HB   ALA 101          3HB       ALA 101  -2.113  24.114  -2.082
  785    H    VAL 102           H        VAL 102  -2.370  21.875  -0.637
  786    HA   VAL 102           HA       VAL 102   0.263  20.619  -0.185
  787    HB   VAL 102           HB       VAL 102  -1.063  21.981   2.080
  788   1HG1  VAL 102          1HG1      VAL 102   0.953  20.830   2.483
  789   2HG1  VAL 102          2HG1      VAL 102   1.193  22.557   2.767
  790   3HG1  VAL 102          3HG1      VAL 102   1.801  21.809   1.285
  791   1HG2  VAL 102          1HG2      VAL 102  -1.364  23.696   0.457
  792   2HG2  VAL 102          2HG2      VAL 102   0.337  23.620  -0.018
  793   3HG2  VAL 102          3HG2      VAL 102  -0.113  24.195   1.598
  794    H    TYR 103           H        TYR 103   0.333  19.097   1.464
  795    HA   TYR 103           HA       TYR 103  -2.051  17.572   1.589
  796   1HB   TYR 103          1HB       TYR 103  -0.188  16.213   1.170
  797   2HB   TYR 103          2HB       TYR 103   0.816  17.124   2.284
  798    HD1  TYR 103           1HD      TYR 103  -2.456  15.496   2.936
  799    HD2  TYR 103           2HD      TYR 103   1.676  15.522   3.656
  800    HE1  TYR 103           1HE      TYR 103  -2.782  13.822   4.644
  801    HE2  TYR 103           2HE      TYR 103   1.388  13.780   5.395
  802    HH   TYR 103           HH       TYR 103  -0.370  13.035   6.910
  803    H    LYS 104           H        LYS 104  -3.435  18.287   2.894
  804    HA   LYS 104           HA       LYS 104  -2.717  18.975   5.657
  805   1HB   LYS 104          1HB       LYS 104  -5.203  19.667   4.111
  806   2HB   LYS 104          2HB       LYS 104  -4.729  20.304   5.675
  807   1HG   LYS 104          1HG       LYS 104  -2.929  21.529   4.706
  808   2HG   LYS 104          2HG       LYS 104  -3.166  20.738   3.147
  809   1HD   LYS 104          1HD       LYS 104  -5.407  21.700   3.032
  810   2HD   LYS 104          2HD       LYS 104  -5.103  22.574   4.532
  811   1HE   LYS 104          1HE       LYS 104  -3.298  23.784   3.482
  812   2HE   LYS 104          2HE       LYS 104  -3.498  22.854   1.998
  813   1HZ   LYS 104          1HZ       LYS 104  -5.447  24.748   3.186
  814   2HZ   LYS 104          2HZ       LYS 104  -5.784  23.753   1.874
  815   3HZ   LYS 104          3HZ       LYS 104  -4.605  24.937   1.742
  816    HA   PRO 105           HA       PRO 105  -4.923  14.894   5.939
  817   1HB   PRO 105          1HB       PRO 105  -3.908  14.296   8.423
  818   2HB   PRO 105          2HB       PRO 105  -3.126  13.879   6.896
  819   1HG   PRO 105          1HG       PRO 105  -2.663  16.166   8.703
  820   2HG   PRO 105          2HG       PRO 105  -1.453  15.161   7.842
  821   1HD   PRO 105          1HD       PRO 105  -2.164  17.639   7.087
  822   2HD   PRO 105          2HD       PRO 105  -1.736  16.419   5.881
  823    H    LYS 106           H        LYS 106  -4.630  17.441   8.321
  824    HA   LYS 106           HA       LYS 106  -6.861  17.014   9.859
  825   1HB   LYS 106          1HB       LYS 106  -6.941  19.493  10.165
  826   2HB   LYS 106          2HB       LYS 106  -5.349  18.783  10.408
  827   1HG   LYS 106          1HG       LYS 106  -4.697  19.469   8.152
  828   2HG   LYS 106          2HG       LYS 106  -6.279  20.202   7.917
  829   1HD   LYS 106          1HD       LYS 106  -4.407  20.919  10.109
  830   2HD   LYS 106          2HD       LYS 106  -4.425  21.774   8.561
  831   1HE   LYS 106          1HE       LYS 106  -6.658  21.593  10.605
  832   2HE   LYS 106          2HE       LYS 106  -5.698  23.016  10.218
  833   1HZ   LYS 106          1HZ       LYS 106  -7.722  23.282   9.085
  834   2HZ   LYS 106          2HZ       LYS 106  -7.784  21.708   8.589
  835   3HZ   LYS 106          3HZ       LYS 106  -6.691  22.747   7.850
  836    H    GLU 107           H        GLU 107  -6.773  17.736   6.571
  837    HA   GLU 107           HA       GLU 107  -9.654  18.276   6.474
  838   1HB   GLU 107          1HB       GLU 107  -7.385  19.305   4.758
  839   2HB   GLU 107          2HB       GLU 107  -9.084  19.505   4.341
  840   1HG   GLU 107          1HG       GLU 107  -9.491  20.901   6.163
  841   2HG   GLU 107          2HG       GLU 107  -8.019  20.402   6.978
  842    H    ASP 108           H        ASP 108  -8.049  15.721   6.469
  843    HA   ASP 108           HA       ASP 108  -8.048  14.730   3.819
  844   1HB   ASP 108          1HB       ASP 108  -6.324  13.749   4.875
  845   2HB   ASP 108          2HB       ASP 108  -7.039  13.847   6.483
  846    H    THR 109           H        THR 109  -8.982  12.442   3.587
  847    HA   THR 109           HA       THR 109 -11.758  12.831   3.413
  848    HB   THR 109           HB       THR 109 -10.630  11.626   1.612
  849    HG1  THR 109           1HG      THR 109 -12.723  10.532   2.943
  850   1HG2  THR 109          1HG2      THR 109  -8.830  10.712   3.006
  851   2HG2  THR 109          2HG2      THR 109  -9.507   9.516   1.890
  852   3HG2  THR 109          3HG2      THR 109  -9.930   9.473   3.610
  Start of MODEL   14
    1    H    THR  10           H        THR  10  -2.326 -23.872   5.779
    2    HA   THR  10           HA       THR  10  -4.444 -22.370   7.023
    3    HB   THR  10           HB       THR  10  -2.578 -21.969   8.770
    4    HG1  THR  10           1HG      THR  10  -0.828 -23.110   8.616
    5   1HG2  THR  10          1HG2      THR  10  -3.651 -24.766   8.330
    6   2HG2  THR  10          2HG2      THR  10  -4.503 -23.460   9.152
    7   3HG2  THR  10          3HG2      THR  10  -3.029 -24.131   9.854
    8    H    SER  11           H        SER  11  -4.608 -20.888   5.393
    9    HA   SER  11           HA       SER  11  -2.487 -19.160   4.499
   10   1HB   SER  11          1HB       SER  11  -5.420 -18.747   4.531
   11   2HB   SER  11          2HB       SER  11  -4.225 -18.024   3.427
   12    HG   SER  11           HG       SER  11  -5.220 -19.750   2.347
   13    H    SER  12           H        SER  12  -4.147 -19.370   7.337
   14    HA   SER  12           HA       SER  12  -4.439 -16.726   8.044
   15   1HB   SER  12          1HB       SER  12  -4.453 -17.896  10.301
   16   2HB   SER  12          2HB       SER  12  -5.612 -18.406   9.046
   17    HG   SER  12           HG       SER  12  -4.344 -20.086  10.234
   18    H    GLU  13           H        GLU  13  -1.704 -19.143   8.647
   19    HA   GLU  13           HA       GLU  13  -0.206 -17.185   9.981
   20   1HB   GLU  13          1HB       GLU  13   1.478 -19.006  10.043
   21   2HB   GLU  13          2HB       GLU  13  -0.100 -19.512  10.637
   22   1HG   GLU  13          1HG       GLU  13  -0.562 -20.524   8.433
   23   2HG   GLU  13          2HG       GLU  13   1.042 -20.076   7.915
   24    H    LEU  14           H        LEU  14  -0.426 -18.533   6.821
   25    HA   LEU  14           HA       LEU  14   1.982 -17.738   5.618
   26   1HB   LEU  14          1HB       LEU  14   0.200 -19.255   4.746
   27   2HB   LEU  14          2HB       LEU  14  -0.757 -17.844   4.426
   28    HG   LEU  14           HG       LEU  14   0.914 -17.004   2.832
   29   1HD1  LEU  14          1HD1      LEU  14   2.295 -19.640   3.307
   30   2HD1  LEU  14          2HD1      LEU  14   2.912 -18.043   3.736
   31   3HD1  LEU  14          3HD1      LEU  14   2.685 -18.477   2.044
   32   1HD2  LEU  14          1HD2      LEU  14  -0.969 -18.310   2.041
   33   2HD2  LEU  14          2HD2      LEU  14  -0.057 -19.798   2.290
   34   3HD2  LEU  14          3HD2      LEU  14   0.469 -18.634   1.073
   35    H    ALA  15           H        ALA  15  -0.948 -16.287   6.233
   36    HA   ALA  15           HA       ALA  15  -0.509 -13.908   4.705
   37   1HB   ALA  15          1HB       ALA  15  -2.698 -14.686   4.885
   38   2HB   ALA  15          2HB       ALA  15  -2.553 -13.069   5.580
   39   3HB   ALA  15          3HB       ALA  15  -2.687 -14.487   6.647
   40    H    LYS  16           H        LYS  16  -0.073 -14.850   8.011
   41    HA   LYS  16           HA       LYS  16   0.126 -12.295   9.091
   42   1HB   LYS  16          1HB       LYS  16   1.564 -14.837   9.879
   43   2HB   LYS  16          2HB       LYS  16   1.637 -13.358  10.826
   44   1HG   LYS  16          1HG       LYS  16  -0.741 -13.438  11.212
   45   2HG   LYS  16          2HG       LYS  16  -0.892 -14.854  10.170
   46   1HD   LYS  16          1HD       LYS  16   0.504 -16.139  11.688
   47   2HD   LYS  16          2HD       LYS  16   0.728 -14.713  12.697
   48   1HE   LYS  16          1HE       LYS  16  -1.939 -16.004  12.145
   49   2HE   LYS  16          2HE       LYS  16  -0.965 -16.313  13.582
   50   1HZ   LYS  16          1HZ       LYS  16  -2.063 -13.671  12.781
   51   2HZ   LYS  16          2HZ       LYS  16  -1.148 -13.982  14.162
   52   3HZ   LYS  16          3HZ       LYS  16  -2.673 -14.658  14.001
   53    H    LYS  17           H        LYS  17   2.291 -14.313   7.333
   54    HA   LYS  17           HA       LYS  17   4.461 -12.430   7.379
   55   1HB   LYS  17          1HB       LYS  17   4.064 -15.080   5.997
   56   2HB   LYS  17          2HB       LYS  17   5.389 -14.027   5.551
   57   1HG   LYS  17          1HG       LYS  17   6.105 -15.782   7.088
   58   2HG   LYS  17          2HG       LYS  17   6.308 -14.191   7.801
   59   1HD   LYS  17          1HD       LYS  17   4.244 -14.529   9.102
   60   2HD   LYS  17          2HD       LYS  17   4.053 -16.122   8.371
   61   1HE   LYS  17          1HE       LYS  17   6.123 -16.868   9.352
   62   2HE   LYS  17          2HE       LYS  17   6.437 -15.263  10.006
   63   1HZ   LYS  17          1HZ       LYS  17   4.137 -16.994  10.783
   64   2HZ   LYS  17          2HZ       LYS  17   4.544 -15.499  11.459
   65   3HZ   LYS  17          3HZ       LYS  17   5.551 -16.806  11.658
   66    H    SER  18           H        SER  18   1.877 -13.349   5.026
   67    HA   SER  18           HA       SER  18   3.157 -11.980   2.961
   68   1HB   SER  18          1HB       SER  18   1.008 -12.128   1.747
   69   2HB   SER  18          2HB       SER  18   1.559 -13.700   2.388
   70    HG   SER  18           HG       SER  18  -0.726 -12.832   2.575
   71    H    LYS  19           H        LYS  19   0.573 -11.070   5.071
   72    HA   LYS  19           HA       LYS  19   0.003  -8.482   4.114
   73   1HB   LYS  19          1HB       LYS  19  -0.002  -9.415   6.976
   74   2HB   LYS  19          2HB       LYS  19  -0.776  -7.961   6.359
   75   1HG   LYS  19          1HG       LYS  19  -2.217  -9.311   4.961
   76   2HG   LYS  19          2HG       LYS  19  -1.451 -10.778   5.562
   77   1HD   LYS  19          1HD       LYS  19  -3.465 -10.530   6.770
   78   2HD   LYS  19          2HD       LYS  19  -2.094 -10.069   7.823
   79   1HE   LYS  19          1HE       LYS  19  -2.596  -7.757   7.530
   80   2HE   LYS  19          2HE       LYS  19  -3.851  -8.134   6.350
   81   1HZ   LYS  19          1HZ       LYS  19  -5.107  -9.221   8.096
   82   2HZ   LYS  19          2HZ       LYS  19  -4.782  -7.627   8.525
   83   3HZ   LYS  19          3HZ       LYS  19  -3.902  -8.879   9.222
   84    H    GLU  20           H        GLU  20   2.627  -9.532   6.105
   85    HA   GLU  20           HA       GLU  20   3.432  -6.825   6.625
   86   1HB   GLU  20          1HB       GLU  20   5.087  -9.297   6.969
   87   2HB   GLU  20          2HB       GLU  20   5.384  -7.702   7.663
   88   1HG   GLU  20          1HG       GLU  20   3.119  -7.901   8.647
   89   2HG   GLU  20          2HG       GLU  20   3.224  -9.598   8.190
   90    H    VAL  21           H        VAL  21   4.579  -9.409   4.551
   91    HA   VAL  21           HA       VAL  21   6.670  -7.888   3.356
   92    HB   VAL  21           HB       VAL  21   5.063 -10.211   2.221
   93   1HG1  VAL  21          1HG1      VAL  21   6.963 -10.537   0.702
   94   2HG1  VAL  21          2HG1      VAL  21   7.745  -9.108   1.379
   95   3HG1  VAL  21          3HG1      VAL  21   6.237  -8.941   0.482
   96   1HG2  VAL  21          1HG2      VAL  21   6.953 -11.617   2.908
   97   2HG2  VAL  21          2HG2      VAL  21   6.201 -10.817   4.291
   98   3HG2  VAL  21          3HG2      VAL  21   7.722 -10.210   3.641
   99    H    PHE  22           H        PHE  22   3.295  -8.288   2.728
  100    HA   PHE  22           HA       PHE  22   3.242  -6.872   0.228
  101   1HB   PHE  22          1HB       PHE  22   1.347  -8.215   0.492
  102   2HB   PHE  22          2HB       PHE  22   1.142  -7.753   2.181
  103    HD1  PHE  22           1HD      PHE  22   1.092  -6.193  -1.219
  104    HD2  PHE  22           2HD      PHE  22  -0.545  -6.284   2.687
  105    HE1  PHE  22           1HE      PHE  22  -0.446  -4.365  -1.815
  106    HE2  PHE  22           2HE      PHE  22  -2.078  -4.521   2.090
  107    HZ   PHE  22           HZ       PHE  22  -2.075  -3.545  -0.095
  108    H    ARG  23           H        ARG  23   2.315  -5.993   3.486
  109    HA   ARG  23           HA       ARG  23   1.851  -3.304   2.832
  110   1HB   ARG  23          1HB       ARG  23   1.826  -2.730   5.171
  111   2HB   ARG  23          2HB       ARG  23   1.097  -4.308   4.927
  112   1HG   ARG  23          1HG       ARG  23   2.376  -4.799   6.786
  113   2HG   ARG  23          2HG       ARG  23   3.507  -5.134   5.473
  114   1HD   ARG  23          1HD       ARG  23   4.535  -2.954   5.736
  115   2HD   ARG  23          2HD       ARG  23   3.455  -2.601   7.088
  116    HE   ARG  23           HE       ARG  23   4.994  -5.030   7.297
  117   1HH1  ARG  23          1HH1      ARG  23   4.953  -1.583   8.092
  118   2HH1  ARG  23          2HH1      ARG  23   5.935  -1.759   9.474
  119   1HH2  ARG  23          1HH2      ARG  23   6.408  -5.238   9.199
  120   2HH2  ARG  23          2HH2      ARG  23   6.757  -3.828  10.093
  121    H    LYS  24           H        LYS  24   4.912  -4.911   3.399
  122    HA   LYS  24           HA       LYS  24   6.329  -2.528   3.803
  123   1HB   LYS  24          1HB       LYS  24   7.218  -5.266   3.071
  124   2HB   LYS  24          2HB       LYS  24   8.336  -3.904   3.135
  125   1HG   LYS  24          1HG       LYS  24   7.559  -3.471   5.455
  126   2HG   LYS  24          2HG       LYS  24   6.633  -4.969   5.364
  127   1HD   LYS  24          1HD       LYS  24   8.695  -5.360   6.471
  128   2HD   LYS  24          2HD       LYS  24   8.712  -6.173   4.893
  129   1HE   LYS  24          1HE       LYS  24  10.095  -4.402   3.974
  130   2HE   LYS  24          2HE       LYS  24   9.988  -3.492   5.482
  131   1HZ   LYS  24          1HZ       LYS  24  12.076  -4.628   5.347
  132   2HZ   LYS  24          2HZ       LYS  24  11.329  -6.101   5.060
  133   3HZ   LYS  24          3HZ       LYS  24  11.162  -5.356   6.563
  134    H    GLU  25           H        GLU  25   5.655  -4.573   0.947
  135    HA   GLU  25           HA       GLU  25   7.330  -3.289  -0.886
  136   1HB   GLU  25          1HB       GLU  25   4.623  -4.410  -1.437
  137   2HB   GLU  25          2HB       GLU  25   5.978  -4.298  -2.542
  138   1HG   GLU  25          1HG       GLU  25   6.513  -5.799  -0.148
  139   2HG   GLU  25          2HG       GLU  25   5.166  -6.369  -1.135
  140    H    MET  26           H        MET  26   4.011  -3.080  -0.001
  141    HA   MET  26           HA       MET  26   3.287  -1.020  -1.812
  142   1HB   MET  26          1HB       MET  26   1.770  -2.611  -0.809
  143   2HB   MET  26          2HB       MET  26   2.010  -1.840   0.749
  144   1HG   MET  26          1HG       MET  26   0.156  -0.651   0.274
  145   2HG   MET  26          2HG       MET  26   1.228   0.284  -0.755
  146   1HE   MET  26          1HE       MET  26   0.174  -0.933  -4.355
  147   2HE   MET  26          2HE       MET  26   1.369  -1.894  -3.529
  148   3HE   MET  26          3HE       MET  26   1.439  -0.106  -3.457
  149    H    SER  27           H        SER  27   4.283  -0.932   1.502
  150    HA   SER  27           HA       SER  27   3.874   1.821   1.916
  151   1HB   SER  27          1HB       SER  27   5.984   0.080   3.226
  152   2HB   SER  27          2HB       SER  27   5.629   1.734   3.710
  153    HG   SER  27           HG       SER  27   3.816  -0.414   3.661
  154    H    GLN  28           H        GLN  28   6.576  -0.026   0.601
  155    HA   GLN  28           HA       GLN  28   8.253   2.278   0.450
  156   1HB   GLN  28          1HB       GLN  28   9.876   0.879  -0.490
  157   2HB   GLN  28          2HB       GLN  28   8.858  -0.134   0.569
  158   1HG   GLN  28          1HG       GLN  28   7.771  -1.078  -1.277
  159   2HG   GLN  28          2HG       GLN  28   8.623  -0.007  -2.380
  160   1HE2  GLN  28          1HE2      GLN  28  10.166  -1.560   0.349
  161   2HE2  GLN  28          2HE2      GLN  28  11.108  -2.655  -0.596
  162    H    PHE  29           H        PHE  29   6.356   0.514  -1.674
  163    HA   PHE  29           HA       PHE  29   6.710   1.905  -4.065
  164   1HB   PHE  29          1HB       PHE  29   5.504  -0.199  -3.983
  165   2HB   PHE  29          2HB       PHE  29   4.247   0.527  -2.993
  166    HD1  PHE  29           1HD      PHE  29   2.454   1.728  -3.964
  167    HD2  PHE  29           2HD      PHE  29   5.722   0.410  -6.337
  168    HE1  PHE  29           1HE      PHE  29   1.197   2.249  -5.983
  169    HE2  PHE  29           2HE      PHE  29   4.448   0.930  -8.351
  170    HZ   PHE  29           HZ       PHE  29   2.138   1.869  -8.132
  171    H    ILE  30           H        ILE  30   4.219   2.383  -1.609
  172    HA   ILE  30           HA       ILE  30   3.105   4.690  -2.719
  173    HB   ILE  30           HB       ILE  30   3.043   3.622   0.106
  174   1HG1  ILE  30          1HG1      ILE  30   0.892   3.790  -2.009
  175   2HG1  ILE  30          2HG1      ILE  30   1.908   2.379  -1.744
  176   1HG2  ILE  30          1HG2      ILE  30   1.486   5.967  -0.992
  177   2HG2  ILE  30          2HG2      ILE  30   2.812   6.074   0.143
  178   3HG2  ILE  30          3HG2      ILE  30   1.308   5.266   0.624
  179   1HD1  ILE  30          1HD1      ILE  30  -0.282   2.118  -0.694
  180   2HD1  ILE  30          2HD1      ILE  30  -0.006   3.550   0.280
  181   3HD1  ILE  30          3HD1      ILE  30   0.998   2.137   0.493
  182    H    VAL  31           H        VAL  31   5.597   4.286  -0.215
  183    HA   VAL  31           HA       VAL  31   6.132   6.948   0.204
  184    HB   VAL  31           HB       VAL  31   7.905   4.508   0.214
  185   1HG1  VAL  31          1HG1      VAL  31   9.358   6.435  -0.405
  186   2HG1  VAL  31          2HG1      VAL  31   9.728   5.805   1.196
  187   3HG1  VAL  31          3HG1      VAL  31   8.806   7.293   1.034
  188   1HG2  VAL  31          1HG2      VAL  31   6.916   6.365   2.366
  189   2HG2  VAL  31          2HG2      VAL  31   7.904   4.925   2.632
  190   3HG2  VAL  31          3HG2      VAL  31   6.265   4.781   1.981
  191    H    GLN  32           H        GLN  32   7.461   4.865  -2.368
  192    HA   GLN  32           HA       GLN  32   9.101   6.685  -3.561
  193   1HB   GLN  32          1HB       GLN  32   8.806   4.178  -3.949
  194   2HB   GLN  32          2HB       GLN  32   7.478   4.581  -5.001
  195   1HG   GLN  32          1HG       GLN  32  10.287   5.521  -5.438
  196   2HG   GLN  32          2HG       GLN  32   9.636   4.043  -6.120
  197   1HE2  GLN  32          1HE2      GLN  32  10.720   6.422  -7.404
  198   2HE2  GLN  32          2HE2      GLN  32   9.507   7.024  -8.462
  199    H    CYS  33           H        CYS  33   5.715   5.930  -4.060
  200    HA   CYS  33           HA       CYS  33   5.094   7.668  -6.182
  201   1HB   CYS  33          1HB       CYS  33   3.426   6.402  -4.060
  202   2HB   CYS  33          2HB       CYS  33   2.742   7.251  -5.449
  203    HG   CYS  33           HG       CYS  33   4.497   4.367  -5.310
  204    H    LEU  34           H        LEU  34   4.928   8.081  -2.702
  205    HA   LEU  34           HA       LEU  34   3.789  10.710  -2.894
  206   1HB   LEU  34          1HB       LEU  34   4.946   9.258  -0.541
  207   2HB   LEU  34          2HB       LEU  34   4.270  10.866  -0.447
  208    HG   LEU  34           HG       LEU  34   2.793   8.325  -1.112
  209   1HD1  LEU  34          1HD1      LEU  34   1.640   8.806   0.991
  210   2HD1  LEU  34          2HD1      LEU  34   2.693  10.196   1.245
  211   3HD1  LEU  34          3HD1      LEU  34   3.371   8.570   1.220
  212   1HD2  LEU  34          1HD2      LEU  34   0.775   9.735  -1.085
  213   2HD2  LEU  34          2HD2      LEU  34   1.851  10.159  -2.405
  214   3HD2  LEU  34          3HD2      LEU  34   1.787  11.175  -0.960
  215    H    ASN  35           H        ASN  35   7.026   9.473  -2.754
  216    HA   ASN  35           HA       ASN  35   8.489  11.446  -1.958
  217   1HB   ASN  35          1HB       ASN  35   8.946   9.457  -3.952
  218   2HB   ASN  35          2HB       ASN  35   9.971  10.898  -4.184
  219   1HD2  ASN  35          1HD2      ASN  35   8.765   8.683  -1.854
  220   2HD2  ASN  35          2HD2      ASN  35  10.026   8.938  -0.737
  221    HA   PRO  36           HA       PRO  36   8.229  14.246  -5.936
  222   1HB   PRO  36          1HB       PRO  36   5.936  14.018  -7.417
  223   2HB   PRO  36          2HB       PRO  36   7.447  13.205  -7.828
  224   1HG   PRO  36          1HG       PRO  36   5.039  12.137  -6.444
  225   2HG   PRO  36          2HG       PRO  36   6.062  11.370  -7.671
  226   1HD   PRO  36          1HD       PRO  36   6.256  10.786  -5.050
  227   2HD   PRO  36          2HD       PRO  36   7.667  10.747  -6.114
  228    H    TYR  37           H        TYR  37   5.755  13.398  -3.770
  229    HA   TYR  37           HA       TYR  37   4.396  15.940  -4.039
  230   1HB   TYR  37          1HB       TYR  37   3.855  13.604  -2.212
  231   2HB   TYR  37          2HB       TYR  37   2.893  15.075  -2.271
  232    HD1  TYR  37           1HD      TYR  37   3.939  12.124  -4.200
  233    HD2  TYR  37           2HD      TYR  37   1.237  15.363  -3.927
  234    HE1  TYR  37           1HE      TYR  37   2.582  11.097  -5.936
  235    HE2  TYR  37           2HE      TYR  37  -0.152  14.377  -5.673
  236    HH   TYR  37           HH       TYR  37   0.082  12.782  -7.518
  237    H    ARG  38           H        ARG  38   6.784  14.448  -2.077
  238    HA   ARG  38           HA       ARG  38   6.444  16.480  -0.021
  239   1HB   ARG  38          1HB       ARG  38   8.228  15.396   1.187
  240   2HB   ARG  38          2HB       ARG  38   7.044  14.210   0.669
  241   1HG   ARG  38          1HG       ARG  38   8.463  13.494  -1.105
  242   2HG   ARG  38          2HG       ARG  38   9.630  14.761  -0.742
  243   1HD   ARG  38          1HD       ARG  38   9.843  13.779   1.561
  244   2HD   ARG  38          2HD       ARG  38   8.773  12.488   1.004
  245    HE   ARG  38           HE       ARG  38  10.489  11.638  -0.336
  246   1HH1  ARG  38          1HH1      ARG  38  11.615  14.515   1.399
  247   2HH1  ARG  38          2HH1      ARG  38  13.233  14.007   1.447
  248   1HH2  ARG  38          1HH2      ARG  38  12.679  10.956  -0.249
  249   2HH2  ARG  38          2HH2      ARG  38  13.874  11.925   0.493
  250    H    LYS  39           H        LYS  39   7.736  16.413  -2.900
  251    HA   LYS  39           HA       LYS  39  10.210  17.851  -2.536
  252   1HB   LYS  39          1HB       LYS  39   8.404  17.754  -4.967
  253   2HB   LYS  39          2HB       LYS  39  10.087  18.248  -4.942
  254   1HG   LYS  39          1HG       LYS  39   9.071  15.485  -4.342
  255   2HG   LYS  39          2HG       LYS  39   9.760  16.003  -5.878
  256   1HD   LYS  39          1HD       LYS  39  11.866  16.496  -4.750
  257   2HD   LYS  39          2HD       LYS  39  11.143  15.993  -3.214
  258   1HE   LYS  39          1HE       LYS  39  10.806  13.768  -4.031
  259   2HE   LYS  39          2HE       LYS  39  11.382  14.215  -5.634
  260   1HZ   LYS  39          1HZ       LYS  39  13.568  14.620  -4.700
  261   2HZ   LYS  39          2HZ       LYS  39  13.102  13.038  -4.378
  262   3HZ   LYS  39          3HZ       LYS  39  13.056  14.196  -3.160
  263    HA   PRO  40           HA       PRO  40   8.236  21.771  -1.621
  264   1HB   PRO  40          1HB       PRO  40  10.139  23.474  -2.513
  265   2HB   PRO  40          2HB       PRO  40  10.245  22.598  -0.982
  266   1HG   PRO  40          1HG       PRO  40  11.516  21.948  -3.625
  267   2HG   PRO  40          2HG       PRO  40  12.229  21.869  -2.004
  268   1HD   PRO  40          1HD       PRO  40  11.341  19.669  -3.273
  269   2HD   PRO  40          2HD       PRO  40  11.187  19.856  -1.510
  270    H    ASP  41           H        ASP  41   8.932  20.700  -4.699
  271    HA   ASP  41           HA       ASP  41   7.885  23.026  -6.109
  272   1HB   ASP  41          1HB       ASP  41   9.979  22.124  -6.945
  273   2HB   ASP  41          2HB       ASP  41   9.304  20.509  -7.025
  274    H    CYS  42           H        CYS  42   6.724  20.442  -4.641
  275    HA   CYS  42           HA       CYS  42   4.959  19.361  -6.600
  276   1HB   CYS  42          1HB       CYS  42   5.599  18.112  -4.523
  277   2HB   CYS  42          2HB       CYS  42   4.582  19.227  -3.636
  278    HG   CYS  42           HG       CYS  42   2.413  17.812  -3.927
  279    H    LYS  43           H        LYS  43   3.175  20.047  -7.342
  280    HA   LYS  43           HA       LYS  43   2.091  22.574  -6.510
  281   1HB   LYS  43          1HB       LYS  43   2.418  22.151  -8.860
  282   2HB   LYS  43          2HB       LYS  43   1.454  20.692  -8.767
  283   1HG   LYS  43          1HG       LYS  43  -0.538  22.007  -8.348
  284   2HG   LYS  43          2HG       LYS  43   0.420  23.490  -8.367
  285   1HD   LYS  43          1HD       LYS  43   1.049  23.091 -10.664
  286   2HD   LYS  43          2HD       LYS  43   0.186  21.554 -10.659
  287   1HE   LYS  43          1HE       LYS  43  -1.914  22.691 -10.333
  288   2HE   LYS  43          2HE       LYS  43  -1.087  24.240 -10.191
  289   1HZ   LYS  43          1HZ       LYS  43  -1.113  22.536 -12.628
  290   2HZ   LYS  43          2HZ       LYS  43  -0.407  24.085 -12.465
  291   3HZ   LYS  43          3HZ       LYS  43  -2.073  23.893 -12.352
  292    H    VAL  44           H        VAL  44   1.197  19.176  -6.398
  293    HA   VAL  44           HA       VAL  44  -1.273  19.990  -5.094
  294    HB   VAL  44           HB       VAL  44  -1.806  19.392  -7.415
  295   1HG1  VAL  44          1HG1      VAL  44  -0.046  17.838  -7.913
  296   2HG1  VAL  44          2HG1      VAL  44  -1.621  17.096  -8.225
  297   3HG1  VAL  44          3HG1      VAL  44  -0.718  16.674  -6.773
  298   1HG2  VAL  44          1HG2      VAL  44  -3.489  19.006  -5.715
  299   2HG2  VAL  44          2HG2      VAL  44  -2.834  17.399  -5.408
  300   3HG2  VAL  44          3HG2      VAL  44  -3.582  17.765  -6.967
  301    H    GLY  45           H        GLY  45  -1.512  19.155  -3.234
  302   1HA   GLY  45          1HA       GLY  45  -1.426  17.716  -1.442
  303   2HA   GLY  45          2HA       GLY  45  -1.024  16.422  -2.567
  304    H    ARG  46           H        ARG  46   0.878  19.501  -1.899
  305    HA   ARG  46           HA       ARG  46   3.199  17.992  -1.787
  306   1HB   ARG  46          1HB       ARG  46   3.082  20.369  -2.548
  307   2HB   ARG  46          2HB       ARG  46   2.709  20.811  -0.878
  308   1HG   ARG  46          1HG       ARG  46   4.785  20.143  -0.087
  309   2HG   ARG  46          2HG       ARG  46   5.175  19.272  -1.565
  310   1HD   ARG  46          1HD       ARG  46   6.448  21.247  -1.525
  311   2HD   ARG  46          2HD       ARG  46   5.204  21.455  -2.746
  312    HE   ARG  46           HE       ARG  46   4.184  23.050  -1.425
  313   1HH1  ARG  46          1HH1      ARG  46   6.962  21.694   0.301
  314   2HH1  ARG  46          2HH1      ARG  46   7.267  23.095   1.201
  315   1HH2  ARG  46          1HH2      ARG  46   4.527  24.915  -0.167
  316   2HH2  ARG  46          2HH2      ARG  46   5.813  25.008   0.957
  317    H    ILE  47           H        ILE  47   3.983  17.007  -0.239
  318    HA   ILE  47           HA       ILE  47   2.722  16.939   2.310
  319    HB   ILE  47           HB       ILE  47   5.235  15.438   1.460
  320   1HG1  ILE  47          1HG1      ILE  47   2.301  14.639   1.467
  321   2HG1  ILE  47          2HG1      ILE  47   3.259  15.029   0.046
  322   1HG2  ILE  47          1HG2      ILE  47   5.199  15.545   3.767
  323   2HG2  ILE  47          2HG2      ILE  47   4.569  13.957   3.294
  324   3HG2  ILE  47          3HG2      ILE  47   3.483  15.206   3.861
  325   1HD1  ILE  47          1HD1      ILE  47   3.830  12.751   1.904
  326   2HD1  ILE  47          2HD1      ILE  47   4.616  13.109   0.354
  327   3HD1  ILE  47          3HD1      ILE  47   2.921  12.634   0.401
  328    H    THR  48           H        THR  48   3.023  18.060   3.913
  329    HA   THR  48           HA       THR  48   4.720  20.222   4.136
  330    HB   THR  48           HB       THR  48   3.722  20.220   6.452
  331    HG1  THR  48           1HG      THR  48   2.664  18.430   7.028
  332   1HG2  THR  48          1HG2      THR  48   2.699  21.321   4.500
  333   2HG2  THR  48          2HG2      THR  48   1.477  20.602   5.593
  334   3HG2  THR  48          3HG2      THR  48   1.978  19.748   4.115
  335    H    THR  49           H        THR  49   4.660  17.165   5.949
  336    HA   THR  49           HA       THR  49   7.382  17.784   6.924
  337    HB   THR  49           HB       THR  49   5.369  16.251   8.543
  338    HG1  THR  49           1HG      THR  49   4.269  17.956   8.699
  339   1HG2  THR  49          1HG2      THR  49   6.709  17.023  10.423
  340   2HG2  THR  49          2HG2      THR  49   7.715  17.978   9.336
  341   3HG2  THR  49          3HG2      THR  49   7.725  16.215   9.229
  342    H    THR  50           H        THR  50   8.677  15.948   7.203
  343    HA   THR  50           HA       THR  50   8.357  13.656   5.660
  344    HB   THR  50           HB       THR  50  10.383  14.651   6.593
  345    HG1  THR  50           1HG      THR  50  11.267  12.823   6.207
  346   1HG2  THR  50          1HG2      THR  50   9.650  15.028   8.837
  347   2HG2  THR  50          2HG2      THR  50  11.159  14.090   8.865
  348   3HG2  THR  50          3HG2      THR  50   9.594  13.299   9.162
  349    H    GLU  51           H        GLU  51   7.565  14.313   9.055
  350    HA   GLU  51           HA       GLU  51   6.580  11.773   9.759
  351   1HB   GLU  51          1HB       GLU  51   5.974  14.524  10.809
  352   2HB   GLU  51          2HB       GLU  51   5.286  13.059  11.504
  353   1HG   GLU  51          1HG       GLU  51   8.227  13.591  11.236
  354   2HG   GLU  51          2HG       GLU  51   7.276  13.882  12.697
  355    H    ASP  52           H        ASP  52   4.995  14.492   8.073
  356    HA   ASP  52           HA       ASP  52   2.410  13.325   8.189
  357   1HB   ASP  52          1HB       ASP  52   3.777  15.562   6.742
  358   2HB   ASP  52          2HB       ASP  52   2.197  15.030   6.226
  359    H    PHE  53           H        PHE  53   5.145  13.357   6.003
  360    HA   PHE  53           HA       PHE  53   4.020  12.001   3.852
  361   1HB   PHE  53          1HB       PHE  53   6.253  13.123   3.790
  362   2HB   PHE  53          2HB       PHE  53   6.820  12.014   5.014
  363    HD1  PHE  53           1HD      PHE  53   7.341   9.697   4.438
  364    HD2  PHE  53           2HD      PHE  53   6.110  12.504   1.524
  365    HE1  PHE  53           1HE      PHE  53   8.148   8.212   2.689
  366    HE2  PHE  53           2HE      PHE  53   6.913  11.022  -0.252
  367    HZ   PHE  53           HZ       PHE  53   7.931   8.888   0.306
  368    H    LYS  54           H        LYS  54   5.792  10.814   6.582
  369    HA   LYS  54           HA       LYS  54   5.631   7.994   6.138
  370   1HB   LYS  54          1HB       LYS  54   6.027   9.650   8.606
  371   2HB   LYS  54          2HB       LYS  54   6.047   7.887   8.634
  372   1HG   LYS  54          1HG       LYS  54   7.922   7.814   7.182
  373   2HG   LYS  54          2HG       LYS  54   7.810   9.536   6.856
  374   1HD   LYS  54          1HD       LYS  54   9.665   8.986   8.363
  375   2HD   LYS  54          2HD       LYS  54   8.487  10.043   9.128
  376   1HE   LYS  54          1HE       LYS  54   8.342   7.078   9.532
  377   2HE   LYS  54          2HE       LYS  54   9.520   8.021  10.436
  378   1HZ   LYS  54          1HZ       LYS  54   6.555   8.373  10.502
  379   2HZ   LYS  54          2HZ       LYS  54   7.672   9.406  11.220
  380   3HZ   LYS  54          3HZ       LYS  54   7.566   7.810  11.743
  381    H    HIS  55           H        HIS  55   3.464  10.197   7.864
  382    HA   HIS  55           HA       HIS  55   1.709   8.212   8.955
  383   1HB   HIS  55          1HB       HIS  55   1.941  10.592   9.768
  384   2HB   HIS  55          2HB       HIS  55   1.284  11.133   8.250
  385    HD1  HIS  55           1HD      HIS  55   0.271  10.098  11.622
  386    HD2  HIS  55           2HD      HIS  55  -1.550  10.504   7.899
  387    HE1  HIS  55           1HE      HIS  55  -2.174  10.110  12.079
  388    H    LEU  56           H        LEU  56   1.589  10.239   6.080
  389    HA   LEU  56           HA       LEU  56  -0.886   9.184   5.158
  390   1HB   LEU  56          1HB       LEU  56   0.767  11.245   4.416
  391   2HB   LEU  56          2HB       LEU  56   0.951  10.117   3.103
  392    HG   LEU  56           HG       LEU  56  -1.229  11.831   3.912
  393   1HD1  LEU  56          1HD1      LEU  56   0.123  12.294   2.047
  394   2HD1  LEU  56          2HD1      LEU  56  -1.553  12.129   1.600
  395   3HD1  LEU  56          3HD1      LEU  56  -0.411  10.824   1.236
  396   1HD2  LEU  56          1HD2      LEU  56  -1.898   9.143   2.716
  397   2HD2  LEU  56          2HD2      LEU  56  -3.000  10.519   2.866
  398   3HD2  LEU  56          3HD2      LEU  56  -2.421   9.736   4.295
  399    H    ALA  57           H        ALA  57   2.519   8.405   4.310
  400    HA   ALA  57           HA       ALA  57   1.875   6.577   2.328
  401   1HB   ALA  57          1HB       ALA  57   4.180   7.459   2.747
  402   2HB   ALA  57          2HB       ALA  57   4.130   5.704   2.594
  403   3HB   ALA  57          3HB       ALA  57   4.255   6.444   4.187
  404    H    ARG  58           H        ARG  58   2.143   6.156   5.755
  405    HA   ARG  58           HA       ARG  58   1.795   3.322   5.531
  406   1HB   ARG  58          1HB       ARG  58   1.772   3.192   7.932
  407   2HB   ARG  58          2HB       ARG  58   2.962   4.388   7.466
  408   1HG   ARG  58          1HG       ARG  58   1.291   6.151   7.994
  409   2HG   ARG  58          2HG       ARG  58   0.255   4.876   8.650
  410   1HD   ARG  58          1HD       ARG  58   2.139   4.196  10.112
  411   2HD   ARG  58          2HD       ARG  58   3.024   5.603   9.516
  412    HE   ARG  58           HE       ARG  58   0.457   6.201  10.615
  413   1HH1  ARG  58          1HH1      ARG  58   3.944   6.015  11.244
  414   2HH1  ARG  58          2HH1      ARG  58   3.847   6.658  12.817
  415   1HH2  ARG  58          1HH2      ARG  58   0.331   7.103  12.819
  416   2HH2  ARG  58          2HH2      ARG  58   1.754   7.296  13.729
  417    H    LYS  59           H        LYS  59  -0.410   6.008   6.157
  418    HA   LYS  59           HA       LYS  59  -2.636   4.407   6.712
  419   1HB   LYS  59          1HB       LYS  59  -2.653   6.801   7.247
  420   2HB   LYS  59          2HB       LYS  59  -2.630   7.199   5.531
  421   1HG   LYS  59          1HG       LYS  59  -4.796   6.179   5.219
  422   2HG   LYS  59          2HG       LYS  59  -4.818   5.641   6.892
  423   1HD   LYS  59          1HD       LYS  59  -4.808   8.037   7.591
  424   2HD   LYS  59          2HD       LYS  59  -4.928   8.485   5.884
  425   1HE   LYS  59          1HE       LYS  59  -7.015   7.338   5.653
  426   2HE   LYS  59          2HE       LYS  59  -6.869   6.647   7.262
  427   1HZ   LYS  59          1HZ       LYS  59  -8.377   8.354   7.414
  428   2HZ   LYS  59          2HZ       LYS  59  -7.471   9.480   6.549
  429   3HZ   LYS  59          3HZ       LYS  59  -6.983   8.995   8.101
  430    H    LEU  60           H        LEU  60  -1.443   5.758   3.667
  431    HA   LEU  60           HA       LEU  60  -3.547   4.987   2.143
  432   1HB   LEU  60          1HB       LEU  60  -0.683   5.389   1.368
  433   2HB   LEU  60          2HB       LEU  60  -1.981   5.299   0.167
  434    HG   LEU  60           HG       LEU  60  -2.081   7.173   2.437
  435   1HD1  LEU  60          1HD1      LEU  60  -0.051   7.776   1.362
  436   2HD1  LEU  60          2HD1      LEU  60  -1.254   8.927   0.745
  437   3HD1  LEU  60          3HD1      LEU  60  -0.730   7.566  -0.236
  438   1HD2  LEU  60          1HD2      LEU  60  -3.600   8.406   0.935
  439   2HD2  LEU  60          2HD2      LEU  60  -4.120   6.750   1.286
  440   3HD2  LEU  60          3HD2      LEU  60  -3.381   7.132  -0.270
  441    H    THR  61           H        THR  61  -0.494   3.446   2.904
  442    HA   THR  61           HA       THR  61  -0.631   1.064   1.445
  443    HB   THR  61           HB       THR  61   0.429   1.458   4.269
  444    HG1  THR  61           1HG      THR  61   1.516   2.783   2.800
  445   1HG2  THR  61          1HG2      THR  61   0.108  -0.921   3.760
  446   2HG2  THR  61          2HG2      THR  61   1.826  -0.526   3.818
  447   3HG2  THR  61          3HG2      THR  61   1.020  -0.731   2.265
  448    H    HIS  62           H        HIS  62  -1.968   1.999   4.484
  449    HA   HIS  62           HA       HIS  62  -3.044  -0.568   5.056
  450   1HB   HIS  62          1HB       HIS  62  -2.443   1.005   6.856
  451   2HB   HIS  62          2HB       HIS  62  -3.653   2.128   6.265
  452    HD1  HIS  62           1HD      HIS  62  -3.219  -0.902   8.390
  453    HD2  HIS  62           2HD      HIS  62  -6.321   1.515   7.049
  454    HE1  HIS  62           1HE      HIS  62  -5.164  -1.454   9.853
  455    H    GLY  63           H        GLY  63  -4.412   2.270   3.488
  456   1HA   GLY  63          1HA       GLY  63  -7.049   1.210   3.565
  457   2HA   GLY  63          2HA       GLY  63  -6.571   2.577   2.605
  458    H    VAL  64           H        VAL  64  -4.470   1.095   1.138
  459    HA   VAL  64           HA       VAL  64  -6.127  -0.074  -0.935
  460    HB   VAL  64           HB       VAL  64  -3.110  -0.287  -0.528
  461   1HG1  VAL  64          1HG1      VAL  64  -3.966  -2.088  -1.998
  462   2HG1  VAL  64          2HG1      VAL  64  -2.997  -0.955  -2.910
  463   3HG1  VAL  64          3HG1      VAL  64  -4.744  -0.885  -3.016
  464   1HG2  VAL  64          1HG2      VAL  64  -4.714   1.575  -2.281
  465   2HG2  VAL  64          2HG2      VAL  64  -2.958   1.437  -2.280
  466   3HG2  VAL  64          3HG2      VAL  64  -3.797   2.025  -0.840
  467    H    MET  65           H        MET  65  -4.231  -1.142   1.566
  468    HA   MET  65           HA       MET  65  -4.123  -3.936   1.164
  469   1HB   MET  65          1HB       MET  65  -2.646  -2.820   2.767
  470   2HB   MET  65          2HB       MET  65  -4.015  -2.325   3.704
  471   1HG   MET  65          1HG       MET  65  -4.456  -4.434   4.488
  472   2HG   MET  65          2HG       MET  65  -3.313  -5.208   3.393
  473   1HE   MET  65          1HE       MET  65  -2.480  -6.341   5.774
  474   2HE   MET  65          2HE       MET  65  -3.559  -5.219   6.602
  475   3HE   MET  65          3HE       MET  65  -1.871  -5.339   7.110
  476    H    ASN  66           H        ASN  66  -6.216  -2.003   3.213
  477    HA   ASN  66           HA       ASN  66  -7.882  -4.135   4.018
  478   1HB   ASN  66          1HB       ASN  66  -7.751  -1.250   4.347
  479   2HB   ASN  66          2HB       ASN  66  -9.374  -1.870   4.517
  480   1HD2  ASN  66          1HD2      ASN  66  -6.176  -1.691   5.718
  481   2HD2  ASN  66          2HD2      ASN  66  -6.452  -2.461   7.248
  482    H    LYS  67           H        LYS  67  -8.143  -1.902   1.374
  483    HA   LYS  67           HA       LYS  67 -10.763  -2.760   0.773
  484   1HB   LYS  67          1HB       LYS  67  -8.798  -1.307  -0.984
  485   2HB   LYS  67          2HB       LYS  67 -10.444  -1.686  -1.471
  486   1HG   LYS  67          1HG       LYS  67 -11.262  -0.392   0.492
  487   2HG   LYS  67          2HG       LYS  67  -9.592   0.081   0.809
  488   1HD   LYS  67          1HD       LYS  67  -9.479   1.067  -1.440
  489   2HD   LYS  67          2HD       LYS  67 -11.167   0.649  -1.695
  490   1HE   LYS  67          1HE       LYS  67 -11.023   2.974  -1.045
  491   2HE   LYS  67          2HE       LYS  67 -11.786   2.052   0.250
  492   1HZ   LYS  67          1HZ       LYS  67  -8.958   2.937   0.168
  493   2HZ   LYS  67          2HZ       LYS  67  -9.680   2.057   1.433
  494   3HZ   LYS  67          3HZ       LYS  67 -10.188   3.625   1.099
  495    H    GLU  68           H        GLU  68  -7.574  -3.919  -0.390
  496    HA   GLU  68           HA       GLU  68  -9.038  -5.636  -2.051
  497   1HB   GLU  68          1HB       GLU  68  -6.943  -6.664  -2.593
  498   2HB   GLU  68          2HB       GLU  68  -6.998  -4.898  -2.786
  499   1HG   GLU  68          1HG       GLU  68  -5.673  -4.620  -0.823
  500   2HG   GLU  68          2HG       GLU  68  -5.560  -6.361  -0.565
  501    H    LEU  69           H        LEU  69  -7.508  -6.006   1.131
  502    HA   LEU  69           HA       LEU  69  -8.113  -8.643   1.441
  503   1HB   LEU  69          1HB       LEU  69  -8.118  -6.343   3.355
  504   2HB   LEU  69          2HB       LEU  69  -8.539  -7.955   3.888
  505    HG   LEU  69           HG       LEU  69  -5.917  -7.327   2.540
  506   1HD1  LEU  69          1HD1      LEU  69  -6.528  -7.484   5.495
  507   2HD1  LEU  69          2HD1      LEU  69  -6.121  -6.018   4.594
  508   3HD1  LEU  69          3HD1      LEU  69  -4.935  -7.303   4.754
  509   1HD2  LEU  69          1HD2      LEU  69  -7.019  -9.649   4.100
  510   2HD2  LEU  69          2HD2      LEU  69  -5.320  -9.444   3.792
  511   3HD2  LEU  69          3HD2      LEU  69  -6.435  -9.649   2.431
  512    H    LYS  70           H        LYS  70 -10.411  -5.930   1.445
  513    HA   LYS  70           HA       LYS  70 -12.506  -7.657   2.405
  514   1HB   LYS  70          1HB       LYS  70 -13.939  -5.770   2.315
  515   2HB   LYS  70          2HB       LYS  70 -12.387  -5.210   2.922
  516   1HG   LYS  70          1HG       LYS  70 -11.848  -4.451   0.658
  517   2HG   LYS  70          2HG       LYS  70 -13.482  -4.876   0.185
  518   1HD   LYS  70          1HD       LYS  70 -12.701  -2.865   2.263
  519   2HD   LYS  70          2HD       LYS  70 -13.295  -2.583   0.608
  520   1HE   LYS  70          1HE       LYS  70 -15.432  -3.602   1.183
  521   2HE   LYS  70          2HE       LYS  70 -14.848  -3.934   2.813
  522   1HZ   LYS  70          1HZ       LYS  70 -15.208  -1.239   1.631
  523   2HZ   LYS  70          2HZ       LYS  70 -14.648  -1.550   3.180
  524   3HZ   LYS  70          3HZ       LYS  70 -16.217  -1.961   2.759
  525    H    TYR  71           H        TYR  71 -11.267  -6.636  -0.691
  526    HA   TYR  71           HA       TYR  71 -13.583  -7.800  -2.052
  527   1HB   TYR  71          1HB       TYR  71 -11.108  -6.453  -3.140
  528   2HB   TYR  71          2HB       TYR  71 -12.414  -7.080  -4.141
  529    HD1  TYR  71           1HD      TYR  71 -11.879  -4.361  -4.620
  530    HD2  TYR  71           2HD      TYR  71 -14.112  -5.977  -1.383
  531    HE1  TYR  71           1HE      TYR  71 -13.096  -2.235  -4.362
  532    HE2  TYR  71           2HE      TYR  71 -15.272  -3.995  -1.090
  533    HH   TYR  71           HH       TYR  71 -15.100  -1.406  -3.467
  534    H    CYS  72           H        CYS  72 -10.353  -8.706  -1.323
  535    HA   CYS  72           HA       CYS  72 -10.401 -10.968  -3.102
  536   1HB   CYS  72          1HB       CYS  72  -8.431  -9.906  -1.115
  537   2HB   CYS  72          2HB       CYS  72  -8.145 -11.442  -1.904
  538    HG   CYS  72           HG       CYS  72  -7.194 -10.501  -4.047
  539    H    LYS  73           H        LYS  73 -10.420 -10.414   0.427
  540    HA   LYS  73           HA       LYS  73 -11.017 -11.657   2.190
  541   1HB   LYS  73          1HB       LYS  73 -12.416 -13.444   0.174
  542   2HB   LYS  73          2HB       LYS  73 -12.603 -13.564   1.913
  543   1HG   LYS  73          1HG       LYS  73 -13.374 -11.169   0.244
  544   2HG   LYS  73          2HG       LYS  73 -14.489 -12.405   0.825
  545   1HD   LYS  73          1HD       LYS  73 -13.842 -11.814   3.155
  546   2HD   LYS  73          2HD       LYS  73 -12.832 -10.525   2.502
  547   1HE   LYS  73          1HE       LYS  73 -15.002  -9.676   3.268
  548   2HE   LYS  73          2HE       LYS  73 -14.770  -9.436   1.540
  549   1HZ   LYS  73          1HZ       LYS  73 -16.317 -11.693   2.698
  550   2HZ   LYS  73          2HZ       LYS  73 -16.274 -11.227   1.072
  551   3HZ   LYS  73          3HZ       LYS  73 -17.003 -10.247   2.218
  552    H    ASN  74           H        ASN  74  -8.859 -12.618   0.027
  553    HA   ASN  74           HA       ASN  74  -7.938 -14.924   1.600
  554   1HB   ASN  74          1HB       ASN  74  -7.931 -14.645  -1.426
  555   2HB   ASN  74          2HB       ASN  74  -7.047 -15.881  -0.562
  556   1HD2  ASN  74          1HD2      ASN  74  -9.209 -16.449   1.362
  557   2HD2  ASN  74          2HD2      ASN  74 -10.408 -17.264   0.441
  558    HA   PRO  75           HA       PRO  75  -4.536 -11.919   1.353
  559   1HB   PRO  75          1HB       PRO  75  -3.048 -12.990   3.112
  560   2HB   PRO  75          2HB       PRO  75  -4.241 -11.711   3.376
  561   1HG   PRO  75          1HG       PRO  75  -4.442 -14.709   4.047
  562   2HG   PRO  75          2HG       PRO  75  -5.250 -13.391   4.903
  563   1HD   PRO  75          1HD       PRO  75  -6.420 -15.074   3.090
  564   2HD   PRO  75          2HD       PRO  75  -7.020 -13.449   3.467
  565    H    GLU  76           H        GLU  76  -4.360 -15.289   1.099
  566    HA   GLU  76           HA       GLU  76  -1.683 -15.320   0.178
  567   1HB   GLU  76          1HB       GLU  76  -2.969 -17.381   0.820
  568   2HB   GLU  76          2HB       GLU  76  -3.918 -17.178  -0.643
  569   1HG   GLU  76          1HG       GLU  76  -1.785 -17.387  -1.935
  570   2HG   GLU  76          2HG       GLU  76  -0.997 -17.839  -0.423
  571    H    ASP  77           H        ASP  77  -4.271 -13.786  -0.884
  572    HA   ASP  77           HA       ASP  77  -3.359 -13.614  -3.696
  573   1HB   ASP  77          1HB       ASP  77  -5.743 -14.471  -3.385
  574   2HB   ASP  77          2HB       ASP  77  -6.096 -12.949  -2.579
  575    H    LEU  78           H        LEU  78  -3.020 -12.234  -0.754
  576    HA   LEU  78           HA       LEU  78  -3.278  -9.520  -1.596
  577   1HB   LEU  78          1HB       LEU  78  -4.086 -10.239   0.567
  578   2HB   LEU  78          2HB       LEU  78  -2.501 -10.934   0.897
  579    HG   LEU  78           HG       LEU  78  -1.547  -8.799   0.836
  580   1HD1  LEU  78          1HD1      LEU  78  -4.416  -7.805   0.709
  581   2HD1  LEU  78          2HD1      LEU  78  -3.186  -7.575  -0.532
  582   3HD1  LEU  78          3HD1      LEU  78  -3.032  -6.759   1.021
  583   1HD2  LEU  78          1HD2      LEU  78  -2.081  -9.731   2.922
  584   2HD2  LEU  78          2HD2      LEU  78  -3.735  -9.113   2.832
  585   3HD2  LEU  78          3HD2      LEU  78  -2.381  -7.995   3.008
  586    H    GLU  79           H        GLU  79  -1.664  -9.062  -2.864
  587    HA   GLU  79           HA       GLU  79   1.156  -9.507  -2.185
  588   1HB   GLU  79          1HB       GLU  79   0.371 -11.224  -3.834
  589   2HB   GLU  79          2HB       GLU  79  -0.383  -9.881  -4.699
  590   1HG   GLU  79          1HG       GLU  79   1.505 -10.573  -5.840
  591   2HG   GLU  79          2HG       GLU  79   1.722  -8.950  -5.234
  592    H    CYS  80           H        CYS  80   2.341  -7.787  -2.934
  593    HA   CYS  80           HA       CYS  80   0.766  -5.510  -3.791
  594   1HB   CYS  80          1HB       CYS  80   2.331  -4.917  -2.089
  595   2HB   CYS  80          2HB       CYS  80   3.686  -5.700  -2.868
  596    HG   CYS  80           HG       CYS  80   4.417  -3.720  -4.276
  597    H    ASN  81           H        ASN  81   0.214  -6.596  -5.634
  598    HA   ASN  81           HA       ASN  81   2.399  -7.164  -7.382
  599   1HB   ASN  81          1HB       ASN  81   0.836  -8.438  -8.806
  600   2HB   ASN  81          2HB       ASN  81   0.586  -8.907  -7.128
  601   1HD2  ASN  81          1HD2      ASN  81  -1.397  -8.372  -6.215
  602   2HD2  ASN  81          2HD2      ASN  81  -2.686  -7.758  -7.124
  603    H    GLU  82           H        GLU  82   1.546  -6.858  -9.755
  604    HA   GLU  82           HA       GLU  82   1.842  -4.351 -10.523
  605   1HB   GLU  82          1HB       GLU  82   1.803  -6.584 -11.666
  606   2HB   GLU  82          2HB       GLU  82   0.086  -6.326 -11.828
  607   1HG   GLU  82          1HG       GLU  82   2.120  -4.433 -12.789
  608   2HG   GLU  82          2HG       GLU  82   1.547  -5.733 -13.857
  609    H    ASN  83           H        ASN  83  -1.215  -6.087 -10.382
  610    HA   ASN  83           HA       ASN  83  -3.101  -4.142 -11.035
  611   1HB   ASN  83          1HB       ASN  83  -3.321  -6.459  -9.103
  612   2HB   ASN  83          2HB       ASN  83  -4.715  -5.559  -9.726
  613   1HD2  ASN  83          1HD2      ASN  83  -2.481  -8.045 -10.204
  614   2HD2  ASN  83          2HD2      ASN  83  -3.044  -8.616 -11.722
  615    H    VAL  84           H        VAL  84  -1.815  -5.215  -7.900
  616    HA   VAL  84           HA       VAL  84  -3.355  -3.452  -6.460
  617    HB   VAL  84           HB       VAL  84  -0.707  -4.722  -5.810
  618   1HG1  VAL  84          1HG1      VAL  84  -1.128  -4.149  -3.491
  619   2HG1  VAL  84          2HG1      VAL  84  -2.533  -3.188  -3.945
  620   3HG1  VAL  84          3HG1      VAL  84  -0.913  -2.684  -4.444
  621   1HG2  VAL  84          1HG2      VAL  84  -2.579  -6.168  -6.093
  622   2HG2  VAL  84          2HG2      VAL  84  -3.499  -5.206  -4.915
  623   3HG2  VAL  84          3HG2      VAL  84  -2.051  -6.085  -4.410
  624    H    LYS  85           H        LYS  85  -0.057  -3.176  -7.602
  625    HA   LYS  85           HA       LYS  85   0.603  -0.655  -6.608
  626   1HB   LYS  85          1HB       LYS  85   1.476  -1.970  -9.159
  627   2HB   LYS  85          2HB       LYS  85   2.212  -0.513  -8.492
  628   1HG   LYS  85          1HG       LYS  85   2.851  -1.672  -6.544
  629   2HG   LYS  85          2HG       LYS  85   2.024  -3.141  -7.084
  630   1HD   LYS  85          1HD       LYS  85   3.549  -3.035  -9.098
  631   2HD   LYS  85          2HD       LYS  85   4.475  -1.823  -8.194
  632   1HE   LYS  85          1HE       LYS  85   4.580  -3.401  -6.319
  633   2HE   LYS  85          2HE       LYS  85   3.752  -4.555  -7.369
  634   1HZ   LYS  85          1HZ       LYS  85   6.444  -3.394  -7.944
  635   2HZ   LYS  85          2HZ       LYS  85   5.606  -4.524  -8.876
  636   3HZ   LYS  85          3HZ       LYS  85   6.155  -4.957  -7.369
  637    H    HIS  86           H        HIS  86  -0.839  -1.570  -9.553
  638    HA   HIS  86           HA       HIS  86  -1.029   0.865 -10.927
  639   1HB   HIS  86          1HB       HIS  86  -1.610  -1.372 -11.907
  640   2HB   HIS  86          2HB       HIS  86  -3.090  -1.368 -10.969
  641    HD1  HIS  86           1HD      HIS  86  -1.878  -0.660 -14.250
  642    HD2  HIS  86           2HD      HIS  86  -4.821   0.988 -11.821
  643    HE1  HIS  86           1HE      HIS  86  -3.394   0.572 -15.797
  644    H    LYS  87           H        LYS  87  -3.404  -0.698  -8.864
  645    HA   LYS  87           HA       LYS  87  -5.235   1.456  -8.932
  646   1HB   LYS  87          1HB       LYS  87  -5.042  -0.791  -6.936
  647   2HB   LYS  87          2HB       LYS  87  -6.418   0.289  -7.124
  648   1HG   LYS  87          1HG       LYS  87  -6.714  -0.487  -9.406
  649   2HG   LYS  87          2HG       LYS  87  -5.349  -1.586  -9.208
  650   1HD   LYS  87          1HD       LYS  87  -6.584  -2.645  -7.331
  651   2HD   LYS  87          2HD       LYS  87  -7.967  -1.623  -7.745
  652   1HE   LYS  87          1HE       LYS  87  -6.576  -3.504  -9.598
  653   2HE   LYS  87          2HE       LYS  87  -8.092  -3.890  -8.765
  654   1HZ   LYS  87          1HZ       LYS  87  -7.651  -1.726 -10.770
  655   2HZ   LYS  87          2HZ       LYS  87  -9.134  -2.048 -10.029
  656   3HZ   LYS  87          3HZ       LYS  87  -8.424  -3.176 -11.056
  657    H    THR  88           H        THR  88  -2.574   0.748  -7.012
  658    HA   THR  88           HA       THR  88  -3.229   2.384  -4.797
  659    HB   THR  88           HB       THR  88  -0.749   1.087  -5.786
  660    HG1  THR  88           1HG      THR  88  -2.096  -0.381  -4.996
  661   1HG2  THR  88          1HG2      THR  88  -1.207   2.625  -3.237
  662   2HG2  THR  88          2HG2      THR  88  -0.232   3.079  -4.652
  663   3HG2  THR  88          3HG2      THR  88   0.260   1.688  -3.664
  664    H    LYS  89           H        LYS  89  -0.757   2.699  -7.284
  665    HA   LYS  89           HA       LYS  89  -0.217   5.208  -6.455
  666   1HB   LYS  89          1HB       LYS  89   0.904   5.506  -8.824
  667   2HB   LYS  89          2HB       LYS  89   1.544   4.463  -7.584
  668   1HG   LYS  89          1HG       LYS  89   1.640   3.260  -9.658
  669   2HG   LYS  89          2HG       LYS  89   0.366   2.561  -8.636
  670   1HD   LYS  89          1HD       LYS  89  -0.325   2.610 -10.802
  671   2HD   LYS  89          2HD       LYS  89  -1.197   3.765  -9.808
  672   1HE   LYS  89          1HE       LYS  89  -0.749   4.901 -11.903
  673   2HE   LYS  89          2HE       LYS  89   0.350   5.524 -10.670
  674   1HZ   LYS  89          1HZ       LYS  89   1.148   3.404 -12.568
  675   2HZ   LYS  89          2HZ       LYS  89   2.171   4.356 -11.602
  676   3HZ   LYS  89          3HZ       LYS  89   1.347   5.036 -12.891
  677    H    GLU  90           H        GLU  90  -2.535   4.096  -8.847
  678    HA   GLU  90           HA       GLU  90  -3.279   6.690  -9.819
  679   1HB   GLU  90          1HB       GLU  90  -4.825   4.106  -9.786
  680   2HB   GLU  90          2HB       GLU  90  -5.476   5.580 -10.482
  681   1HG   GLU  90          1HG       GLU  90  -3.002   4.114 -11.400
  682   2HG   GLU  90          2HG       GLU  90  -4.562   4.133 -12.213
  683    H    TYR  91           H        TYR  91  -4.224   4.799  -7.013
  684    HA   TYR  91           HA       TYR  91  -6.510   6.356  -6.345
  685   1HB   TYR  91          1HB       TYR  91  -6.576   4.263  -5.306
  686   2HB   TYR  91          2HB       TYR  91  -4.855   4.267  -4.963
  687    HD1  TYR  91           1HD      TYR  91  -7.898   6.246  -4.001
  688    HD2  TYR  91           2HD      TYR  91  -4.269   4.409  -2.751
  689    HE1  TYR  91           1HE      TYR  91  -8.374   6.882  -1.670
  690    HE2  TYR  91           2HE      TYR  91  -4.697   5.033  -0.478
  691    HH   TYR  91           HH       TYR  91  -7.773   6.183   0.559
  692    H    ILE  92           H        ILE  92  -3.165   6.100  -5.268
  693    HA   ILE  92           HA       ILE  92  -2.966   8.190  -3.507
  694    HB   ILE  92           HB       ILE  92  -0.993   7.321  -5.615
  695   1HG1  ILE  92          1HG1      ILE  92  -1.914   5.774  -3.723
  696   2HG1  ILE  92          2HG1      ILE  92  -0.178   5.716  -4.095
  697   1HG2  ILE  92          1HG2      ILE  92   0.755   8.419  -4.269
  698   2HG2  ILE  92          2HG2      ILE  92  -0.513   9.002  -3.175
  699   3HG2  ILE  92          3HG2      ILE  92  -0.485   9.557  -4.839
  700   1HD1  ILE  92          1HD1      ILE  92  -0.625   5.673  -1.760
  701   2HD1  ILE  92          2HD1      ILE  92  -1.650   7.115  -1.925
  702   3HD1  ILE  92          3HD1      ILE  92   0.103   7.225  -2.205
  703    H    LYS  93           H        LYS  93  -2.454   8.475  -7.021
  704    HA   LYS  93           HA       LYS  93  -1.994  11.175  -7.158
  705   1HB   LYS  93          1HB       LYS  93  -3.688   9.520  -9.030
  706   2HB   LYS  93          2HB       LYS  93  -3.119  11.136  -9.382
  707   1HG   LYS  93          1HG       LYS  93  -0.837  10.363  -9.385
  708   2HG   LYS  93          2HG       LYS  93  -1.367   8.741  -8.914
  709   1HD   LYS  93          1HD       LYS  93  -2.657   8.547 -10.960
  710   2HD   LYS  93          2HD       LYS  93  -2.201  10.186 -11.416
  711   1HE   LYS  93          1HE       LYS  93   0.121   9.517 -11.546
  712   2HE   LYS  93          2HE       LYS  93  -0.303   7.884 -11.033
  713   1HZ   LYS  93          1HZ       LYS  93  -1.592   7.597 -12.988
  714   2HZ   LYS  93          2HZ       LYS  93  -0.043   8.070 -13.458
  715   3HZ   LYS  93          3HZ       LYS  93  -1.317   9.176 -13.507
  716    H    LYS  94           H        LYS  94  -5.075   9.483  -7.263
  717    HA   LYS  94           HA       LYS  94  -6.545  11.874  -7.669
  718   1HB   LYS  94          1HB       LYS  94  -7.486   9.168  -6.740
  719   2HB   LYS  94          2HB       LYS  94  -8.554  10.456  -7.298
  720   1HG   LYS  94          1HG       LYS  94  -7.674  10.284  -9.512
  721   2HG   LYS  94          2HG       LYS  94  -6.413   9.170  -8.975
  722   1HD   LYS  94          1HD       LYS  94  -8.174   7.562  -8.327
  723   2HD   LYS  94          2HD       LYS  94  -9.386   8.663  -8.982
  724   1HE   LYS  94          1HE       LYS  94  -8.325   8.509 -11.182
  725   2HE   LYS  94          2HE       LYS  94  -7.123   7.406 -10.518
  726   1HZ   LYS  94          1HZ       LYS  94  -8.876   5.824 -10.041
  727   2HZ   LYS  94          2HZ       LYS  94  -8.887   6.238 -11.669
  728   3HZ   LYS  94          3HZ       LYS  94 -10.040   6.893 -10.629
  729    H    TYR  95           H        TYR  95  -5.676   9.922  -4.919
  730    HA   TYR  95           HA       TYR  95  -7.286  11.136  -3.020
  731   1HB   TYR  95          1HB       TYR  95  -6.245   9.050  -2.663
  732   2HB   TYR  95          2HB       TYR  95  -4.656   9.770  -2.971
  733    HD1  TYR  95           1HD      TYR  95  -7.605   9.943  -0.733
  734    HD2  TYR  95           2HD      TYR  95  -3.444  10.622  -1.154
  735    HE1  TYR  95           1HE      TYR  95  -7.477  10.573   1.619
  736    HE2  TYR  95           2HE      TYR  95  -3.293  11.250   1.141
  737    HH   TYR  95           HH       TYR  95  -6.075  10.883   3.317
  738    H    MET  96           H        MET  96  -3.923  11.767  -3.864
  739    HA   MET  96           HA       MET  96  -3.580  13.854  -2.058
  740   1HB   MET  96          1HB       MET  96  -2.125  13.578  -4.681
  741   2HB   MET  96          2HB       MET  96  -1.632  14.453  -3.229
  742   1HG   MET  96          1HG       MET  96  -1.943  11.474  -3.445
  743   2HG   MET  96          2HG       MET  96  -0.416  12.356  -3.480
  744   1HE   MET  96          1HE       MET  96   0.437  13.786  -1.533
  745   2HE   MET  96          2HE       MET  96  -0.351  13.904   0.068
  746   3HE   MET  96          3HE       MET  96  -1.115  14.604  -1.377
  747    H    GLN  97           H        GLN  97  -4.962  13.806  -5.114
  748    HA   GLN  97           HA       GLN  97  -4.864  16.561  -5.766
  749   1HB   GLN  97          1HB       GLN  97  -7.176  14.786  -6.510
  750   2HB   GLN  97          2HB       GLN  97  -6.696  16.275  -7.301
  751   1HG   GLN  97          1HG       GLN  97  -5.385  13.595  -7.365
  752   2HG   GLN  97          2HG       GLN  97  -5.977  14.554  -8.708
  753   1HE2  GLN  97          1HE2      GLN  97  -3.465  13.865  -6.607
  754   2HE2  GLN  97          2HE2      GLN  97  -2.218  14.832  -7.255
  755    H    LYS  98           H        LYS  98  -6.758  14.932  -3.465
  756    HA   LYS  98           HA       LYS  98  -8.842  16.874  -3.417
  757   1HB   LYS  98          1HB       LYS  98  -9.870  15.674  -1.651
  758   2HB   LYS  98          2HB       LYS  98  -9.137  14.502  -2.716
  759   1HG   LYS  98          1HG       LYS  98  -7.875  13.636  -1.085
  760   2HG   LYS  98          2HG       LYS  98  -7.325  15.232  -0.572
  761   1HD   LYS  98          1HD       LYS  98  -9.997  13.987   0.123
  762   2HD   LYS  98          2HD       LYS  98  -8.572  14.006   1.173
  763   1HE   LYS  98          1HE       LYS  98  -8.632  16.282   1.458
  764   2HE   LYS  98          2HE       LYS  98  -9.674  16.584   0.075
  765   1HZ   LYS  98          1HZ       LYS  98 -10.884  16.885   2.047
  766   2HZ   LYS  98          2HZ       LYS  98 -10.436  15.418   2.712
  767   3HZ   LYS  98          3HZ       LYS  98 -11.473  15.465   1.356
  768    H    PHE  99           H        PHE  99  -5.772  16.614  -1.916
  769    HA   PHE  99           HA       PHE  99  -6.359  18.262   0.363
  770   1HB   PHE  99          1HB       PHE  99  -3.712  17.443  -0.826
  771   2HB   PHE  99          2HB       PHE  99  -3.872  18.437   0.613
  772    HD1  PHE  99           1HD      PHE  99  -5.517  17.352   2.446
  773    HD2  PHE  99           2HD      PHE  99  -3.311  15.225  -0.507
  774    HE1  PHE  99           1HE      PHE  99  -5.536  15.321   3.876
  775    HE2  PHE  99           2HE      PHE  99  -3.363  13.204   0.953
  776    HZ   PHE  99           HZ       PHE  99  -4.528  13.286   3.080
  777    H    GLY 100           H        GLY 100  -5.047  18.847  -2.823
  778   1HA   GLY 100          1HA       GLY 100  -5.493  20.961  -3.855
  779   2HA   GLY 100          2HA       GLY 100  -5.351  21.687  -2.255
  780    H    ALA 101           H        ALA 101  -3.632  22.791  -2.103
  781    HA   ALA 101           HA       ALA 101  -1.327  22.261  -3.763
  782   1HB   ALA 101          1HB       ALA 101  -1.737  24.295  -1.584
  783   2HB   ALA 101          2HB       ALA 101  -2.043  24.556  -3.300
  784   3HB   ALA 101          3HB       ALA 101  -0.395  24.260  -2.730
  785    H    VAL 102           H        VAL 102  -2.104  22.118  -0.272
  786    HA   VAL 102           HA       VAL 102   0.302  20.564  -0.016
  787    HB   VAL 102           HB       VAL 102   0.044  21.325   2.435
  788   1HG1  VAL 102          1HG1      VAL 102   1.244  23.061   0.263
  789   2HG1  VAL 102          2HG1      VAL 102   2.031  21.713   1.107
  790   3HG1  VAL 102          3HG1      VAL 102   1.651  23.198   1.979
  791   1HG2  VAL 102          1HG2      VAL 102  -0.610  23.703   2.649
  792   2HG2  VAL 102          2HG2      VAL 102  -1.950  22.645   2.190
  793   3HG2  VAL 102          3HG2      VAL 102  -1.167  23.660   0.978
  794    H    TYR 103           H        TYR 103   0.356  18.979   1.453
  795    HA   TYR 103           HA       TYR 103  -2.072  17.551   1.627
  796   1HB   TYR 103          1HB       TYR 103  -0.302  16.164   1.058
  797   2HB   TYR 103          2HB       TYR 103   0.815  17.010   2.110
  798    HD1  TYR 103           1HD      TYR 103  -2.428  15.372   2.884
  799    HD2  TYR 103           2HD      TYR 103   1.724  15.427   3.424
  800    HE1  TYR 103           1HE      TYR 103  -2.657  13.631   4.550
  801    HE2  TYR 103           2HE      TYR 103   1.527  13.629   5.130
  802    HH   TYR 103           HH       TYR 103  -0.071  12.837   6.668
  803    H    LYS 104           H        LYS 104  -3.408  17.981   3.074
  804    HA   LYS 104           HA       LYS 104  -2.573  18.633   5.784
  805   1HB   LYS 104          1HB       LYS 104  -4.739  19.932   5.851
  806   2HB   LYS 104          2HB       LYS 104  -3.466  20.587   4.821
  807   1HG   LYS 104          1HG       LYS 104  -4.564  19.570   2.880
  808   2HG   LYS 104          2HG       LYS 104  -5.876  19.018   3.907
  809   1HD   LYS 104          1HD       LYS 104  -6.658  21.021   2.968
  810   2HD   LYS 104          2HD       LYS 104  -6.092  21.435   4.595
  811   1HE   LYS 104          1HE       LYS 104  -4.031  22.316   3.746
  812   2HE   LYS 104          2HE       LYS 104  -4.419  21.772   2.115
  813   1HZ   LYS 104          1HZ       LYS 104  -6.290  23.318   2.115
  814   2HZ   LYS 104          2HZ       LYS 104  -4.826  24.116   2.354
  815   3HZ   LYS 104          3HZ       LYS 104  -5.860  23.859   3.651
  816    HA   PRO 105           HA       PRO 105  -4.700  14.521   5.819
  817   1HB   PRO 105          1HB       PRO 105  -3.650  13.781   8.253
  818   2HB   PRO 105          2HB       PRO 105  -2.885  13.471   6.694
  819   1HG   PRO 105          1HG       PRO 105  -2.403  15.622   8.656
  820   2HG   PRO 105          2HG       PRO 105  -1.211  14.731   7.656
  821   1HD   PRO 105          1HD       PRO 105  -2.032  17.267   7.198
  822   2HD   PRO 105          2HD       PRO 105  -1.575  16.196   5.864
  823    H    LYS 106           H        LYS 106  -4.553  16.801   8.443
  824    HA   LYS 106           HA       LYS 106  -6.790  15.968   9.860
  825   1HB   LYS 106          1HB       LYS 106  -7.024  18.236  10.732
  826   2HB   LYS 106          2HB       LYS 106  -5.349  17.738  10.713
  827   1HG   LYS 106          1HG       LYS 106  -6.432  19.387   8.467
  828   2HG   LYS 106          2HG       LYS 106  -6.025  20.152   9.996
  829   1HD   LYS 106          1HD       LYS 106  -4.103  18.534   8.289
  830   2HD   LYS 106          2HD       LYS 106  -4.222  20.287   8.297
  831   1HE   LYS 106          1HE       LYS 106  -3.712  20.236  10.759
  832   2HE   LYS 106          2HE       LYS 106  -3.399  18.515  10.601
  833   1HZ   LYS 106          1HZ       LYS 106  -1.973  20.647   9.124
  834   2HZ   LYS 106          2HZ       LYS 106  -1.563  18.995   9.086
  835   3HZ   LYS 106          3HZ       LYS 106  -1.376  19.885  10.486
  836    H    GLU 107           H        GLU 107  -6.670  17.182   6.717
  837    HA   GLU 107           HA       GLU 107  -9.565  17.576   6.581
  838   1HB   GLU 107          1HB       GLU 107  -7.323  19.002   5.160
  839   2HB   GLU 107          2HB       GLU 107  -8.997  19.099   4.638
  840   1HG   GLU 107          1HG       GLU 107  -7.928  20.001   7.304
  841   2HG   GLU 107          2HG       GLU 107  -8.283  21.048   5.930
  842    H    ASP 108           H        ASP 108  -7.947  15.136   6.311
  843    HA   ASP 108           HA       ASP 108  -7.600  14.490   3.605
  844   1HB   ASP 108          1HB       ASP 108  -6.285  13.059   4.788
  845   2HB   ASP 108          2HB       ASP 108  -7.211  13.269   6.244
  846    H    THR 109           H        THR 109  -8.939  12.097   3.202
  847    HA   THR 109           HA       THR 109 -11.469  13.242   2.417
  848    HB   THR 109           HB       THR 109 -10.168  11.847   0.841
  849    HG1  THR 109           1HG      THR 109 -12.729  11.597   1.372
  850   1HG2  THR 109          1HG2      THR 109  -9.221  10.409   2.598
  851   2HG2  THR 109          2HG2      THR 109  -9.817   9.481   1.209
  852   3HG2  THR 109          3HG2      THR 109 -10.755   9.559   2.719
  Start of MODEL   15
    1    H    THR  10           H        THR  10  -4.128 -23.838   4.219
    2    HA   THR  10           HA       THR  10  -4.527 -22.536   5.914
    3    HB   THR  10           HB       THR  10  -2.894 -22.586   7.882
    4    HG1  THR  10           1HG      THR  10  -1.191 -23.229   6.058
    5   1HG2  THR  10          1HG2      THR  10  -3.668 -25.223   6.634
    6   2HG2  THR  10          2HG2      THR  10  -4.683 -24.226   7.677
    7   3HG2  THR  10          3HG2      THR  10  -3.230 -24.989   8.324
    8    H    SER  11           H        SER  11  -4.717 -20.747   4.729
    9    HA   SER  11           HA       SER  11  -2.520 -18.957   4.131
   10   1HB   SER  11          1HB       SER  11  -5.392 -18.499   3.950
   11   2HB   SER  11          2HB       SER  11  -4.092 -17.845   2.912
   12    HG   SER  11           HG       SER  11  -4.460 -19.587   1.613
   13    H    SER  12           H        SER  12  -4.404 -19.419   6.788
   14    HA   SER  12           HA       SER  12  -4.662 -16.773   7.580
   15   1HB   SER  12          1HB       SER  12  -4.897 -17.958   9.820
   16   2HB   SER  12          2HB       SER  12  -5.935 -18.495   8.472
   17    HG   SER  12           HG       SER  12  -4.694 -20.126   9.821
   18    H    GLU  13           H        GLU  13  -2.112 -19.346   8.335
   19    HA   GLU  13           HA       GLU  13  -0.495 -17.455   9.528
   20   1HB   GLU  13          1HB       GLU  13   0.986 -19.467   9.775
   21   2HB   GLU  13          2HB       GLU  13  -0.614 -19.612  10.486
   22   1HG   GLU  13          1HG       GLU  13  -1.351 -20.940   8.525
   23   2HG   GLU  13          2HG       GLU  13   0.243 -20.777   7.840
   24    H    LEU  14           H        LEU  14  -0.594 -19.177   6.460
   25    HA   LEU  14           HA       LEU  14   1.950 -18.724   5.403
   26   1HB   LEU  14          1HB       LEU  14  -0.005 -20.081   4.488
   27   2HB   LEU  14          2HB       LEU  14  -0.679 -18.570   3.982
   28    HG   LEU  14           HG       LEU  14   1.960 -19.505   2.852
   29   1HD1  LEU  14          1HD1      LEU  14  -0.834 -20.029   1.841
   30   2HD1  LEU  14          2HD1      LEU  14   0.309 -21.242   2.428
   31   3HD1  LEU  14          3HD1      LEU  14   0.650 -20.341   0.948
   32   1HD2  LEU  14          1HD2      LEU  14  -0.181 -17.629   1.812
   33   2HD2  LEU  14          2HD2      LEU  14   1.320 -18.032   0.986
   34   3HD2  LEU  14          3HD2      LEU  14   1.362 -17.132   2.502
   35    H    ALA  15           H        ALA  15  -0.717 -16.858   5.618
   36    HA   ALA  15           HA       ALA  15   0.404 -14.750   3.975
   37   1HB   ALA  15          1HB       ALA  15  -1.714 -13.676   3.884
   38   2HB   ALA  15          2HB       ALA  15  -2.396 -14.916   4.943
   39   3HB   ALA  15          3HB       ALA  15  -1.817 -15.344   3.331
   40    H    LYS  16           H        LYS  16   0.169 -15.499   7.169
   41    HA   LYS  16           HA       LYS  16  -0.066 -12.949   8.415
   42   1HB   LYS  16          1HB       LYS  16  -0.164 -15.041   9.699
   43   2HB   LYS  16          2HB       LYS  16   1.463 -15.451   9.197
   44   1HG   LYS  16          1HG       LYS  16   1.419 -14.688  11.499
   45   2HG   LYS  16          2HG       LYS  16   2.339 -13.573  10.488
   46   1HD   LYS  16          1HD       LYS  16   0.413 -12.083  10.380
   47   2HD   LYS  16          2HD       LYS  16  -0.519 -13.206  11.363
   48   1HE   LYS  16          1HE       LYS  16   0.358 -11.356  12.717
   49   2HE   LYS  16          2HE       LYS  16   1.040 -12.901  13.221
   50   1HZ   LYS  16          1HZ       LYS  16   2.712 -11.168  13.108
   51   2HZ   LYS  16          2HZ       LYS  16   2.406 -10.903  11.485
   52   3HZ   LYS  16          3HZ       LYS  16   3.048 -12.377  11.995
   53    H    LYS  17           H        LYS  17   2.491 -14.719   6.911
   54    HA   LYS  17           HA       LYS  17   4.480 -12.701   7.368
   55   1HB   LYS  17          1HB       LYS  17   4.434 -15.215   5.699
   56   2HB   LYS  17          2HB       LYS  17   5.766 -14.081   5.609
   57   1HG   LYS  17          1HG       LYS  17   6.334 -15.933   7.054
   58   2HG   LYS  17          2HG       LYS  17   6.217 -14.451   7.995
   59   1HD   LYS  17          1HD       LYS  17   3.978 -15.128   8.746
   60   2HD   LYS  17          2HD       LYS  17   4.119 -16.614   7.805
   61   1HE   LYS  17          1HE       LYS  17   5.964 -15.798  10.043
   62   2HE   LYS  17          2HE       LYS  17   4.628 -16.926  10.209
   63   1HZ   LYS  17          1HZ       LYS  17   7.006 -17.291   8.466
   64   2HZ   LYS  17          2HZ       LYS  17   5.711 -18.367   8.586
   65   3HZ   LYS  17          3HZ       LYS  17   6.690 -18.103   9.913
   66    H    SER  18           H        SER  18   2.441 -13.803   4.661
   67    HA   SER  18           HA       SER  18   3.536 -12.214   2.734
   68   1HB   SER  18          1HB       SER  18   0.639 -13.055   2.857
   69   2HB   SER  18          2HB       SER  18   1.573 -12.677   1.410
   70    HG   SER  18           HG       SER  18   1.816 -14.746   1.447
   71    H    LYS  19           H        LYS  19   1.028 -11.335   5.105
   72    HA   LYS  19           HA       LYS  19   0.326  -8.817   3.889
   73   1HB   LYS  19          1HB       LYS  19   0.171  -9.536   6.816
   74   2HB   LYS  19          2HB       LYS  19  -0.710  -8.254   6.000
   75   1HG   LYS  19          1HG       LYS  19  -1.830 -10.152   4.651
   76   2HG   LYS  19          2HG       LYS  19  -1.171 -11.231   5.866
   77   1HD   LYS  19          1HD       LYS  19  -3.096  -8.943   6.334
   78   2HD   LYS  19          2HD       LYS  19  -3.449 -10.667   6.447
   79   1HE   LYS  19          1HE       LYS  19  -1.799 -10.832   8.275
   80   2HE   LYS  19          2HE       LYS  19  -1.577  -9.081   8.117
   81   1HZ   LYS  19          1HZ       LYS  19  -4.169 -10.360   8.843
   82   2HZ   LYS  19          2HZ       LYS  19  -3.839  -8.713   8.790
   83   3HZ   LYS  19          3HZ       LYS  19  -3.104  -9.684   9.942
   84    H    GLU  20           H        GLU  20   2.882  -9.836   5.925
   85    HA   GLU  20           HA       GLU  20   3.696  -7.152   6.526
   86   1HB   GLU  20          1HB       GLU  20   5.160  -9.750   6.825
   87   2HB   GLU  20          2HB       GLU  20   5.648  -8.195   7.510
   88   1HG   GLU  20          1HG       GLU  20   3.090  -9.460   7.876
   89   2HG   GLU  20          2HG       GLU  20   4.409  -9.724   9.065
   90    H    VAL  21           H        VAL  21   4.728  -9.753   4.426
   91    HA   VAL  21           HA       VAL  21   6.886  -8.418   3.124
   92    HB   VAL  21           HB       VAL  21   4.943 -10.473   2.016
   93   1HG1  VAL  21          1HG1      VAL  21   6.746 -11.040   0.450
   94   2HG1  VAL  21          2HG1      VAL  21   7.761  -9.791   1.164
   95   3HG1  VAL  21          3HG1      VAL  21   6.290  -9.342   0.293
   96   1HG2  VAL  21          1HG2      VAL  21   7.571 -10.905   3.414
   97   2HG2  VAL  21          2HG2      VAL  21   6.635 -12.159   2.599
   98   3HG2  VAL  21          3HG2      VAL  21   5.971 -11.341   4.013
   99    H    PHE  22           H        PHE  22   3.449  -8.513   2.594
  100    HA   PHE  22           HA       PHE  22   3.520  -6.935   0.182
  101   1HB   PHE  22          1HB       PHE  22   1.564  -8.204   0.310
  102   2HB   PHE  22          2HB       PHE  22   1.376  -7.898   2.033
  103    HD1  PHE  22           1HD      PHE  22   1.273  -6.028  -1.243
  104    HD2  PHE  22           2HD      PHE  22  -0.287  -6.425   2.693
  105    HE1  PHE  22           1HE      PHE  22  -0.336  -4.189  -1.677
  106    HE2  PHE  22           2HE      PHE  22  -1.880  -4.644   2.240
  107    HZ   PHE  22           HZ       PHE  22  -1.939  -3.540   0.089
  108    H    ARG  23           H        ARG  23   2.586  -6.209   3.506
  109    HA   ARG  23           HA       ARG  23   2.254  -3.479   2.908
  110   1HB   ARG  23          1HB       ARG  23   2.132  -2.971   5.268
  111   2HB   ARG  23          2HB       ARG  23   1.340  -4.501   4.921
  112   1HG   ARG  23          1HG       ARG  23   2.452  -5.194   6.780
  113   2HG   ARG  23          2HG       ARG  23   3.739  -5.386   5.579
  114   1HD   ARG  23          1HD       ARG  23   4.792  -3.387   6.209
  115   2HD   ARG  23          2HD       ARG  23   3.423  -2.892   7.215
  116    HE   ARG  23           HE       ARG  23   4.301  -5.363   8.150
  117   1HH1  ARG  23          1HH1      ARG  23   5.617  -2.068   8.038
  118   2HH1  ARG  23          2HH1      ARG  23   6.498  -2.280   9.484
  119   1HH2  ARG  23          1HH2      ARG  23   5.459  -5.627   9.965
  120   2HH2  ARG  23          2HH2      ARG  23   6.461  -4.399  10.628
  121    H    LYS  24           H        LYS  24   5.194  -5.214   3.560
  122    HA   LYS  24           HA       LYS  24   6.713  -2.905   4.018
  123   1HB   LYS  24          1HB       LYS  24   7.525  -5.668   3.135
  124   2HB   LYS  24          2HB       LYS  24   8.698  -4.375   3.293
  125   1HG   LYS  24          1HG       LYS  24   6.942  -5.379   5.518
  126   2HG   LYS  24          2HG       LYS  24   8.602  -5.890   5.239
  127   1HD   LYS  24          1HD       LYS  24   9.319  -3.521   5.502
  128   2HD   LYS  24          2HD       LYS  24   7.653  -3.101   5.897
  129   1HE   LYS  24          1HE       LYS  24   8.932  -3.368   7.930
  130   2HE   LYS  24          2HE       LYS  24   7.734  -4.651   7.806
  131   1HZ   LYS  24          1HZ       LYS  24  10.627  -4.908   7.169
  132   2HZ   LYS  24          2HZ       LYS  24   9.484  -6.132   6.997
  133   3HZ   LYS  24          3HZ       LYS  24   9.844  -5.538   8.522
  134    H    GLU  25           H        GLU  25   6.097  -4.868   1.032
  135    HA   GLU  25           HA       GLU  25   7.739  -3.060  -0.388
  136   1HB   GLU  25          1HB       GLU  25   6.551  -4.354  -2.322
  137   2HB   GLU  25          2HB       GLU  25   7.988  -5.033  -1.504
  138   1HG   GLU  25          1HG       GLU  25   6.202  -6.215  -0.145
  139   2HG   GLU  25          2HG       GLU  25   5.079  -5.682  -1.383
  140    H    MET  26           H        MET  26   4.445  -3.326   0.271
  141    HA   MET  26           HA       MET  26   3.750  -1.529  -1.787
  142   1HB   MET  26          1HB       MET  26   2.249  -3.164  -0.622
  143   2HB   MET  26          2HB       MET  26   2.132  -1.914   0.670
  144   1HG   MET  26          1HG       MET  26   0.326  -1.800  -0.972
  145   2HG   MET  26          2HG       MET  26   1.393  -0.383  -1.130
  146   1HE   MET  26          1HE       MET  26   0.911   0.112  -3.662
  147   2HE   MET  26          2HE       MET  26  -0.344  -1.103  -3.374
  148   3HE   MET  26          3HE       MET  26   0.664  -1.190  -4.837
  149    H    SER  27           H        SER  27   4.472  -1.207   1.551
  150    HA   SER  27           HA       SER  27   3.940   1.548   1.725
  151   1HB   SER  27          1HB       SER  27   5.579   1.657   3.592
  152   2HB   SER  27          2HB       SER  27   4.239   0.502   3.859
  153    HG   SER  27           HG       SER  27   5.665  -1.107   3.404
  154    H    GLN  28           H        GLN  28   6.776  -0.244   0.856
  155    HA   GLN  28           HA       GLN  28   8.461   2.038   0.607
  156   1HB   GLN  28          1HB       GLN  28  10.100   0.545  -0.182
  157   2HB   GLN  28          2HB       GLN  28   8.937  -0.458   0.725
  158   1HG   GLN  28          1HG       GLN  28   7.960  -1.266  -1.205
  159   2HG   GLN  28          2HG       GLN  28   8.876  -0.173  -2.207
  160   1HE2  GLN  28          1HE2      GLN  28   8.755  -3.003  -2.441
  161   2HE2  GLN  28          2HE2      GLN  28  10.320  -3.668  -2.161
  162    H    PHE  29           H        PHE  29   6.568   0.252  -1.545
  163    HA   PHE  29           HA       PHE  29   6.945   1.675  -3.931
  164   1HB   PHE  29          1HB       PHE  29   5.703  -0.424  -3.952
  165   2HB   PHE  29          2HB       PHE  29   4.421   0.288  -2.984
  166    HD1  PHE  29           1HD      PHE  29   2.638   1.533  -4.015
  167    HD2  PHE  29           2HD      PHE  29   6.021   0.277  -6.295
  168    HE1  PHE  29           1HE      PHE  29   1.472   2.121  -6.087
  169    HE2  PHE  29           2HE      PHE  29   4.821   0.876  -8.357
  170    HZ   PHE  29           HZ       PHE  29   2.526   1.791  -8.209
  171    H    ILE  30           H        ILE  30   4.384   2.145  -1.537
  172    HA   ILE  30           HA       ILE  30   3.265   4.435  -2.700
  173    HB   ILE  30           HB       ILE  30   3.130   3.375   0.119
  174   1HG1  ILE  30          1HG1      ILE  30   1.084   3.444  -2.096
  175   2HG1  ILE  30          2HG1      ILE  30   2.169   2.092  -1.820
  176   1HG2  ILE  30          1HG2      ILE  30   1.303   4.979   0.520
  177   2HG2  ILE  30          2HG2      ILE  30   1.554   5.644  -1.106
  178   3HG2  ILE  30          3HG2      ILE  30   2.803   5.829   0.100
  179   1HD1  ILE  30          1HD1      ILE  30   1.201   1.749   0.356
  180   2HD1  ILE  30          2HD1      ILE  30  -0.036   1.687  -0.892
  181   3HD1  ILE  30          3HD1      ILE  30   0.121   3.116   0.129
  182    H    VAL  31           H        VAL  31   5.617   4.100  -0.049
  183    HA   VAL  31           HA       VAL  31   6.068   6.742   0.445
  184    HB   VAL  31           HB       VAL  31   7.851   4.317   0.489
  185   1HG1  VAL  31          1HG1      VAL  31   9.310   6.289  -0.012
  186   2HG1  VAL  31          2HG1      VAL  31   9.619   5.568   1.564
  187   3HG1  VAL  31          3HG1      VAL  31   8.694   7.058   1.458
  188   1HG2  VAL  31          1HG2      VAL  31   7.737   4.702   2.925
  189   2HG2  VAL  31          2HG2      VAL  31   6.141   4.519   2.194
  190   3HG2  VAL  31          3HG2      VAL  31   6.723   6.115   2.632
  191    H    GLN  32           H        GLN  32   7.573   4.741  -2.121
  192    HA   GLN  32           HA       GLN  32   9.196   6.629  -3.176
  193   1HB   GLN  32          1HB       GLN  32   9.163   4.222  -3.656
  194   2HB   GLN  32          2HB       GLN  32   7.716   4.445  -4.610
  195   1HG   GLN  32          1HG       GLN  32   9.623   4.250  -6.019
  196   2HG   GLN  32          2HG       GLN  32   8.907   5.870  -6.126
  197   1HE2  GLN  32          1HE2      GLN  32  10.070   7.628  -5.354
  198   2HE2  GLN  32          2HE2      GLN  32  11.746   7.520  -4.933
  199    H    CYS  33           H        CYS  33   5.841   5.818  -3.804
  200    HA   CYS  33           HA       CYS  33   5.295   7.495  -5.996
  201   1HB   CYS  33          1HB       CYS  33   3.559   6.305  -3.882
  202   2HB   CYS  33          2HB       CYS  33   2.917   7.131  -5.309
  203    HG   CYS  33           HG       CYS  33   4.760   4.271  -5.189
  204    H    LEU  34           H        LEU  34   5.054   7.969  -2.539
  205    HA   LEU  34           HA       LEU  34   3.947  10.604  -2.785
  206   1HB   LEU  34          1HB       LEU  34   5.032   9.143  -0.405
  207   2HB   LEU  34          2HB       LEU  34   4.417  10.775  -0.325
  208    HG   LEU  34           HG       LEU  34   2.852   8.298  -1.015
  209   1HD1  LEU  34          1HD1      LEU  34   2.842  10.155   1.367
  210   2HD1  LEU  34          2HD1      LEU  34   3.412   8.490   1.335
  211   3HD1  LEU  34          3HD1      LEU  34   1.701   8.842   1.101
  212   1HD2  LEU  34          1HD2      LEU  34   0.886   9.789  -0.980
  213   2HD2  LEU  34          2HD2      LEU  34   1.988  10.191  -2.290
  214   3HD2  LEU  34          3HD2      LEU  34   1.955  11.184  -0.831
  215    H    ASN  35           H        ASN  35   7.137   9.313  -2.642
  216    HA   ASN  35           HA       ASN  35   8.729  11.263  -1.825
  217   1HB   ASN  35          1HB       ASN  35   9.060   9.370  -3.987
  218   2HB   ASN  35          2HB       ASN  35  10.181  10.763  -4.093
  219   1HD2  ASN  35          1HD2      ASN  35   8.689   9.360  -1.348
  220   2HD2  ASN  35          2HD2      ASN  35  10.099   8.732  -0.659
  221    HA   PRO  36           HA       PRO  36   8.425  14.124  -5.718
  222   1HB   PRO  36          1HB       PRO  36   6.170  13.901  -7.260
  223   2HB   PRO  36          2HB       PRO  36   7.688  13.104  -7.657
  224   1HG   PRO  36          1HG       PRO  36   5.263  11.989  -6.334
  225   2HG   PRO  36          2HG       PRO  36   6.327  11.247  -7.543
  226   1HD   PRO  36          1HD       PRO  36   6.434  10.663  -4.916
  227   2HD   PRO  36          2HD       PRO  36   7.872  10.596  -5.933
  228    H    TYR  37           H        TYR  37   5.855  13.233  -3.679
  229    HA   TYR  37           HA       TYR  37   4.434  15.727  -4.017
  230   1HB   TYR  37          1HB       TYR  37   3.949  13.391  -2.170
  231   2HB   TYR  37          2HB       TYR  37   2.950  14.839  -2.214
  232    HD1  TYR  37           1HD      TYR  37   4.069  11.939  -4.191
  233    HD2  TYR  37           2HD      TYR  37   1.308  15.127  -3.859
  234    HE1  TYR  37           1HE      TYR  37   2.761  10.941  -5.975
  235    HE2  TYR  37           2HE      TYR  37  -0.039  14.175  -5.656
  236    HH   TYR  37           HH       TYR  37   0.497  10.994  -6.827
  237    H    ARG  38           H        ARG  38   6.759  14.346  -1.917
  238    HA   ARG  38           HA       ARG  38   6.339  16.393   0.115
  239   1HB   ARG  38          1HB       ARG  38   8.136  15.354   1.352
  240   2HB   ARG  38          2HB       ARG  38   7.017  14.124   0.788
  241   1HG   ARG  38          1HG       ARG  38   8.485  13.525  -0.986
  242   2HG   ARG  38          2HG       ARG  38   9.590  14.827  -0.570
  243   1HD   ARG  38          1HD       ARG  38   9.899  13.758   1.668
  244   2HD   ARG  38          2HD       ARG  38   8.817  12.471   1.122
  245    HE   ARG  38           HE       ARG  38  11.024  12.826  -0.619
  246   1HH1  ARG  38          1HH1      ARG  38  10.235  11.431   2.561
  247   2HH1  ARG  38          2HH1      ARG  38  11.325  10.140   2.373
  248   1HH2  ARG  38          1HH2      ARG  38  12.548  11.005  -0.770
  249   2HH2  ARG  38          2HH2      ARG  38  12.627   9.896   0.520
  250    H    LYS  39           H        LYS  39   7.675  16.416  -2.768
  251    HA   LYS  39           HA       LYS  39  10.039  17.990  -2.274
  252   1HB   LYS  39          1HB       LYS  39   8.398  17.809  -4.810
  253   2HB   LYS  39          2HB       LYS  39  10.048  18.383  -4.669
  254   1HG   LYS  39          1HG       LYS  39   9.061  15.576  -4.311
  255   2HG   LYS  39          2HG       LYS  39  10.034  16.205  -5.642
  256   1HD   LYS  39          1HD       LYS  39  11.827  16.707  -4.014
  257   2HD   LYS  39          2HD       LYS  39  10.835  15.951  -2.763
  258   1HE   LYS  39          1HE       LYS  39  12.396  14.315  -3.533
  259   2HE   LYS  39          2HE       LYS  39  10.773  13.916  -4.106
  260   1HZ   LYS  39          1HZ       LYS  39  11.335  14.794  -6.288
  261   2HZ   LYS  39          2HZ       LYS  39  12.476  13.641  -5.860
  262   3HZ   LYS  39          3HZ       LYS  39  12.849  15.275  -5.740
  263    HA   PRO  40           HA       PRO  40   7.679  21.628  -1.309
  264   1HB   PRO  40          1HB       PRO  40   9.544  23.521  -2.001
  265   2HB   PRO  40          2HB       PRO  40   9.580  22.598  -0.499
  266   1HG   PRO  40          1HG       PRO  40  11.076  22.119  -3.044
  267   2HG   PRO  40          2HG       PRO  40  11.656  22.039  -1.370
  268   1HD   PRO  40          1HD       PRO  40  11.044  19.834  -2.758
  269   2HD   PRO  40          2HD       PRO  40  10.700  19.949  -1.015
  270    H    ASP  41           H        ASP  41   8.652  20.844  -4.455
  271    HA   ASP  41           HA       ASP  41   7.453  23.233  -5.621
  272   1HB   ASP  41          1HB       ASP  41   9.778  22.570  -6.283
  273   2HB   ASP  41          2HB       ASP  41   9.127  21.084  -6.949
  274    H    CYS  42           H        CYS  42   6.557  20.374  -4.621
  275    HA   CYS  42           HA       CYS  42   5.088  19.178  -6.756
  276   1HB   CYS  42          1HB       CYS  42   5.507  18.017  -4.573
  277   2HB   CYS  42          2HB       CYS  42   4.325  19.103  -3.860
  278    HG   CYS  42           HG       CYS  42   2.324  17.457  -4.280
  279    H    LYS  43           H        LYS  43   3.126  19.559  -7.611
  280    HA   LYS  43           HA       LYS  43   2.058  22.182  -7.053
  281   1HB   LYS  43          1HB       LYS  43   1.388  20.232  -9.270
  282   2HB   LYS  43          2HB       LYS  43   0.722  21.845  -9.121
  283   1HG   LYS  43          1HG       LYS  43   2.408  22.013 -10.765
  284   2HG   LYS  43          2HG       LYS  43   3.124  22.695  -9.310
  285   1HD   LYS  43          1HD       LYS  43   4.292  20.568  -8.901
  286   2HD   LYS  43          2HD       LYS  43   3.581  19.898 -10.366
  287   1HE   LYS  43          1HE       LYS  43   5.851  20.624 -10.814
  288   2HE   LYS  43          2HE       LYS  43   4.723  21.660 -11.682
  289   1HZ   LYS  43          1HZ       LYS  43   5.030  23.349  -9.949
  290   2HZ   LYS  43          2HZ       LYS  43   6.496  22.913 -10.635
  291   3HZ   LYS  43          3HZ       LYS  43   6.091  22.325  -9.127
  292    H    VAL  44           H        VAL  44   1.166  18.840  -6.706
  293    HA   VAL  44           HA       VAL  44  -1.283  19.750  -5.423
  294    HB   VAL  44           HB       VAL  44  -1.922  19.029  -7.679
  295   1HG1  VAL  44          1HG1      VAL  44  -1.788  16.694  -8.383
  296   2HG1  VAL  44          2HG1      VAL  44  -0.778  16.353  -6.974
  297   3HG1  VAL  44          3HG1      VAL  44  -0.213  17.468  -8.217
  298   1HG2  VAL  44          1HG2      VAL  44  -3.680  17.420  -7.085
  299   2HG2  VAL  44          2HG2      VAL  44  -3.545  18.730  -5.912
  300   3HG2  VAL  44          3HG2      VAL  44  -2.878  17.139  -5.538
  301    H    GLY  45           H        GLY  45  -1.500  19.032  -3.505
  302   1HA   GLY  45          1HA       GLY  45  -1.369  17.712  -1.628
  303   2HA   GLY  45          2HA       GLY  45  -0.996  16.348  -2.676
  304    H    ARG  46           H        ARG  46   0.832  19.478  -1.993
  305    HA   ARG  46           HA       ARG  46   3.252  18.063  -1.973
  306   1HB   ARG  46          1HB       ARG  46   2.786  20.523  -2.615
  307   2HB   ARG  46          2HB       ARG  46   2.739  20.840  -0.891
  308   1HG   ARG  46          1HG       ARG  46   5.106  19.533  -2.185
  309   2HG   ARG  46          2HG       ARG  46   4.944  21.297  -2.138
  310   1HD   ARG  46          1HD       ARG  46   4.989  19.445   0.235
  311   2HD   ARG  46          2HD       ARG  46   6.408  20.230  -0.467
  312    HE   ARG  46           HE       ARG  46   4.446  22.159   0.137
  313   1HH1  ARG  46          1HH1      ARG  46   6.695  20.028   1.860
  314   2HH1  ARG  46          2HH1      ARG  46   6.955  21.110   3.149
  315   1HH2  ARG  46          1HH2      ARG  46   4.780  23.596   1.906
  316   2HH2  ARG  46          2HH2      ARG  46   5.809  23.195   3.199
  317    H    ILE  47           H        ILE  47   4.004  16.978  -0.380
  318    HA   ILE  47           HA       ILE  47   2.710  17.017   2.176
  319    HB   ILE  47           HB       ILE  47   5.180  15.369   1.437
  320   1HG1  ILE  47          1HG1      ILE  47   2.241  14.627   1.523
  321   2HG1  ILE  47          2HG1      ILE  47   3.148  14.948   0.051
  322   1HG2  ILE  47          1HG2      ILE  47   5.066  15.688   3.755
  323   2HG2  ILE  47          2HG2      ILE  47   4.550  14.048   3.342
  324   3HG2  ILE  47          3HG2      ILE  47   3.365  15.253   3.798
  325   1HD1  ILE  47          1HD1      ILE  47   2.855  12.565   0.507
  326   2HD1  ILE  47          2HD1      ILE  47   3.775  12.752   2.004
  327   3HD1  ILE  47          3HD1      ILE  47   4.544  13.052   0.442
  328    H    THR  48           H        THR  48   3.049  18.223   3.714
  329    HA   THR  48           HA       THR  48   4.775  20.320   3.790
  330    HB   THR  48           HB       THR  48   3.996  20.309   6.237
  331    HG1  THR  48           1HG      THR  48   3.127  18.394   6.758
  332   1HG2  THR  48          1HG2      THR  48   2.964  21.574   4.419
  333   2HG2  THR  48          2HG2      THR  48   1.740  20.873   5.522
  334   3HG2  THR  48          3HG2      THR  48   2.115  20.087   3.974
  335    H    THR  49           H        THR  49   4.833  17.425   5.708
  336    HA   THR  49           HA       THR  49   7.668  17.918   6.205
  337    HB   THR  49           HB       THR  49   6.386  17.153   8.720
  338    HG1  THR  49           1HG      THR  49   4.689  18.355   8.248
  339   1HG2  THR  49          1HG2      THR  49   8.018  19.558   7.871
  340   2HG2  THR  49          2HG2      THR  49   8.662  18.049   8.527
  341   3HG2  THR  49          3HG2      THR  49   7.662  19.094   9.535
  342    H    THR  50           H        THR  50   8.746  16.101   7.250
  343    HA   THR  50           HA       THR  50   8.345  13.720   5.883
  344    HB   THR  50           HB       THR  50  10.381  14.503   6.690
  345    HG1  THR  50           1HG      THR  50  11.044  12.370   7.782
  346   1HG2  THR  50          1HG2      THR  50   9.472  13.767   9.449
  347   2HG2  THR  50          2HG2      THR  50   9.717  15.378   8.804
  348   3HG2  THR  50          3HG2      THR  50  11.119  14.302   9.036
  349    H    GLU  51           H        GLU  51   7.508  14.536   9.231
  350    HA   GLU  51           HA       GLU  51   6.506  11.998   9.851
  351   1HB   GLU  51          1HB       GLU  51   5.255  13.141  11.723
  352   2HB   GLU  51          2HB       GLU  51   6.992  13.406  11.670
  353   1HG   GLU  51          1HG       GLU  51   5.204  15.419  10.411
  354   2HG   GLU  51          2HG       GLU  51   5.347  15.377  12.167
  355    H    ASP  52           H        ASP  52   4.980  14.737   8.131
  356    HA   ASP  52           HA       ASP  52   2.338  13.694   8.194
  357   1HB   ASP  52          1HB       ASP  52   3.849  15.625   6.464
  358   2HB   ASP  52          2HB       ASP  52   2.170  15.231   6.198
  359    H    PHE  53           H        PHE  53   5.121  13.533   6.090
  360    HA   PHE  53           HA       PHE  53   4.007  12.142   3.968
  361   1HB   PHE  53          1HB       PHE  53   6.245  13.198   3.847
  362   2HB   PHE  53          2HB       PHE  53   6.797  12.181   5.158
  363    HD1  PHE  53           1HD      PHE  53   6.087  12.381   1.620
  364    HD2  PHE  53           2HD      PHE  53   7.368   9.866   4.776
  365    HE1  PHE  53           1HE      PHE  53   6.934  10.767  -0.020
  366    HE2  PHE  53           2HE      PHE  53   8.205   8.236   3.161
  367    HZ   PHE  53           HZ       PHE  53   7.989   8.708   0.723
  368    H    LYS  54           H        LYS  54   5.612  11.039   6.846
  369    HA   LYS  54           HA       LYS  54   5.438   8.219   6.424
  370   1HB   LYS  54          1HB       LYS  54   5.687   9.788   8.974
  371   2HB   LYS  54          2HB       LYS  54   5.891   8.046   8.820
  372   1HG   LYS  54          1HG       LYS  54   7.752   8.415   7.251
  373   2HG   LYS  54          2HG       LYS  54   7.552  10.152   7.448
  374   1HD   LYS  54          1HD       LYS  54   9.370   9.411   8.807
  375   2HD   LYS  54          2HD       LYS  54   8.030   9.899   9.849
  376   1HE   LYS  54          1HE       LYS  54   9.059   7.822  10.655
  377   2HE   LYS  54          2HE       LYS  54   7.402   7.527  10.140
  378   1HZ   LYS  54          1HZ       LYS  54   9.867   6.917   8.598
  379   2HZ   LYS  54          2HZ       LYS  54   8.309   6.675   8.026
  380   3HZ   LYS  54          3HZ       LYS  54   8.863   5.793   9.345
  381    H    HIS  55           H        HIS  55   3.279  10.504   8.071
  382    HA   HIS  55           HA       HIS  55   1.412   8.646   9.192
  383   1HB   HIS  55          1HB       HIS  55   1.643  11.042   9.871
  384   2HB   HIS  55          2HB       HIS  55   1.273  11.524   8.249
  385    HD1  HIS  55           1HD      HIS  55  -0.371  10.500  11.455
  386    HD2  HIS  55           2HD      HIS  55  -1.444  11.530   7.570
  387    HE1  HIS  55           1HE      HIS  55  -2.793  11.073  11.560
  388    H    LEU  56           H        LEU  56   1.466  10.466   6.202
  389    HA   LEU  56           HA       LEU  56  -0.977   9.384   5.258
  390   1HB   LEU  56          1HB       LEU  56   0.617  11.491   4.527
  391   2HB   LEU  56          2HB       LEU  56   0.906  10.341   3.244
  392    HG   LEU  56           HG       LEU  56  -1.431  11.914   3.951
  393   1HD1  LEU  56          1HD1      LEU  56  -0.320  11.048   1.314
  394   2HD1  LEU  56          2HD1      LEU  56   0.104  12.497   2.206
  395   3HD1  LEU  56          3HD1      LEU  56  -1.529  12.312   1.606
  396   1HD2  LEU  56          1HD2      LEU  56  -2.396   9.670   4.150
  397   2HD2  LEU  56          2HD2      LEU  56  -1.723   9.238   2.586
  398   3HD2  LEU  56          3HD2      LEU  56  -2.966  10.478   2.724
  399    H    ALA  57           H        ALA  57   2.466   8.572   4.520
  400    HA   ALA  57           HA       ALA  57   1.852   6.682   2.577
  401   1HB   ALA  57          1HB       ALA  57   4.096   5.790   2.927
  402   2HB   ALA  57          2HB       ALA  57   4.187   6.579   4.498
  403   3HB   ALA  57          3HB       ALA  57   4.161   7.551   3.031
  404    H    ARG  58           H        ARG  58   2.007   6.405   6.008
  405    HA   ARG  58           HA       ARG  58   1.666   3.580   6.216
  406   1HB   ARG  58          1HB       ARG  58   0.787   5.763   8.101
  407   2HB   ARG  58          2HB       ARG  58   0.667   4.055   8.471
  408   1HG   ARG  58          1HG       ARG  58   3.043   3.824   8.447
  409   2HG   ARG  58          2HG       ARG  58   3.235   5.486   7.871
  410   1HD   ARG  58          1HD       ARG  58   2.154   6.298   9.901
  411   2HD   ARG  58          2HD       ARG  58   2.015   4.648  10.490
  412    HE   ARG  58           HE       ARG  58   4.594   4.733  10.141
  413   1HH1  ARG  58          1HH1      ARG  58   2.521   7.190  11.635
  414   2HH1  ARG  58          2HH1      ARG  58   3.775   7.928  12.514
  415   1HH2  ARG  58          1HH2      ARG  58   6.304   5.697  11.408
  416   2HH2  ARG  58          2HH2      ARG  58   5.997   7.030  12.415
  417    H    LYS  59           H        LYS  59  -0.675   6.232   6.349
  418    HA   LYS  59           HA       LYS  59  -2.903   4.658   6.665
  419   1HB   LYS  59          1HB       LYS  59  -3.098   6.954   7.133
  420   2HB   LYS  59          2HB       LYS  59  -2.619   7.410   5.505
  421   1HG   LYS  59          1HG       LYS  59  -4.716   6.729   4.615
  422   2HG   LYS  59          2HG       LYS  59  -5.160   5.924   6.118
  423   1HD   LYS  59          1HD       LYS  59  -6.309   8.090   5.792
  424   2HD   LYS  59          2HD       LYS  59  -5.342   8.023   7.258
  425   1HE   LYS  59          1HE       LYS  59  -3.539   9.251   6.078
  426   2HE   LYS  59          2HE       LYS  59  -4.575   9.347   4.651
  427   1HZ   LYS  59          1HZ       LYS  59  -6.142  10.633   5.872
  428   2HZ   LYS  59          2HZ       LYS  59  -4.637  11.364   5.990
  429   3HZ   LYS  59          3HZ       LYS  59  -5.254  10.469   7.305
  430    H    LEU  60           H        LEU  60  -1.426   5.821   3.658
  431    HA   LEU  60           HA       LEU  60  -3.427   4.994   2.062
  432   1HB   LEU  60          1HB       LEU  60  -0.541   5.402   1.395
  433   2HB   LEU  60          2HB       LEU  60  -1.805   5.310   0.160
  434    HG   LEU  60           HG       LEU  60  -1.938   7.186   2.429
  435   1HD1  LEU  60          1HD1      LEU  60  -1.143   8.942   0.702
  436   2HD1  LEU  60          2HD1      LEU  60  -0.542   7.560  -0.226
  437   3HD1  LEU  60          3HD1      LEU  60   0.044   7.855   1.400
  438   1HD2  LEU  60          1HD2      LEU  60  -3.982   6.766   1.313
  439   2HD2  LEU  60          2HD2      LEU  60  -3.267   7.128  -0.264
  440   3HD2  LEU  60          3HD2      LEU  60  -3.473   8.414   0.931
  441    H    THR  61           H        THR  61  -0.359   3.502   2.966
  442    HA   THR  61           HA       THR  61  -0.371   1.136   1.465
  443    HB   THR  61           HB       THR  61   0.629   1.467   4.325
  444    HG1  THR  61           1HG      THR  61   1.657   2.990   3.071
  445   1HG2  THR  61          1HG2      THR  61   2.207  -0.354   3.730
  446   2HG2  THR  61          2HG2      THR  61   1.459  -0.479   2.145
  447   3HG2  THR  61          3HG2      THR  61   0.534  -0.891   3.587
  448    H    HIS  62           H        HIS  62  -1.820   1.979   4.472
  449    HA   HIS  62           HA       HIS  62  -2.857  -0.689   4.874
  450   1HB   HIS  62          1HB       HIS  62  -2.212   0.897   6.738
  451   2HB   HIS  62          2HB       HIS  62  -3.670   1.803   6.360
  452    HD1  HIS  62           1HD      HIS  62  -2.493  -1.392   7.949
  453    HD2  HIS  62           2HD      HIS  62  -6.064   0.623   7.251
  454    HE1  HIS  62           1HE      HIS  62  -4.192  -2.592   9.296
  455    H    GLY  63           H        GLY  63  -4.153   2.215   3.362
  456   1HA   GLY  63          1HA       GLY  63  -6.872   1.406   3.508
  457   2HA   GLY  63          2HA       GLY  63  -6.215   2.656   2.472
  458    H    VAL  64           H        VAL  64  -4.321   1.020   1.133
  459    HA   VAL  64           HA       VAL  64  -5.995  -0.185  -0.903
  460    HB   VAL  64           HB       VAL  64  -2.981  -0.376  -0.502
  461   1HG1  VAL  64          1HG1      VAL  64  -2.877  -1.024  -2.883
  462   2HG1  VAL  64          2HG1      VAL  64  -4.626  -0.965  -2.976
  463   3HG1  VAL  64          3HG1      VAL  64  -3.842  -2.172  -1.963
  464   1HG2  VAL  64          1HG2      VAL  64  -4.595   1.490  -2.239
  465   2HG2  VAL  64          2HG2      VAL  64  -2.837   1.366  -2.234
  466   3HG2  VAL  64          3HG2      VAL  64  -3.685   1.932  -0.792
  467    H    MET  65           H        MET  65  -4.111  -1.174   1.661
  468    HA   MET  65           HA       MET  65  -4.057  -3.992   1.357
  469   1HB   MET  65          1HB       MET  65  -2.578  -2.862   2.941
  470   2HB   MET  65          2HB       MET  65  -3.951  -2.290   3.845
  471   1HG   MET  65          1HG       MET  65  -4.515  -4.508   4.493
  472   2HG   MET  65          2HG       MET  65  -3.099  -5.142   3.658
  473   1HE   MET  65          1HE       MET  65  -3.814  -5.407   6.666
  474   2HE   MET  65          2HE       MET  65  -2.230  -5.232   7.457
  475   3HE   MET  65          3HE       MET  65  -2.387  -6.189   5.955
  476    H    ASN  66           H        ASN  66  -6.162  -1.856   3.235
  477    HA   ASN  66           HA       ASN  66  -8.014  -3.827   4.115
  478   1HB   ASN  66          1HB       ASN  66  -7.769  -0.919   4.105
  479   2HB   ASN  66          2HB       ASN  66  -9.449  -1.484   4.183
  480   1HD2  ASN  66          1HD2      ASN  66  -6.501  -2.865   5.504
  481   2HD2  ASN  66          2HD2      ASN  66  -6.913  -2.481   7.141
  482    H    LYS  67           H        LYS  67  -7.903  -1.826   1.243
  483    HA   LYS  67           HA       LYS  67 -10.483  -2.333   0.314
  484   1HB   LYS  67          1HB       LYS  67  -8.916  -0.597  -0.557
  485   2HB   LYS  67          2HB       LYS  67  -7.949  -1.867  -1.268
  486   1HG   LYS  67          1HG       LYS  67  -9.785  -2.449  -2.776
  487   2HG   LYS  67          2HG       LYS  67 -10.791  -1.197  -2.034
  488   1HD   LYS  67          1HD       LYS  67  -9.101   0.495  -2.695
  489   2HD   LYS  67          2HD       LYS  67  -8.188  -0.766  -3.511
  490   1HE   LYS  67          1HE       LYS  67 -11.014   0.053  -4.189
  491   2HE   LYS  67          2HE       LYS  67  -9.579   0.596  -5.049
  492   1HZ   LYS  67          1HZ       LYS  67 -10.616  -1.207  -6.235
  493   2HZ   LYS  67          2HZ       LYS  67 -10.606  -2.196  -4.901
  494   3HZ   LYS  67          3HZ       LYS  67  -9.156  -1.766  -5.626
  495    H    GLU  68           H        GLU  68  -7.403  -4.049  -0.373
  496    HA   GLU  68           HA       GLU  68  -8.923  -5.850  -1.864
  497   1HB   GLU  68          1HB       GLU  68  -6.818  -7.029  -2.258
  498   2HB   GLU  68          2HB       GLU  68  -6.904  -5.305  -2.668
  499   1HG   GLU  68          1HG       GLU  68  -5.607  -4.757  -0.707
  500   2HG   GLU  68          2HG       GLU  68  -5.378  -6.466  -0.335
  501    H    LEU  69           H        LEU  69  -7.446  -6.033   1.360
  502    HA   LEU  69           HA       LEU  69  -8.257  -8.650   1.712
  503   1HB   LEU  69          1HB       LEU  69  -8.012  -6.423   3.725
  504   2HB   LEU  69          2HB       LEU  69  -8.328  -8.089   4.172
  505    HG   LEU  69           HG       LEU  69  -5.870  -7.135   2.707
  506   1HD1  LEU  69          1HD1      LEU  69  -6.232  -7.925   5.592
  507   2HD1  LEU  69          2HD1      LEU  69  -5.918  -6.297   4.981
  508   3HD1  LEU  69          3HD1      LEU  69  -4.698  -7.554   4.801
  509   1HD2  LEU  69          1HD2      LEU  69  -5.014  -9.377   3.243
  510   2HD2  LEU  69          2HD2      LEU  69  -6.399  -9.430   2.165
  511   3HD2  LEU  69          3HD2      LEU  69  -6.599  -9.821   3.877
  512    H    LYS  70           H        LYS  70 -10.331  -5.796   1.603
  513    HA   LYS  70           HA       LYS  70 -12.495  -7.270   2.841
  514   1HB   LYS  70          1HB       LYS  70 -13.780  -5.303   2.697
  515   2HB   LYS  70          2HB       LYS  70 -12.172  -4.775   3.127
  516   1HG   LYS  70          1HG       LYS  70 -11.846  -4.332   0.658
  517   2HG   LYS  70          2HG       LYS  70 -13.592  -4.512   0.525
  518   1HD   LYS  70          1HD       LYS  70 -12.083  -2.542   2.211
  519   2HD   LYS  70          2HD       LYS  70 -13.011  -2.219   0.734
  520   1HE   LYS  70          1HE       LYS  70 -14.161  -3.220   3.359
  521   2HE   LYS  70          2HE       LYS  70 -14.213  -1.548   2.830
  522   1HZ   LYS  70          1HZ       LYS  70 -15.557  -2.317   0.890
  523   2HZ   LYS  70          2HZ       LYS  70 -16.275  -2.557   2.373
  524   3HZ   LYS  70          3HZ       LYS  70 -15.604  -3.866   1.577
  525    H    TYR  71           H        TYR  71 -11.373  -6.564  -0.384
  526    HA   TYR  71           HA       TYR  71 -13.782  -7.914  -1.527
  527   1HB   TYR  71          1HB       TYR  71 -11.632  -6.272  -2.831
  528   2HB   TYR  71          2HB       TYR  71 -13.056  -6.974  -3.621
  529    HD1  TYR  71           1HD      TYR  71 -12.048  -3.887  -2.781
  530    HD2  TYR  71           2HD      TYR  71 -15.151  -6.590  -1.644
  531    HE1  TYR  71           1HE      TYR  71 -13.399  -2.030  -1.980
  532    HE2  TYR  71           2HE      TYR  71 -16.463  -4.773  -0.837
  533    HH   TYR  71           HH       TYR  71 -15.771  -1.525  -1.539
  534    H    CYS  72           H        CYS  72 -10.560  -8.675  -0.875
  535    HA   CYS  72           HA       CYS  72 -10.673 -10.987  -2.679
  536   1HB   CYS  72          1HB       CYS  72  -8.536  -9.804  -0.942
  537   2HB   CYS  72          2HB       CYS  72  -8.262 -11.289  -1.806
  538    HG   CYS  72           HG       CYS  72  -7.329 -10.041  -3.876
  539    H    LYS  73           H        LYS  73 -10.787  -9.988   0.611
  540    HA   LYS  73           HA       LYS  73 -11.381 -10.854   2.508
  541   1HB   LYS  73          1HB       LYS  73 -12.373 -13.229   0.924
  542   2HB   LYS  73          2HB       LYS  73 -12.620 -13.034   2.647
  543   1HG   LYS  73          1HG       LYS  73 -14.651 -12.265   1.738
  544   2HG   LYS  73          2HG       LYS  73 -13.715 -10.798   2.038
  545   1HD   LYS  73          1HD       LYS  73 -14.809 -10.630  -0.106
  546   2HD   LYS  73          2HD       LYS  73 -13.068 -10.714  -0.309
  547   1HE   LYS  73          1HE       LYS  73 -14.266 -12.085  -1.964
  548   2HE   LYS  73          2HE       LYS  73 -13.204 -13.054  -0.952
  549   1HZ   LYS  73          1HZ       LYS  73 -15.105 -13.765   0.324
  550   2HZ   LYS  73          2HZ       LYS  73 -15.391 -14.080  -1.287
  551   3HZ   LYS  73          3HZ       LYS  73 -16.129 -12.757  -0.538
  552    H    ASN  74           H        ASN  74  -9.667 -13.205   0.617
  553    HA   ASN  74           HA       ASN  74  -8.206 -13.846   3.059
  554   1HB   ASN  74          1HB       ASN  74  -8.817 -15.588   0.693
  555   2HB   ASN  74          2HB       ASN  74  -7.443 -15.945   1.733
  556   1HD2  ASN  74          1HD2      ASN  74 -10.914 -15.811   1.527
  557   2HD2  ASN  74          2HD2      ASN  74 -11.226 -16.615   3.016
  558    HA   PRO  75           HA       PRO  75  -4.798 -11.701   1.387
  559   1HB   PRO  75          1HB       PRO  75  -2.969 -12.787   2.826
  560   2HB   PRO  75          2HB       PRO  75  -3.973 -11.417   3.314
  561   1HG   PRO  75          1HG       PRO  75  -4.151 -14.354   4.091
  562   2HG   PRO  75          2HG       PRO  75  -4.544 -12.953   5.105
  563   1HD   PRO  75          1HD       PRO  75  -6.388 -14.504   3.902
  564   2HD   PRO  75          2HD       PRO  75  -6.641 -12.769   4.198
  565    H    GLU  76           H        GLU  76  -5.229 -14.780   0.811
  566    HA   GLU  76           HA       GLU  76  -2.648 -15.605  -0.000
  567   1HB   GLU  76          1HB       GLU  76  -4.561 -17.157   0.580
  568   2HB   GLU  76          2HB       GLU  76  -5.313 -16.704  -0.937
  569   1HG   GLU  76          1HG       GLU  76  -3.439 -17.668  -2.165
  570   2HG   GLU  76          2HG       GLU  76  -2.665 -18.103  -0.645
  571    H    ASP  77           H        ASP  77  -4.601 -13.324  -1.003
  572    HA   ASP  77           HA       ASP  77  -3.752 -13.294  -3.867
  573   1HB   ASP  77          1HB       ASP  77  -6.234 -13.750  -3.491
  574   2HB   ASP  77          2HB       ASP  77  -6.326 -12.162  -2.743
  575    H    LEU  78           H        LEU  78  -3.216 -11.997  -0.898
  576    HA   LEU  78           HA       LEU  78  -3.298  -9.206  -1.518
  577   1HB   LEU  78          1HB       LEU  78  -4.051 -10.065   0.619
  578   2HB   LEU  78          2HB       LEU  78  -2.510 -10.899   0.798
  579    HG   LEU  78           HG       LEU  78  -1.521  -8.603   0.657
  580   1HD1  LEU  78          1HD1      LEU  78  -2.934  -6.865   1.726
  581   2HD1  LEU  78          2HD1      LEU  78  -4.308  -7.949   1.569
  582   3HD1  LEU  78          3HD1      LEU  78  -3.506  -7.315   0.109
  583   1HD2  LEU  78          1HD2      LEU  78  -2.989  -9.545   3.067
  584   2HD2  LEU  78          2HD2      LEU  78  -1.726  -8.314   3.076
  585   3HD2  LEU  78          3HD2      LEU  78  -1.350  -9.963   2.567
  586    H    GLU  79           H        GLU  79  -1.648  -8.774  -2.802
  587    HA   GLU  79           HA       GLU  79   1.111  -9.395  -2.061
  588   1HB   GLU  79          1HB       GLU  79   0.177 -11.135  -3.625
  589   2HB   GLU  79          2HB       GLU  79  -0.247  -9.766  -4.660
  590   1HG   GLU  79          1HG       GLU  79   1.603 -10.835  -5.418
  591   2HG   GLU  79          2HG       GLU  79   1.975  -9.190  -4.958
  592    H    CYS  80           H        CYS  80   2.428  -7.790  -2.727
  593    HA   CYS  80           HA       CYS  80   1.206  -5.360  -3.675
  594   1HB   CYS  80          1HB       CYS  80   2.909  -5.038  -2.034
  595   2HB   CYS  80          2HB       CYS  80   4.064  -6.074  -2.821
  596    HG   CYS  80           HG       CYS  80   3.132  -2.899  -3.523
  597    H    ASN  81           H        ASN  81   0.469  -6.498  -5.520
  598    HA   ASN  81           HA       ASN  81   2.634  -7.091  -7.241
  599   1HB   ASN  81          1HB       ASN  81   1.113  -8.326  -8.744
  600   2HB   ASN  81          2HB       ASN  81   0.886  -8.851  -7.072
  601   1HD2  ASN  81          1HD2      ASN  81  -1.025  -8.434  -6.183
  602   2HD2  ASN  81          2HD2      ASN  81  -2.382  -7.832  -7.030
  603    H    GLU  82           H        GLU  82   1.833  -6.724  -9.672
  604    HA   GLU  82           HA       GLU  82   2.020  -4.217 -10.369
  605   1HB   GLU  82          1HB       GLU  82   0.914  -6.615 -11.427
  606   2HB   GLU  82          2HB       GLU  82   0.752  -5.201 -12.479
  607   1HG   GLU  82          1HG       GLU  82   2.844  -6.369 -13.090
  608   2HG   GLU  82          2HG       GLU  82   3.164  -4.834 -12.257
  609    H    ASN  83           H        ASN  83  -1.001  -6.052 -10.282
  610    HA   ASN  83           HA       ASN  83  -2.918  -4.152 -10.961
  611   1HB   ASN  83          1HB       ASN  83  -3.436  -6.554 -10.717
  612   2HB   ASN  83          2HB       ASN  83  -3.046  -6.470  -9.005
  613   1HD2  ASN  83          1HD2      ASN  83  -4.633  -5.809  -7.566
  614   2HD2  ASN  83          2HD2      ASN  83  -6.221  -5.412  -8.037
  615    H    VAL  84           H        VAL  84  -1.608  -5.161  -7.810
  616    HA   VAL  84           HA       VAL  84  -3.156  -3.366  -6.395
  617    HB   VAL  84           HB       VAL  84  -0.566  -4.751  -5.676
  618   1HG1  VAL  84          1HG1      VAL  84  -1.135  -4.316  -3.323
  619   2HG1  VAL  84          2HG1      VAL  84  -2.360  -3.148  -3.818
  620   3HG1  VAL  84          3HG1      VAL  84  -0.642  -2.872  -4.165
  621   1HG2  VAL  84          1HG2      VAL  84  -3.404  -5.194  -4.925
  622   2HG2  VAL  84          2HG2      VAL  84  -2.028  -6.142  -4.382
  623   3HG2  VAL  84          3HG2      VAL  84  -2.474  -6.132  -6.101
  624    H    LYS  85           H        LYS  85   0.150  -3.148  -7.561
  625    HA   LYS  85           HA       LYS  85   0.945  -0.586  -6.639
  626   1HB   LYS  85          1HB       LYS  85   1.601  -1.948  -9.241
  627   2HB   LYS  85          2HB       LYS  85   2.440  -0.548  -8.589
  628   1HG   LYS  85          1HG       LYS  85   3.239  -1.792  -6.751
  629   2HG   LYS  85          2HG       LYS  85   2.245  -3.187  -7.195
  630   1HD   LYS  85          1HD       LYS  85   3.513  -3.219  -9.373
  631   2HD   LYS  85          2HD       LYS  85   4.606  -2.038  -8.646
  632   1HE   LYS  85          1HE       LYS  85   5.068  -3.553  -6.838
  633   2HE   LYS  85          2HE       LYS  85   3.897  -4.684  -7.525
  634   1HZ   LYS  85          1HZ       LYS  85   6.381  -3.813  -8.914
  635   2HZ   LYS  85          2HZ       LYS  85   5.284  -4.986  -9.445
  636   3HZ   LYS  85          3HZ       LYS  85   6.223  -5.276  -8.096
  637    H    HIS  86           H        HIS  86  -0.549  -1.506  -9.558
  638    HA   HIS  86           HA       HIS  86  -0.718   0.952 -10.830
  639   1HB   HIS  86          1HB       HIS  86  -1.179  -1.100 -12.035
  640   2HB   HIS  86          2HB       HIS  86  -2.582  -1.421 -11.033
  641    HD1  HIS  86           1HD      HIS  86  -1.413   0.937 -13.757
  642    HD2  HIS  86           2HD      HIS  86  -4.932  -0.355 -11.960
  643    HE1  HIS  86           1HE      HIS  86  -3.257   1.877 -15.157
  644    H    LYS  87           H        LYS  87  -3.143  -0.676  -8.885
  645    HA   LYS  87           HA       LYS  87  -5.030   1.451  -8.972
  646   1HB   LYS  87          1HB       LYS  87  -4.771  -0.841  -7.045
  647   2HB   LYS  87          2HB       LYS  87  -6.147   0.255  -7.120
  648   1HG   LYS  87          1HG       LYS  87  -6.556  -0.433  -9.414
  649   2HG   LYS  87          2HG       LYS  87  -5.199  -1.551  -9.313
  650   1HD   LYS  87          1HD       LYS  87  -6.289  -2.813  -7.620
  651   2HD   LYS  87          2HD       LYS  87  -7.581  -1.611  -7.499
  652   1HE   LYS  87          1HE       LYS  87  -6.922  -3.218  -9.941
  653   2HE   LYS  87          2HE       LYS  87  -8.239  -3.586  -8.824
  654   1HZ   LYS  87          1HZ       LYS  87  -7.974  -1.122 -10.484
  655   2HZ   LYS  87          2HZ       LYS  87  -9.171  -1.394  -9.335
  656   3HZ   LYS  87          3HZ       LYS  87  -9.094  -2.368 -10.701
  657    H    THR  88           H        THR  88  -2.419   0.814  -7.034
  658    HA   THR  88           HA       THR  88  -3.164   2.477  -4.868
  659    HB   THR  88           HB       THR  88  -0.666   1.148  -5.708
  660    HG1  THR  88           1HG      THR  88  -2.124  -0.179  -4.841
  661   1HG2  THR  88          1HG2      THR  88   0.308   1.928  -3.568
  662   2HG2  THR  88          2HG2      THR  88  -1.137   2.951  -3.341
  663   3HG2  THR  88          3HG2      THR  88  -0.070   3.201  -4.737
  664    H    LYS  89           H        LYS  89  -0.680   2.883  -7.315
  665    HA   LYS  89           HA       LYS  89  -0.249   5.422  -6.420
  666   1HB   LYS  89          1HB       LYS  89   0.891   5.724  -8.789
  667   2HB   LYS  89          2HB       LYS  89   1.566   4.761  -7.494
  668   1HG   LYS  89          1HG       LYS  89   1.786   3.488  -9.451
  669   2HG   LYS  89          2HG       LYS  89   0.468   2.764  -8.528
  670   1HD   LYS  89          1HD       LYS  89  -0.078   2.762 -10.712
  671   2HD   LYS  89          2HD       LYS  89  -1.043   3.954  -9.856
  672   1HE   LYS  89          1HE       LYS  89   0.329   5.807 -10.711
  673   2HE   LYS  89          2HE       LYS  89   1.464   4.677 -11.436
  674   1HZ   LYS  89          1HZ       LYS  89   0.151   5.658 -13.069
  675   2HZ   LYS  89          2HZ       LYS  89  -1.290   5.320 -12.314
  676   3HZ   LYS  89          3HZ       LYS  89  -0.352   4.049 -12.995
  677    H    GLU  90           H        GLU  90  -2.429   4.149  -8.826
  678    HA   GLU  90           HA       GLU  90  -3.447   6.607  -9.849
  679   1HB   GLU  90          1HB       GLU  90  -4.818   3.935  -9.503
  680   2HB   GLU  90          2HB       GLU  90  -5.572   5.310 -10.291
  681   1HG   GLU  90          1HG       GLU  90  -3.043   3.950 -11.182
  682   2HG   GLU  90          2HG       GLU  90  -4.640   3.725 -11.893
  683    H    TYR  91           H        TYR  91  -4.190   4.768  -6.921
  684    HA   TYR  91           HA       TYR  91  -6.506   6.243  -6.214
  685   1HB   TYR  91          1HB       TYR  91  -6.496   4.144  -5.194
  686   2HB   TYR  91          2HB       TYR  91  -4.767   4.186  -4.898
  687    HD1  TYR  91           1HD      TYR  91  -7.839   6.040  -3.807
  688    HD2  TYR  91           2HD      TYR  91  -4.086   4.365  -2.715
  689    HE1  TYR  91           1HE      TYR  91  -8.232   6.672  -1.468
  690    HE2  TYR  91           2HE      TYR  91  -4.448   4.990  -0.406
  691    HH   TYR  91           HH       TYR  91  -7.492   5.923   0.723
  692    H    ILE  92           H        ILE  92  -3.148   6.123  -5.216
  693    HA   ILE  92           HA       ILE  92  -2.992   8.199  -3.408
  694    HB   ILE  92           HB       ILE  92  -1.004   7.485  -5.567
  695   1HG1  ILE  92          1HG1      ILE  92  -1.846   5.823  -3.741
  696   2HG1  ILE  92          2HG1      ILE  92  -0.118   5.823  -4.163
  697   1HG2  ILE  92          1HG2      ILE  92   0.706   8.587  -4.182
  698   2HG2  ILE  92          2HG2      ILE  92  -0.573   9.058  -3.047
  699   3HG2  ILE  92          3HG2      ILE  92  -0.593   9.692  -4.684
  700   1HD1  ILE  92          1HD1      ILE  92   0.184   7.211  -2.170
  701   2HD1  ILE  92          2HD1      ILE  92  -0.525   5.622  -1.821
  702   3HD1  ILE  92          3HD1      ILE  92  -1.552   7.068  -1.868
  703    H    LYS  93           H        LYS  93  -2.553   8.509  -6.918
  704    HA   LYS  93           HA       LYS  93  -2.186  11.257  -6.836
  705   1HB   LYS  93          1HB       LYS  93  -3.415   9.599  -9.051
  706   2HB   LYS  93          2HB       LYS  93  -2.925  11.280  -9.215
  707   1HG   LYS  93          1HG       LYS  93  -0.606  10.657  -8.735
  708   2HG   LYS  93          2HG       LYS  93  -1.099   8.975  -8.558
  709   1HD   LYS  93          1HD       LYS  93  -0.141   9.303 -10.756
  710   2HD   LYS  93          2HD       LYS  93  -1.867   8.996 -10.916
  711   1HE   LYS  93          1HE       LYS  93  -2.281  11.383 -11.206
  712   2HE   LYS  93          2HE       LYS  93  -0.566  11.723 -10.977
  713   1HZ   LYS  93          1HZ       LYS  93  -1.777  10.155 -13.174
  714   2HZ   LYS  93          2HZ       LYS  93  -0.116  10.410 -12.965
  715   3HZ   LYS  93          3HZ       LYS  93  -1.145  11.709 -13.294
  716    H    LYS  94           H        LYS  94  -5.147   9.373  -7.195
  717    HA   LYS  94           HA       LYS  94  -6.721  11.690  -7.619
  718   1HB   LYS  94          1HB       LYS  94  -7.549   8.910  -6.784
  719   2HB   LYS  94          2HB       LYS  94  -8.683  10.167  -7.254
  720   1HG   LYS  94          1HG       LYS  94  -6.593   8.874  -9.003
  721   2HG   LYS  94          2HG       LYS  94  -8.326   8.581  -9.066
  722   1HD   LYS  94          1HD       LYS  94  -8.618  11.013  -9.604
  723   2HD   LYS  94          2HD       LYS  94  -6.865  11.122  -9.737
  724   1HE   LYS  94          1HE       LYS  94  -7.852  10.829 -11.939
  725   2HE   LYS  94          2HE       LYS  94  -6.890   9.418 -11.501
  726   1HZ   LYS  94          1HZ       LYS  94  -9.024   8.822 -12.519
  727   2HZ   LYS  94          2HZ       LYS  94  -9.858   9.588 -11.280
  728   3HZ   LYS  94          3HZ       LYS  94  -8.918   8.236 -10.952
  729    H    TYR  95           H        TYR  95  -5.781   9.819  -4.842
  730    HA   TYR  95           HA       TYR  95  -7.428  11.063  -2.989
  731   1HB   TYR  95          1HB       TYR  95  -6.359   9.027  -2.503
  732   2HB   TYR  95          2HB       TYR  95  -4.794   9.749  -2.910
  733    HD1  TYR  95           1HD      TYR  95  -7.650   9.988  -0.414
  734    HD2  TYR  95           2HD      TYR  95  -3.504  10.661  -1.209
  735    HE1  TYR  95           1HE      TYR  95  -7.285  10.615   1.908
  736    HE2  TYR  95           2HE      TYR  95  -3.186  11.316   1.074
  737    HH   TYR  95           HH       TYR  95  -5.822  11.012   3.433
  738    H    MET  96           H        MET  96  -4.066  11.742  -3.816
  739    HA   MET  96           HA       MET  96  -3.806  13.940  -2.116
  740   1HB   MET  96          1HB       MET  96  -2.363  13.664  -4.744
  741   2HB   MET  96          2HB       MET  96  -1.871  14.575  -3.320
  742   1HG   MET  96          1HG       MET  96  -2.039  11.576  -3.505
  743   2HG   MET  96          2HG       MET  96  -0.563  12.532  -3.562
  744   1HE   MET  96          1HE       MET  96  -0.527  14.080  -0.002
  745   2HE   MET  96          2HE       MET  96  -1.405  14.725  -1.411
  746   3HE   MET  96          3HE       MET  96   0.202  14.054  -1.632
  747    H    GLN  97           H        GLN  97  -5.315  13.729  -5.103
  748    HA   GLN  97           HA       GLN  97  -5.300  16.488  -5.821
  749   1HB   GLN  97          1HB       GLN  97  -7.596  14.639  -6.474
  750   2HB   GLN  97          2HB       GLN  97  -7.158  16.118  -7.309
  751   1HG   GLN  97          1HG       GLN  97  -5.755  13.480  -7.313
  752   2HG   GLN  97          2HG       GLN  97  -6.434  14.349  -8.683
  753   1HE2  GLN  97          1HE2      GLN  97  -3.834  13.903  -6.595
  754   2HE2  GLN  97          2HE2      GLN  97  -2.663  14.947  -7.280
  755    H    LYS  98           H        LYS  98  -7.006  14.903  -3.359
  756    HA   LYS  98           HA       LYS  98  -9.111  16.830  -3.177
  757   1HB   LYS  98          1HB       LYS  98  -9.904  15.613  -1.298
  758   2HB   LYS  98          2HB       LYS  98  -9.372  14.471  -2.519
  759   1HG   LYS  98          1HG       LYS  98  -8.409  13.449  -0.738
  760   2HG   LYS  98          2HG       LYS  98  -7.152  14.581  -1.111
  761   1HD   LYS  98          1HD       LYS  98  -7.537  14.640   1.264
  762   2HD   LYS  98          2HD       LYS  98  -8.018  16.174   0.540
  763   1HE   LYS  98          1HE       LYS  98  -9.657  15.488   2.151
  764   2HE   LYS  98          2HE       LYS  98 -10.357  15.418   0.556
  765   1HZ   LYS  98          1HZ       LYS  98 -10.885  13.506   1.898
  766   2HZ   LYS  98          2HZ       LYS  98  -9.233  13.038   1.940
  767   3HZ   LYS  98          3HZ       LYS  98 -10.091  13.068   0.486
  768    H    PHE  99           H        PHE  99  -5.919  16.639  -1.951
  769    HA   PHE  99           HA       PHE  99  -6.421  18.438   0.250
  770   1HB   PHE  99          1HB       PHE  99  -3.775  17.499  -0.888
  771   2HB   PHE  99          2HB       PHE  99  -3.961  18.530   0.530
  772    HD1  PHE  99           1HD      PHE  99  -5.700  17.538   2.305
  773    HD2  PHE  99           2HD      PHE  99  -3.387  15.269  -0.463
  774    HE1  PHE  99           1HE      PHE  99  -5.882  15.576   3.765
  775    HE2  PHE  99           2HE      PHE  99  -3.565  13.286   1.053
  776    HZ   PHE  99           HZ       PHE  99  -4.879  13.456   3.094
  777    H    GLY 100           H        GLY 100  -5.244  18.707  -3.014
  778   1HA   GLY 100          1HA       GLY 100  -5.645  20.665  -4.241
  779   2HA   GLY 100          2HA       GLY 100  -5.494  21.591  -2.742
  780    H    ALA 101           H        ALA 101  -3.762  22.684  -2.736
  781    HA   ALA 101           HA       ALA 101  -1.457  21.958  -4.335
  782   1HB   ALA 101          1HB       ALA 101  -2.193  24.275  -4.132
  783   2HB   ALA 101          2HB       ALA 101  -0.518  24.055  -3.600
  784   3HB   ALA 101          3HB       ALA 101  -1.815  24.232  -2.410
  785    H    VAL 102           H        VAL 102  -2.203  22.040  -0.861
  786    HA   VAL 102           HA       VAL 102   0.389  20.723  -0.447
  787    HB   VAL 102           HB       VAL 102  -0.884  22.286   1.750
  788   1HG1  VAL 102          1HG1      VAL 102   1.390  22.686   2.496
  789   2HG1  VAL 102          2HG1      VAL 102   1.981  21.807   1.084
  790   3HG1  VAL 102          3HG1      VAL 102   1.008  20.973   2.298
  791   1HG2  VAL 102          1HG2      VAL 102   0.788  23.629  -0.357
  792   2HG2  VAL 102          2HG2      VAL 102   0.252  24.356   1.170
  793   3HG2  VAL 102          3HG2      VAL 102  -0.933  23.867  -0.049
  794    H    TYR 103           H        TYR 103   0.419  19.307   1.364
  795    HA   TYR 103           HA       TYR 103  -2.021  17.856   1.480
  796   1HB   TYR 103          1HB       TYR 103  -0.196  16.450   1.001
  797   2HB   TYR 103          2HB       TYR 103   0.829  17.271   2.168
  798    HD1  TYR 103           1HD      TYR 103  -2.538  15.799   2.638
  799    HD2  TYR 103           2HD      TYR 103   1.560  15.601   3.556
  800    HE1  TYR 103           1HE      TYR 103  -3.039  14.109   4.270
  801    HE2  TYR 103           2HE      TYR 103   1.105  13.834   5.232
  802    HH   TYR 103           HH       TYR 103  -0.698  13.165   6.608
  803    H    LYS 104           H        LYS 104  -3.328  18.740   2.791
  804    HA   LYS 104           HA       LYS 104  -2.542  19.146   5.574
  805   1HB   LYS 104          1HB       LYS 104  -4.753  20.320   3.913
  806   2HB   LYS 104          2HB       LYS 104  -4.717  20.495   5.652
  807   1HG   LYS 104          1HG       LYS 104  -2.576  21.700   5.481
  808   2HG   LYS 104          2HG       LYS 104  -2.578  21.465   3.736
  809   1HD   LYS 104          1HD       LYS 104  -4.666  23.021   5.280
  810   2HD   LYS 104          2HD       LYS 104  -3.307  23.741   4.417
  811   1HE   LYS 104          1HE       LYS 104  -4.154  22.748   2.321
  812   2HE   LYS 104          2HE       LYS 104  -5.534  22.101   3.203
  813   1HZ   LYS 104          1HZ       LYS 104  -6.119  24.120   2.071
  814   2HZ   LYS 104          2HZ       LYS 104  -4.909  24.996   2.823
  815   3HZ   LYS 104          3HZ       LYS 104  -6.196  24.402   3.723
  816    HA   PRO 105           HA       PRO 105  -4.915  15.147   5.529
  817   1HB   PRO 105          1HB       PRO 105  -4.095  14.456   8.076
  818   2HB   PRO 105          2HB       PRO 105  -3.239  14.029   6.591
  819   1HG   PRO 105          1HG       PRO 105  -2.763  16.246   8.495
  820   2HG   PRO 105          2HG       PRO 105  -1.575  15.214   7.631
  821   1HD   PRO 105          1HD       PRO 105  -2.102  17.749   6.928
  822   2HD   PRO 105          2HD       PRO 105  -1.728  16.539   5.701
  823    H    LYS 106           H        LYS 106  -4.839  17.614   7.967
  824    HA   LYS 106           HA       LYS 106  -7.133  17.059   9.404
  825   1HB   LYS 106          1HB       LYS 106  -6.089  19.745   8.494
  826   2HB   LYS 106          2HB       LYS 106  -7.285  19.513   9.762
  827   1HG   LYS 106          1HG       LYS 106  -5.719  18.450  11.184
  828   2HG   LYS 106          2HG       LYS 106  -4.539  18.292   9.883
  829   1HD   LYS 106          1HD       LYS 106  -3.936  20.092  11.434
  830   2HD   LYS 106          2HD       LYS 106  -4.259  20.703   9.817
  831   1HE   LYS 106          1HE       LYS 106  -6.502  21.392  10.537
  832   2HE   LYS 106          2HE       LYS 106  -6.161  20.789  12.159
  833   1HZ   LYS 106          1HZ       LYS 106  -5.829  23.195  11.948
  834   2HZ   LYS 106          2HZ       LYS 106  -4.647  22.936  10.785
  835   3HZ   LYS 106          3HZ       LYS 106  -4.407  22.399  12.368
  836    H    GLU 107           H        GLU 107  -6.869  17.897   6.114
  837    HA   GLU 107           HA       GLU 107  -9.704  18.593   5.844
  838   1HB   GLU 107          1HB       GLU 107  -7.415  18.755   3.873
  839   2HB   GLU 107          2HB       GLU 107  -9.066  19.241   3.546
  840   1HG   GLU 107          1HG       GLU 107  -7.259  20.493   5.600
  841   2HG   GLU 107          2HG       GLU 107  -7.581  21.138   3.992
  842    H    ASP 108           H        ASP 108  -7.972  15.800   6.045
  843    HA   ASP 108           HA       ASP 108  -8.596  14.664   3.558
  844   1HB   ASP 108          1HB       ASP 108  -6.552  14.052   4.736
  845   2HB   ASP 108          2HB       ASP 108  -7.493  13.342   6.036
  846    H    THR 109           H        THR 109  -9.595  12.383   3.782
  847    HA   THR 109           HA       THR 109 -12.331  12.731   4.515
  848    HB   THR 109           HB       THR 109 -11.711  11.772   2.339
  849    HG1  THR 109           1HG      THR 109 -13.618  10.979   3.582
  850   1HG2  THR 109          1HG2      THR 109  -9.626  10.754   2.994
  851   2HG2  THR 109          2HG2      THR 109 -10.642   9.566   2.159
  852   3HG2  THR 109          3HG2      THR 109 -10.473   9.526   3.925
  Start of MODEL   16
    1    H    THR  10           H        THR  10  -3.582 -23.411   4.063
    2    HA   THR  10           HA       THR  10  -3.267 -22.545   6.083
    3    HB   THR  10           HB       THR  10  -0.895 -22.561   7.022
    4    HG1  THR  10           1HG      THR  10  -0.306 -22.735   4.374
    5   1HG2  THR  10          1HG2      THR  10  -0.568 -24.981   6.874
    6   2HG2  THR  10          2HG2      THR  10  -1.703 -25.048   5.529
    7   3HG2  THR  10          3HG2      THR  10  -2.264 -24.570   7.130
    8    H    SER  11           H        SER  11  -3.915 -20.811   4.316
    9    HA   SER  11           HA       SER  11  -2.215 -18.488   3.978
   10   1HB   SER  11          1HB       SER  11  -5.079 -18.903   3.536
   11   2HB   SER  11          2HB       SER  11  -3.997 -17.743   2.705
   12    HG   SER  11           HG       SER  11  -4.219 -19.527   1.277
   13    H    SER  12           H        SER  12  -3.949 -19.545   6.478
   14    HA   SER  12           HA       SER  12  -4.724 -16.992   7.350
   15   1HB   SER  12          1HB       SER  12  -4.996 -18.416   9.474
   16   2HB   SER  12          2HB       SER  12  -5.905 -18.843   7.990
   17    HG   SER  12           HG       SER  12  -5.140 -20.698   8.544
   18    H    GLU  13           H        GLU  13  -2.016 -19.360   8.130
   19    HA   GLU  13           HA       GLU  13  -0.679 -17.411   9.623
   20   1HB   GLU  13          1HB       GLU  13   0.884 -19.254   9.982
   21   2HB   GLU  13          2HB       GLU  13  -0.773 -19.715  10.341
   22   1HG   GLU  13          1HG       GLU  13  -0.420 -21.507   9.060
   23   2HG   GLU  13          2HG       GLU  13  -0.471 -20.394   7.696
   24    H    LEU  14           H        LEU  14  -0.442 -18.837   6.407
   25    HA   LEU  14           HA       LEU  14   2.146 -18.129   5.657
   26   1HB   LEU  14          1HB       LEU  14   0.540 -19.579   4.447
   27   2HB   LEU  14          2HB       LEU  14  -0.287 -18.135   3.928
   28    HG   LEU  14           HG       LEU  14   1.684 -17.366   2.705
   29   1HD1  LEU  14          1HD1      LEU  14   2.928 -19.979   3.547
   30   2HD1  LEU  14          2HD1      LEU  14   3.448 -18.366   4.046
   31   3HD1  LEU  14          3HD1      LEU  14   3.592 -18.863   2.364
   32   1HD2  LEU  14          1HD2      LEU  14   1.645 -19.044   0.927
   33   2HD2  LEU  14          2HD2      LEU  14   0.030 -18.703   1.546
   34   3HD2  LEU  14          3HD2      LEU  14   0.862 -20.183   2.025
   35    H    ALA  15           H        ALA  15  -0.733 -16.599   5.691
   36    HA   ALA  15           HA       ALA  15   0.125 -14.289   4.202
   37   1HB   ALA  15          1HB       ALA  15  -2.133 -14.963   3.755
   38   2HB   ALA  15          2HB       ALA  15  -2.074 -13.327   4.413
   39   3HB   ALA  15          3HB       ALA  15  -2.565 -14.676   5.442
   40    H    LYS  16           H        LYS  16   0.014 -15.208   7.452
   41    HA   LYS  16           HA       LYS  16  -0.056 -12.700   8.698
   42   1HB   LYS  16          1HB       LYS  16  -0.125 -14.777   9.997
   43   2HB   LYS  16          2HB       LYS  16   1.487 -15.199   9.446
   44   1HG   LYS  16          1HG       LYS  16   2.392 -13.266  10.650
   45   2HG   LYS  16          2HG       LYS  16   0.775 -12.873  11.223
   46   1HD   LYS  16          1HD       LYS  16   0.651 -15.055  12.332
   47   2HD   LYS  16          2HD       LYS  16   2.284 -15.419  11.771
   48   1HE   LYS  16          1HE       LYS  16   3.132 -13.494  13.014
   49   2HE   LYS  16          2HE       LYS  16   1.497 -13.142  13.568
   50   1HZ   LYS  16          1HZ       LYS  16   3.085 -15.570  14.198
   51   2HZ   LYS  16          2HZ       LYS  16   1.471 -15.344  14.602
   52   3HZ   LYS  16          3HZ       LYS  16   2.637 -14.318  15.264
   53    H    LYS  17           H        LYS  17   2.434 -14.533   7.092
   54    HA   LYS  17           HA       LYS  17   4.415 -12.490   7.474
   55   1HB   LYS  17          1HB       LYS  17   4.400 -14.984   5.758
   56   2HB   LYS  17          2HB       LYS  17   5.700 -13.815   5.701
   57   1HG   LYS  17          1HG       LYS  17   6.478 -15.504   7.102
   58   2HG   LYS  17          2HG       LYS  17   5.975 -14.219   8.188
   59   1HD   LYS  17          1HD       LYS  17   5.246 -16.250   9.153
   60   2HD   LYS  17          2HD       LYS  17   3.806 -15.491   8.475
   61   1HE   LYS  17          1HE       LYS  17   3.891 -16.965   6.547
   62   2HE   LYS  17          2HE       LYS  17   5.416 -17.652   7.102
   63   1HZ   LYS  17          1HZ       LYS  17   2.836 -17.818   8.537
   64   2HZ   LYS  17          2HZ       LYS  17   4.255 -18.541   9.050
   65   3HZ   LYS  17          3HZ       LYS  17   3.476 -19.103   7.663
   66    H    SER  18           H        SER  18   2.274 -13.596   4.874
   67    HA   SER  18           HA       SER  18   3.468 -12.061   2.905
   68   1HB   SER  18          1HB       SER  18   1.943 -14.063   2.546
   69   2HB   SER  18          2HB       SER  18   0.593 -12.960   2.833
   70    HG   SER  18           HG       SER  18   1.869 -11.691   1.087
   71    H    LYS  19           H        LYS  19   0.887 -11.145   5.143
   72    HA   LYS  19           HA       LYS  19   0.201  -8.697   3.740
   73   1HB   LYS  19          1HB       LYS  19  -0.181  -9.210   6.691
   74   2HB   LYS  19          2HB       LYS  19  -1.055  -8.068   5.687
   75   1HG   LYS  19          1HG       LYS  19  -1.949 -10.191   4.451
   76   2HG   LYS  19          2HG       LYS  19  -1.334 -11.048   5.843
   77   1HD   LYS  19          1HD       LYS  19  -3.403  -8.857   5.891
   78   2HD   LYS  19          2HD       LYS  19  -3.697 -10.580   6.107
   79   1HE   LYS  19          1HE       LYS  19  -2.061  -8.801   7.876
   80   2HE   LYS  19          2HE       LYS  19  -3.688  -9.381   8.217
   81   1HZ   LYS  19          1HZ       LYS  19  -2.850 -11.642   8.272
   82   2HZ   LYS  19          2HZ       LYS  19  -2.067 -10.707   9.388
   83   3HZ   LYS  19          3HZ       LYS  19  -1.271 -11.128   7.957
   84    H    GLU  20           H        GLU  20   2.580  -9.569   6.040
   85    HA   GLU  20           HA       GLU  20   3.236  -6.844   6.636
   86   1HB   GLU  20          1HB       GLU  20   4.751  -9.371   7.195
   87   2HB   GLU  20          2HB       GLU  20   4.984  -7.798   7.973
   88   1HG   GLU  20          1HG       GLU  20   2.457  -9.242   7.894
   89   2HG   GLU  20          2HG       GLU  20   3.594  -9.497   9.243
   90    H    VAL  21           H        VAL  21   4.548  -9.458   4.711
   91    HA   VAL  21           HA       VAL  21   6.712  -7.981   3.586
   92    HB   VAL  21           HB       VAL  21   5.138 -10.308   2.418
   93   1HG1  VAL  21          1HG1      VAL  21   7.098 -10.681   0.997
   94   2HG1  VAL  21          2HG1      VAL  21   7.881  -9.266   1.697
   95   3HG1  VAL  21          3HG1      VAL  21   6.425  -9.072   0.720
   96   1HG2  VAL  21          1HG2      VAL  21   6.162 -10.911   4.539
   97   2HG2  VAL  21          2HG2      VAL  21   7.724 -10.319   3.972
   98   3HG2  VAL  21          3HG2      VAL  21   6.985 -11.723   3.206
   99    H    PHE  22           H        PHE  22   3.332  -8.365   2.732
  100    HA   PHE  22           HA       PHE  22   3.444  -6.884   0.260
  101   1HB   PHE  22          1HB       PHE  22   1.480  -8.130   0.407
  102   2HB   PHE  22          2HB       PHE  22   1.285  -7.800   2.121
  103    HD1  PHE  22           1HD      PHE  22  -0.368  -6.321   2.773
  104    HD2  PHE  22           2HD      PHE  22   1.153  -6.019  -1.183
  105    HE1  PHE  22           1HE      PHE  22  -1.974  -4.574   2.301
  106    HE2  PHE  22           2HE      PHE  22  -0.481  -4.249  -1.655
  107    HZ   PHE  22           HZ       PHE  22  -2.080  -3.532   0.118
  108    H    ARG  23           H        ARG  23   2.445  -6.039   3.475
  109    HA   ARG  23           HA       ARG  23   2.186  -3.317   2.813
  110   1HB   ARG  23          1HB       ARG  23   1.913  -2.763   5.139
  111   2HB   ARG  23          2HB       ARG  23   1.145  -4.305   4.802
  112   1HG   ARG  23          1HG       ARG  23   2.147  -4.897   6.770
  113   2HG   ARG  23          2HG       ARG  23   3.465  -5.175   5.619
  114   1HD   ARG  23          1HD       ARG  23   4.636  -3.315   6.203
  115   2HD   ARG  23          2HD       ARG  23   3.234  -2.518   6.919
  116    HE   ARG  23           HE       ARG  23   3.490  -3.723   8.837
  117   1HH1  ARG  23          1HH1      ARG  23   5.719  -5.150   6.523
  118   2HH1  ARG  23          2HH1      ARG  23   6.852  -5.644   7.698
  119   1HH2  ARG  23          1HH2      ARG  23   4.991  -4.473  10.439
  120   2HH2  ARG  23          2HH2      ARG  23   6.446  -5.248   9.998
  121    H    LYS  24           H        LYS  24   5.049  -5.124   3.557
  122    HA   LYS  24           HA       LYS  24   6.600  -2.866   4.035
  123   1HB   LYS  24          1HB       LYS  24   7.242  -5.691   3.437
  124   2HB   LYS  24          2HB       LYS  24   8.492  -4.534   3.024
  125   1HG   LYS  24          1HG       LYS  24   7.247  -4.845   5.749
  126   2HG   LYS  24          2HG       LYS  24   8.800  -5.517   5.242
  127   1HD   LYS  24          1HD       LYS  24   9.637  -3.262   4.798
  128   2HD   LYS  24          2HD       LYS  24   8.091  -2.579   5.288
  129   1HE   LYS  24          1HE       LYS  24   8.414  -3.534   7.530
  130   2HE   LYS  24          2HE       LYS  24   9.994  -4.135   7.030
  131   1HZ   LYS  24          1HZ       LYS  24  10.697  -1.863   6.633
  132   2HZ   LYS  24          2HZ       LYS  24  10.150  -2.019   8.224
  133   3HZ   LYS  24          3HZ       LYS  24   9.171  -1.292   7.065
  134    H    GLU  25           H        GLU  25   6.087  -4.802   1.051
  135    HA   GLU  25           HA       GLU  25   7.750  -3.047  -0.430
  136   1HB   GLU  25          1HB       GLU  25   6.368  -4.320  -2.321
  137   2HB   GLU  25          2HB       GLU  25   7.834  -5.014  -1.577
  138   1HG   GLU  25          1HG       GLU  25   6.202  -6.190  -0.073
  139   2HG   GLU  25          2HG       GLU  25   4.923  -5.573  -1.110
  140    H    MET  26           H        MET  26   4.353  -3.171   0.194
  141    HA   MET  26           HA       MET  26   3.789  -1.250  -1.805
  142   1HB   MET  26          1HB       MET  26   2.183  -2.869  -1.057
  143   2HB   MET  26          2HB       MET  26   2.200  -2.138   0.534
  144   1HG   MET  26          1HG       MET  26   0.255  -1.466  -1.042
  145   2HG   MET  26          2HG       MET  26   1.080  -0.220  -0.112
  146   1HE   MET  26          1HE       MET  26   1.797  -2.055  -3.728
  147   2HE   MET  26          2HE       MET  26   1.341  -0.622  -4.699
  148   3HE   MET  26          3HE       MET  26   0.131  -1.420  -3.717
  149    H    SER  27           H        SER  27   4.405  -1.090   1.610
  150    HA   SER  27           HA       SER  27   3.835   1.655   1.868
  151   1HB   SER  27          1HB       SER  27   5.480   1.729   3.750
  152   2HB   SER  27          2HB       SER  27   4.175   0.530   3.963
  153    HG   SER  27           HG       SER  27   5.573  -1.009   3.510
  154    H    GLN  28           H        GLN  28   6.650  -0.095   0.975
  155    HA   GLN  28           HA       GLN  28   8.344   2.177   0.596
  156   1HB   GLN  28          1HB       GLN  28   8.430  -0.557  -0.659
  157   2HB   GLN  28          2HB       GLN  28   9.695   0.648  -0.841
  158   1HG   GLN  28          1HG       GLN  28  10.178   0.563   1.502
  159   2HG   GLN  28          2HG       GLN  28   8.800  -0.489   1.784
  160   1HE2  GLN  28          1HE2      GLN  28  10.114  -2.069   2.649
  161   2HE2  GLN  28          2HE2      GLN  28  11.099  -3.089   1.659
  162    H    PHE  29           H        PHE  29   6.319   0.364  -1.637
  163    HA   PHE  29           HA       PHE  29   6.860   1.832  -3.931
  164   1HB   PHE  29          1HB       PHE  29   5.707  -0.328  -3.938
  165   2HB   PHE  29          2HB       PHE  29   4.343   0.388  -3.096
  166    HD1  PHE  29           1HD      PHE  29   2.699   1.638  -4.260
  167    HD2  PHE  29           2HD      PHE  29   6.131   0.168  -6.289
  168    HE1  PHE  29           1HE      PHE  29   1.608   2.081  -6.417
  169    HE2  PHE  29           2HE      PHE  29   5.033   0.616  -8.445
  170    HZ   PHE  29           HZ       PHE  29   2.744   1.570  -8.473
  171    H    ILE  30           H        ILE  30   4.312   2.238  -1.535
  172    HA   ILE  30           HA       ILE  30   3.180   4.546  -2.624
  173    HB   ILE  30           HB       ILE  30   3.125   3.386   0.153
  174   1HG1  ILE  30          1HG1      ILE  30   0.998   3.711  -1.954
  175   2HG1  ILE  30          2HG1      ILE  30   1.998   2.281  -1.766
  176   1HG2  ILE  30          1HG2      ILE  30   1.592   5.816  -0.802
  177   2HG2  ILE  30          2HG2      ILE  30   2.937   5.853   0.316
  178   3HG2  ILE  30          3HG2      ILE  30   1.433   5.039   0.781
  179   1HD1  ILE  30          1HD1      ILE  30   1.108   1.929   0.429
  180   2HD1  ILE  30          2HD1      ILE  30  -0.175   1.970  -0.770
  181   3HD1  ILE  30          3HD1      ILE  30   0.092   3.357   0.290
  182    H    VAL  31           H        VAL  31   5.655   4.148  -0.095
  183    HA   VAL  31           HA       VAL  31   6.231   6.789   0.350
  184    HB   VAL  31           HB       VAL  31   7.977   4.324   0.269
  185   1HG1  VAL  31          1HG1      VAL  31   9.010   7.038   1.142
  186   2HG1  VAL  31          2HG1      VAL  31   9.405   6.300  -0.406
  187   3HG1  VAL  31          3HG1      VAL  31   9.905   5.520   1.090
  188   1HG2  VAL  31          1HG2      VAL  31   8.097   4.712   2.686
  189   2HG2  VAL  31          2HG2      VAL  31   6.418   4.650   2.124
  190   3HG2  VAL  31          3HG2      VAL  31   7.160   6.194   2.488
  191    H    GLN  32           H        GLN  32   7.486   4.761  -2.291
  192    HA   GLN  32           HA       GLN  32   9.075   6.520  -3.557
  193   1HB   GLN  32          1HB       GLN  32   8.908   4.174  -4.083
  194   2HB   GLN  32          2HB       GLN  32   7.278   4.386  -4.677
  195   1HG   GLN  32          1HG       GLN  32   8.233   5.875  -6.429
  196   2HG   GLN  32          2HG       GLN  32   9.829   5.306  -5.911
  197   1HE2  GLN  32          1HE2      GLN  32  10.341   3.114  -6.209
  198   2HE2  GLN  32          2HE2      GLN  32   9.465   2.107  -7.300
  199    H    CYS  33           H        CYS  33   5.645   5.863  -3.915
  200    HA   CYS  33           HA       CYS  33   4.989   7.595  -6.019
  201   1HB   CYS  33          1HB       CYS  33   3.382   6.368  -3.832
  202   2HB   CYS  33          2HB       CYS  33   2.644   7.219  -5.201
  203    HG   CYS  33           HG       CYS  33   4.267   4.266  -5.041
  204    H    LEU  34           H        LEU  34   4.940   7.999  -2.539
  205    HA   LEU  34           HA       LEU  34   3.777  10.617  -2.668
  206   1HB   LEU  34          1HB       LEU  34   5.122   9.224  -0.387
  207   2HB   LEU  34          2HB       LEU  34   4.298  10.759  -0.266
  208    HG   LEU  34           HG       LEU  34   3.065   8.112  -0.936
  209   1HD1  LEU  34          1HD1      LEU  34   2.825   9.935   1.461
  210   2HD1  LEU  34          2HD1      LEU  34   3.701   8.412   1.400
  211   3HD1  LEU  34          3HD1      LEU  34   1.946   8.423   1.229
  212   1HD2  LEU  34          1HD2      LEU  34   1.801  10.831  -0.671
  213   2HD2  LEU  34          2HD2      LEU  34   0.927   9.306  -0.795
  214   3HD2  LEU  34          3HD2      LEU  34   1.918   9.862  -2.143
  215    H    ASN  35           H        ASN  35   7.029   9.400  -2.628
  216    HA   ASN  35           HA       ASN  35   8.536  11.367  -1.903
  217   1HB   ASN  35          1HB       ASN  35   8.872   9.381  -3.913
  218   2HB   ASN  35          2HB       ASN  35   9.911  10.806  -4.182
  219   1HD2  ASN  35          1HD2      ASN  35   8.794   8.565  -1.826
  220   2HD2  ASN  35          2HD2      ASN  35  10.110   8.815  -0.770
  221    HA   PRO  36           HA       PRO  36   8.124  14.140  -5.915
  222   1HB   PRO  36          1HB       PRO  36   5.822  13.886  -7.336
  223   2HB   PRO  36          2HB       PRO  36   7.286  12.996  -7.759
  224   1HG   PRO  36          1HG       PRO  36   4.921  12.095  -6.186
  225   2HG   PRO  36          2HG       PRO  36   5.786  11.248  -7.481
  226   1HD   PRO  36          1HD       PRO  36   6.209  10.671  -4.913
  227   2HD   PRO  36          2HD       PRO  36   7.552  10.649  -6.062
  228    H    TYR  37           H        TYR  37   5.625  13.284  -3.756
  229    HA   TYR  37           HA       TYR  37   4.223  15.798  -4.033
  230   1HB   TYR  37          1HB       TYR  37   3.816  13.472  -2.154
  231   2HB   TYR  37          2HB       TYR  37   2.825  14.925  -2.160
  232    HD1  TYR  37           1HD      TYR  37   3.760  11.943  -4.074
  233    HD2  TYR  37           2HD      TYR  37   1.144  15.253  -3.794
  234    HE1  TYR  37           1HE      TYR  37   2.367  10.937  -5.758
  235    HE2  TYR  37           2HE      TYR  37  -0.282  14.322  -5.481
  236    HH   TYR  37           HH       TYR  37  -0.060  12.742  -7.353
  237    H    ARG  38           H        ARG  38   6.640  14.390  -2.040
  238    HA   ARG  38           HA       ARG  38   6.322  16.453  -0.012
  239   1HB   ARG  38          1HB       ARG  38   8.148  15.386   1.164
  240   2HB   ARG  38          2HB       ARG  38   6.982  14.174   0.651
  241   1HG   ARG  38          1HG       ARG  38   8.365  13.535  -1.169
  242   2HG   ARG  38          2HG       ARG  38   9.507  14.822  -0.816
  243   1HD   ARG  38          1HD       ARG  38   9.831  13.769   1.453
  244   2HD   ARG  38          2HD       ARG  38   8.796  12.453   0.887
  245    HE   ARG  38           HE       ARG  38  10.554  12.165  -0.907
  246   1HH1  ARG  38          1HH1      ARG  38  11.380  13.377   2.347
  247   2HH1  ARG  38          2HH1      ARG  38  12.950  12.727   2.305
  248   1HH2  ARG  38          1HH2      ARG  38  12.705  11.336  -0.940
  249   2HH2  ARG  38          2HH2      ARG  38  13.742  11.585   0.383
  250    H    LYS  39           H        LYS  39   7.527  16.440  -2.936
  251    HA   LYS  39           HA       LYS  39   9.949  17.942  -2.648
  252   1HB   LYS  39          1HB       LYS  39   8.021  17.799  -4.991
  253   2HB   LYS  39          2HB       LYS  39   9.653  18.441  -5.043
  254   1HG   LYS  39          1HG       LYS  39   8.926  15.586  -4.454
  255   2HG   LYS  39          2HG       LYS  39   9.491  16.200  -6.009
  256   1HD   LYS  39          1HD       LYS  39  11.609  16.824  -5.031
  257   2HD   LYS  39          2HD       LYS  39  11.025  16.364  -3.428
  258   1HE   LYS  39          1HE       LYS  39  10.805  14.091  -4.121
  259   2HE   LYS  39          2HE       LYS  39  11.317  14.494  -5.762
  260   1HZ   LYS  39          1HZ       LYS  39  13.133  13.566  -4.445
  261   2HZ   LYS  39          2HZ       LYS  39  12.995  14.814  -3.322
  262   3HZ   LYS  39          3HZ       LYS  39  13.462  15.144  -4.914
  263    HA   PRO  40           HA       PRO  40   7.906  21.659  -1.340
  264   1HB   PRO  40          1HB       PRO  40   9.887  23.454  -2.042
  265   2HB   PRO  40          2HB       PRO  40   9.857  22.518  -0.548
  266   1HG   PRO  40          1HG       PRO  40  11.361  22.024  -3.068
  267   2HG   PRO  40          2HG       PRO  40  11.859  21.747  -1.394
  268   1HD   PRO  40          1HD       PRO  40  11.061  19.759  -3.051
  269   2HD   PRO  40          2HD       PRO  40  10.791  19.702  -1.298
  270    H    ASP  41           H        ASP  41   8.712  21.050  -4.601
  271    HA   ASP  41           HA       ASP  41   7.127  23.410  -5.412
  272   1HB   ASP  41          1HB       ASP  41   9.498  23.185  -6.341
  273   2HB   ASP  41          2HB       ASP  41   8.911  21.794  -7.246
  274    H    CYS  42           H        CYS  42   6.507  20.540  -4.615
  275    HA   CYS  42           HA       CYS  42   5.036  19.330  -6.723
  276   1HB   CYS  42          1HB       CYS  42   5.444  18.155  -4.555
  277   2HB   CYS  42          2HB       CYS  42   4.327  19.269  -3.792
  278    HG   CYS  42           HG       CYS  42   2.389  17.529  -4.059
  279    H    LYS  43           H        LYS  43   3.046  19.708  -7.533
  280    HA   LYS  43           HA       LYS  43   1.933  22.312  -6.964
  281   1HB   LYS  43          1HB       LYS  43   1.101  20.273  -9.009
  282   2HB   LYS  43          2HB       LYS  43   0.568  21.945  -8.927
  283   1HG   LYS  43          1HG       LYS  43   2.867  22.680  -9.316
  284   2HG   LYS  43          2HG       LYS  43   3.371  20.993  -9.448
  285   1HD   LYS  43          1HD       LYS  43   1.756  20.717 -11.305
  286   2HD   LYS  43          2HD       LYS  43   1.412  22.442 -11.215
  287   1HE   LYS  43          1HE       LYS  43   4.076  21.183 -11.787
  288   2HE   LYS  43          2HE       LYS  43   3.027  21.966 -12.968
  289   1HZ   LYS  43          1HZ       LYS  43   4.787  23.437 -12.278
  290   2HZ   LYS  43          2HZ       LYS  43   4.411  23.258 -10.680
  291   3HZ   LYS  43          3HZ       LYS  43   3.329  24.061 -11.717
  292    H    VAL  44           H        VAL  44   1.057  18.934  -6.603
  293    HA   VAL  44           HA       VAL  44  -1.385  19.801  -5.296
  294    HB   VAL  44           HB       VAL  44  -2.029  19.203  -7.566
  295   1HG1  VAL  44          1HG1      VAL  44  -0.239  17.752  -8.205
  296   2HG1  VAL  44          2HG1      VAL  44  -1.788  16.949  -8.463
  297   3HG1  VAL  44          3HG1      VAL  44  -0.792  16.521  -7.072
  298   1HG2  VAL  44          1HG2      VAL  44  -3.715  17.477  -7.091
  299   2HG2  VAL  44          2HG2      VAL  44  -3.626  18.692  -5.815
  300   3HG2  VAL  44          3HG2      VAL  44  -2.888  17.108  -5.577
  301    H    GLY  45           H        GLY  45  -1.636  18.941  -3.425
  302   1HA   GLY  45          1HA       GLY  45  -1.498  17.513  -1.630
  303   2HA   GLY  45          2HA       GLY  45  -1.056  16.224  -2.747
  304    H    ARG  46           H        ARG  46   0.687  19.376  -1.971
  305    HA   ARG  46           HA       ARG  46   3.128  18.017  -1.954
  306   1HB   ARG  46          1HB       ARG  46   2.762  20.384  -2.679
  307   2HB   ARG  46          2HB       ARG  46   2.354  20.760  -1.022
  308   1HG   ARG  46          1HG       ARG  46   4.553  20.397  -0.279
  309   2HG   ARG  46          2HG       ARG  46   5.033  19.675  -1.817
  310   1HD   ARG  46          1HD       ARG  46   5.809  21.973  -1.669
  311   2HD   ARG  46          2HD       ARG  46   4.608  21.803  -2.945
  312    HE   ARG  46           HE       ARG  46   4.118  22.926  -0.291
  313   1HH1  ARG  46          1HH1      ARG  46   3.265  22.758  -3.757
  314   2HH1  ARG  46          2HH1      ARG  46   2.282  24.132  -3.731
  315   1HH2  ARG  46          1HH2      ARG  46   2.729  24.840  -0.274
  316   2HH2  ARG  46          2HH2      ARG  46   1.968  25.351  -1.715
  317    H    ILE  47           H        ILE  47   3.900  16.926  -0.366
  318    HA   ILE  47           HA       ILE  47   2.739  16.983   2.255
  319    HB   ILE  47           HB       ILE  47   5.187  15.371   1.375
  320   1HG1  ILE  47          1HG1      ILE  47   2.262  14.582   1.544
  321   2HG1  ILE  47          2HG1      ILE  47   3.131  14.915   0.050
  322   1HG2  ILE  47          1HG2      ILE  47   3.472  15.145   3.809
  323   2HG2  ILE  47          2HG2      ILE  47   5.149  15.653   3.710
  324   3HG2  ILE  47          3HG2      ILE  47   4.695  14.016   3.258
  325   1HD1  ILE  47          1HD1      ILE  47   3.801  12.721   1.985
  326   2HD1  ILE  47          2HD1      ILE  47   4.573  13.034   0.425
  327   3HD1  ILE  47          3HD1      ILE  47   2.884  12.532   0.492
  328    H    THR  48           H        THR  48   3.231  18.195   3.781
  329    HA   THR  48           HA       THR  48   5.103  20.222   3.756
  330    HB   THR  48           HB       THR  48   4.396  20.343   6.182
  331    HG1  THR  48           1HG      THR  48   2.548  18.919   6.578
  332   1HG2  THR  48          1HG2      THR  48   3.284  21.543   4.348
  333   2HG2  THR  48          2HG2      THR  48   2.130  20.969   5.586
  334   3HG2  THR  48          3HG2      THR  48   2.342  20.070   4.068
  335    H    THR  49           H        THR  49   4.959  17.330   5.752
  336    HA   THR  49           HA       THR  49   7.793  17.793   6.493
  337    HB   THR  49           HB       THR  49   5.927  16.651   8.519
  338    HG1  THR  49           1HG      THR  49   4.718  18.269   8.278
  339   1HG2  THR  49          1HG2      THR  49   7.368  17.923  10.050
  340   2HG2  THR  49          2HG2      THR  49   8.217  18.629   8.675
  341   3HG2  THR  49          3HG2      THR  49   8.334  16.898   8.988
  342    H    THR  50           H        THR  50   8.904  15.930   7.184
  343    HA   THR  50           HA       THR  50   8.533  13.558   5.821
  344    HB   THR  50           HB       THR  50  10.557  14.353   6.672
  345    HG1  THR  50           1HG      THR  50  11.365  12.342   7.088
  346   1HG2  THR  50          1HG2      THR  50   9.570  13.690   9.436
  347   2HG2  THR  50          2HG2      THR  50   9.852  15.292   8.776
  348   3HG2  THR  50          3HG2      THR  50  11.226  14.202   9.057
  349    H    GLU  51           H        GLU  51   7.664  14.374   9.149
  350    HA   GLU  51           HA       GLU  51   6.657  11.827   9.815
  351   1HB   GLU  51          1HB       GLU  51   5.516  12.869  11.696
  352   2HB   GLU  51          2HB       GLU  51   7.150  13.482  11.551
  353   1HG   GLU  51          1HG       GLU  51   6.391  15.544  10.653
  354   2HG   GLU  51          2HG       GLU  51   4.748  14.929  10.480
  355    H    ASP  52           H        ASP  52   5.137  14.591   8.097
  356    HA   ASP  52           HA       ASP  52   2.518  13.560   8.139
  357   1HB   ASP  52          1HB       ASP  52   4.065  15.623   6.596
  358   2HB   ASP  52          2HB       ASP  52   2.421  15.226   6.168
  359    H    PHE  53           H        PHE  53   5.289  13.449   5.995
  360    HA   PHE  53           HA       PHE  53   4.148  12.081   3.879
  361   1HB   PHE  53          1HB       PHE  53   6.382  13.127   3.743
  362   2HB   PHE  53          2HB       PHE  53   6.939  12.115   5.056
  363    HD1  PHE  53           1HD      PHE  53   6.161  12.267   1.523
  364    HD2  PHE  53           2HD      PHE  53   7.549   9.841   4.700
  365    HE1  PHE  53           1HE      PHE  53   6.990  10.634  -0.100
  366    HE2  PHE  53           2HE      PHE  53   8.370   8.197   3.124
  367    HZ   PHE  53           HZ       PHE  53   8.096   8.610   0.658
  368    H    LYS  54           H        LYS  54   5.790  10.942   6.702
  369    HA   LYS  54           HA       LYS  54   5.623   8.112   6.331
  370   1HB   LYS  54          1HB       LYS  54   5.841   9.800   8.787
  371   2HB   LYS  54          2HB       LYS  54   5.897   8.040   8.797
  372   1HG   LYS  54          1HG       LYS  54   7.901   8.038   7.499
  373   2HG   LYS  54          2HG       LYS  54   7.771   9.768   7.209
  374   1HD   LYS  54          1HD       LYS  54   9.460   9.391   8.847
  375   2HD   LYS  54          2HD       LYS  54   8.093  10.159   9.640
  376   1HE   LYS  54          1HE       LYS  54   8.722   7.191   9.733
  377   2HE   LYS  54          2HE       LYS  54   9.179   8.337  10.977
  378   1HZ   LYS  54          1HZ       LYS  54   6.687   8.747  11.273
  379   2HZ   LYS  54          2HZ       LYS  54   7.292   7.262  11.718
  380   3HZ   LYS  54          3HZ       LYS  54   6.450   7.378  10.286
  381    H    HIS  55           H        HIS  55   3.422  10.401   7.933
  382    HA   HIS  55           HA       HIS  55   1.584   8.510   9.063
  383   1HB   HIS  55          1HB       HIS  55   1.761  10.920   9.746
  384   2HB   HIS  55          2HB       HIS  55   1.288  11.381   8.135
  385    HD1  HIS  55           1HD      HIS  55  -0.129  10.459  11.424
  386    HD2  HIS  55           2HD      HIS  55  -1.503  10.925   7.521
  387    HE1  HIS  55           1HE      HIS  55  -2.599  10.641  11.605
  388    H    LEU  56           H        LEU  56   1.591  10.300   6.087
  389    HA   LEU  56           HA       LEU  56  -0.878   9.040   5.194
  390   1HB   LEU  56          1HB       LEU  56   0.200  11.305   4.569
  391   2HB   LEU  56          2HB       LEU  56   1.024  10.352   3.390
  392    HG   LEU  56           HG       LEU  56  -1.127   9.379   2.654
  393   1HD1  LEU  56          1HD1      LEU  56  -3.167  10.654   3.058
  394   2HD1  LEU  56          2HD1      LEU  56  -2.312  11.615   4.267
  395   3HD1  LEU  56          3HD1      LEU  56  -2.548   9.888   4.515
  396   1HD2  LEU  56          1HD2      LEU  56  -0.695  12.310   2.317
  397   2HD2  LEU  56          2HD2      LEU  56  -1.681  11.248   1.269
  398   3HD2  LEU  56          3HD2      LEU  56   0.069  10.978   1.432
  399    H    ALA  57           H        ALA  57   2.585   8.482   4.526
  400    HA   ALA  57           HA       ALA  57   2.108   6.557   2.528
  401   1HB   ALA  57          1HB       ALA  57   4.401   7.452   3.073
  402   2HB   ALA  57          2HB       ALA  57   4.355   5.693   3.013
  403   3HB   ALA  57          3HB       ALA  57   4.358   6.519   4.569
  404    H    ARG  58           H        ARG  58   2.188   6.317   5.947
  405    HA   ARG  58           HA       ARG  58   1.785   3.503   6.210
  406   1HB   ARG  58          1HB       ARG  58   1.022   5.799   7.983
  407   2HB   ARG  58          2HB       ARG  58   0.656   4.139   8.392
  408   1HG   ARG  58          1HG       ARG  58   3.014   3.627   8.504
  409   2HG   ARG  58          2HG       ARG  58   3.409   5.279   7.990
  410   1HD   ARG  58          1HD       ARG  58   2.407   6.211   9.914
  411   2HD   ARG  58          2HD       ARG  58   1.712   4.665  10.380
  412    HE   ARG  58           HE       ARG  58   4.455   4.362  10.282
  413   1HH1  ARG  58          1HH1      ARG  58   2.129   6.280  12.137
  414   2HH1  ARG  58          2HH1      ARG  58   2.984   6.164  13.602
  415   1HH2  ARG  58          1HH2      ARG  58   5.650   4.195  12.353
  416   2HH2  ARG  58          2HH2      ARG  58   4.970   4.940  13.726
  417    H    LYS  59           H        LYS  59  -0.415   6.276   6.035
  418    HA   LYS  59           HA       LYS  59  -2.744   4.870   6.707
  419   1HB   LYS  59          1HB       LYS  59  -2.245   7.343   6.831
  420   2HB   LYS  59          2HB       LYS  59  -2.518   7.397   5.099
  421   1HG   LYS  59          1HG       LYS  59  -4.794   6.743   5.385
  422   2HG   LYS  59          2HG       LYS  59  -4.541   6.486   7.119
  423   1HD   LYS  59          1HD       LYS  59  -3.860   8.898   7.266
  424   2HD   LYS  59          2HD       LYS  59  -4.423   9.084   5.605
  425   1HE   LYS  59          1HE       LYS  59  -6.640   8.420   6.245
  426   2HE   LYS  59          2HE       LYS  59  -6.100   8.095   7.895
  427   1HZ   LYS  59          1HZ       LYS  59  -7.064  10.234   7.959
  428   2HZ   LYS  59          2HZ       LYS  59  -6.442  10.626   6.488
  429   3HZ   LYS  59          3HZ       LYS  59  -5.400  10.558   7.846
  430    H    LEU  60           H        LEU  60  -1.303   5.804   3.634
  431    HA   LEU  60           HA       LEU  60  -3.386   4.946   2.131
  432   1HB   LEU  60          1HB       LEU  60  -0.533   5.384   1.434
  433   2HB   LEU  60          2HB       LEU  60  -1.796   5.216   0.201
  434    HG   LEU  60           HG       LEU  60  -1.986   7.143   2.416
  435   1HD1  LEU  60          1HD1      LEU  60  -1.267   8.906   0.706
  436   2HD1  LEU  60          2HD1      LEU  60  -0.673   7.582  -0.298
  437   3HD1  LEU  60          3HD1      LEU  60  -0.004   7.849   1.301
  438   1HD2  LEU  60          1HD2      LEU  60  -3.319   6.931  -0.245
  439   2HD2  LEU  60          2HD2      LEU  60  -3.537   8.278   0.880
  440   3HD2  LEU  60          3HD2      LEU  60  -4.006   6.643   1.351
  441    H    THR  61           H        THR  61  -0.289   3.486   3.007
  442    HA   THR  61           HA       THR  61  -0.338   1.097   1.563
  443    HB   THR  61           HB       THR  61   0.668   1.504   4.400
  444    HG1  THR  61           1HG      THR  61   1.730   2.914   3.030
  445   1HG2  THR  61          1HG2      THR  61   1.413  -0.578   2.332
  446   2HG2  THR  61          2HG2      THR  61   0.452  -0.874   3.781
  447   3HG2  THR  61          3HG2      THR  61   2.146  -0.402   3.928
  448    H    HIS  62           H        HIS  62  -1.762   1.979   4.580
  449    HA   HIS  62           HA       HIS  62  -2.789  -0.680   4.965
  450   1HB   HIS  62          1HB       HIS  62  -2.089   0.832   6.845
  451   2HB   HIS  62          2HB       HIS  62  -3.518   1.804   6.508
  452    HD1  HIS  62           1HD      HIS  62  -2.546  -1.655   7.798
  453    HD2  HIS  62           2HD      HIS  62  -5.808   0.916   7.692
  454    HE1  HIS  62           1HE      HIS  62  -4.262  -2.713   9.252
  455    H    GLY  63           H        GLY  63  -4.128   2.307   3.610
  456   1HA   GLY  63          1HA       GLY  63  -6.795   1.358   3.681
  457   2HA   GLY  63          2HA       GLY  63  -6.248   2.718   2.747
  458    H    VAL  64           H        VAL  64  -4.204   1.120   1.253
  459    HA   VAL  64           HA       VAL  64  -5.893  -0.043  -0.817
  460    HB   VAL  64           HB       VAL  64  -2.902  -0.412  -0.349
  461   1HG1  VAL  64          1HG1      VAL  64  -2.800  -1.138  -2.758
  462   2HG1  VAL  64          2HG1      VAL  64  -4.535  -0.994  -2.858
  463   3HG1  VAL  64          3HG1      VAL  64  -3.824  -2.201  -1.809
  464   1HG2  VAL  64          1HG2      VAL  64  -4.328   1.507  -2.193
  465   2HG2  VAL  64          2HG2      VAL  64  -2.587   1.248  -2.143
  466   3HG2  VAL  64          3HG2      VAL  64  -3.415   1.933  -0.740
  467    H    MET  65           H        MET  65  -4.121  -1.064   1.740
  468    HA   MET  65           HA       MET  65  -4.163  -3.888   1.418
  469   1HB   MET  65          1HB       MET  65  -2.614  -2.835   2.989
  470   2HB   MET  65          2HB       MET  65  -3.951  -2.237   3.925
  471   1HG   MET  65          1HG       MET  65  -4.570  -4.376   4.610
  472   2HG   MET  65          2HG       MET  65  -3.314  -5.128   3.632
  473   1HE   MET  65          1HE       MET  65  -2.119  -5.385   7.357
  474   2HE   MET  65          2HE       MET  65  -2.641  -6.277   5.899
  475   3HE   MET  65          3HE       MET  65  -3.797  -5.261   6.796
  476    H    ASN  66           H        ASN  66  -6.237  -1.711   3.350
  477    HA   ASN  66           HA       ASN  66  -8.115  -3.630   4.209
  478   1HB   ASN  66          1HB       ASN  66  -8.123  -0.677   3.792
  479   2HB   ASN  66          2HB       ASN  66  -9.543  -1.478   4.385
  480   1HD2  ASN  66          1HD2      ASN  66  -8.124   0.540   5.600
  481   2HD2  ASN  66          2HD2      ASN  66  -7.429  -0.071   7.048
  482    H    LYS  67           H        LYS  67  -8.080  -1.537   1.396
  483    HA   LYS  67           HA       LYS  67 -10.677  -2.258   0.645
  484   1HB   LYS  67          1HB       LYS  67  -9.639  -0.224  -0.249
  485   2HB   LYS  67          2HB       LYS  67  -8.500  -1.200  -1.171
  486   1HG   LYS  67          1HG       LYS  67 -10.309  -2.145  -2.482
  487   2HG   LYS  67          2HG       LYS  67 -11.495  -1.289  -1.511
  488   1HD   LYS  67          1HD       LYS  67  -9.405   0.024  -3.247
  489   2HD   LYS  67          2HD       LYS  67 -11.086  -0.230  -3.710
  490   1HE   LYS  67          1HE       LYS  67 -11.748   1.123  -1.700
  491   2HE   LYS  67          2HE       LYS  67 -10.042   1.487  -1.467
  492   1HZ   LYS  67          1HZ       LYS  67 -11.673   2.175  -3.835
  493   2HZ   LYS  67          2HZ       LYS  67 -10.038   2.468  -3.725
  494   3HZ   LYS  67          3HZ       LYS  67 -11.117   3.256  -2.671
  495    H    GLU  68           H        GLU  68  -7.526  -3.678  -0.291
  496    HA   GLU  68           HA       GLU  68  -8.997  -5.419  -1.911
  497   1HB   GLU  68          1HB       GLU  68  -6.859  -6.507  -2.383
  498   2HB   GLU  68          2HB       GLU  68  -6.987  -4.763  -2.663
  499   1HG   GLU  68          1HG       GLU  68  -5.717  -4.311  -0.682
  500   2HG   GLU  68          2HG       GLU  68  -5.454  -6.034  -0.407
  501    H    LEU  69           H        LEU  69  -7.554  -5.736   1.310
  502    HA   LEU  69           HA       LEU  69  -8.292  -8.388   1.563
  503   1HB   LEU  69          1HB       LEU  69  -8.127  -6.175   3.587
  504   2HB   LEU  69          2HB       LEU  69  -8.584  -7.801   4.047
  505    HG   LEU  69           HG       LEU  69  -5.973  -7.090   2.723
  506   1HD1  LEU  69          1HD1      LEU  69  -6.578  -7.640   5.629
  507   2HD1  LEU  69          2HD1      LEU  69  -6.135  -6.077   4.933
  508   3HD1  LEU  69          3HD1      LEU  69  -4.978  -7.401   4.917
  509   1HD2  LEU  69          1HD2      LEU  69  -5.363  -9.358   3.549
  510   2HD2  LEU  69          2HD2      LEU  69  -6.588  -9.356   2.290
  511   3HD2  LEU  69          3HD2      LEU  69  -7.054  -9.609   3.975
  512    H    LYS  70           H        LYS  70 -10.422  -5.572   1.495
  513    HA   LYS  70           HA       LYS  70 -12.524  -7.201   2.554
  514   1HB   LYS  70          1HB       LYS  70 -13.882  -5.227   2.571
  515   2HB   LYS  70          2HB       LYS  70 -12.288  -4.838   3.214
  516   1HG   LYS  70          1HG       LYS  70 -11.704  -3.931   1.021
  517   2HG   LYS  70          2HG       LYS  70 -13.371  -4.179   0.535
  518   1HD   LYS  70          1HD       LYS  70 -12.499  -2.445   2.832
  519   2HD   LYS  70          2HD       LYS  70 -12.870  -1.929   1.174
  520   1HE   LYS  70          1HE       LYS  70 -14.784  -1.437   2.548
  521   2HE   LYS  70          2HE       LYS  70 -15.177  -2.772   1.472
  522   1HZ   LYS  70          1HZ       LYS  70 -16.002  -2.974   3.775
  523   2HZ   LYS  70          2HZ       LYS  70 -14.426  -3.143   4.332
  524   3HZ   LYS  70          3HZ       LYS  70 -15.098  -4.282   3.283
  525    H    TYR  71           H        TYR  71 -11.361  -6.190  -0.545
  526    HA   TYR  71           HA       TYR  71 -13.782  -7.209  -1.915
  527   1HB   TYR  71          1HB       TYR  71 -11.261  -5.909  -2.976
  528   2HB   TYR  71          2HB       TYR  71 -12.584  -6.488  -3.983
  529    HD1  TYR  71           1HD      TYR  71 -13.839  -5.206  -0.961
  530    HD2  TYR  71           2HD      TYR  71 -12.374  -3.957  -4.732
  531    HE1  TYR  71           1HE      TYR  71 -14.951  -3.137  -0.634
  532    HE2  TYR  71           2HE      TYR  71 -13.518  -1.782  -4.453
  533    HH   TYR  71           HH       TYR  71 -14.855  -0.771  -1.458
  534    H    CYS  72           H        CYS  72 -10.519  -8.159  -1.333
  535    HA   CYS  72           HA       CYS  72 -10.715 -10.465  -3.083
  536   1HB   CYS  72          1HB       CYS  72  -8.613  -9.354  -1.274
  537   2HB   CYS  72          2HB       CYS  72  -8.344 -10.873  -2.074
  538    HG   CYS  72           HG       CYS  72  -7.408  -9.823  -4.185
  539    H    LYS  73           H        LYS  73 -10.845  -9.616   0.290
  540    HA   LYS  73           HA       LYS  73 -11.488 -10.633   2.151
  541   1HB   LYS  73          1HB       LYS  73 -12.344 -12.924   0.362
  542   2HB   LYS  73          2HB       LYS  73 -12.664 -12.843   2.077
  543   1HG   LYS  73          1HG       LYS  73 -13.688 -10.837   0.055
  544   2HG   LYS  73          2HG       LYS  73 -14.637 -12.170   0.729
  545   1HD   LYS  73          1HD       LYS  73 -14.128 -11.124   3.000
  546   2HD   LYS  73          2HD       LYS  73 -13.527  -9.729   2.099
  547   1HE   LYS  73          1HE       LYS  73 -16.332 -10.857   2.056
  548   2HE   LYS  73          2HE       LYS  73 -15.809  -9.329   2.737
  549   1HZ   LYS  73          1HZ       LYS  73 -15.205  -8.605   0.482
  550   2HZ   LYS  73          2HZ       LYS  73 -16.821  -8.903   0.648
  551   3HZ   LYS  73          3HZ       LYS  73 -15.859 -10.023  -0.167
  552    H    ASN  74           H        ASN  74  -9.835 -12.854   0.060
  553    HA   ASN  74           HA       ASN  74  -8.441 -14.093   2.303
  554   1HB   ASN  74          1HB       ASN  74  -8.488 -14.723  -0.656
  555   2HB   ASN  74          2HB       ASN  74  -7.515 -15.600   0.514
  556   1HD2  ASN  74          1HD2      ASN  74  -9.756 -16.405  -1.250
  557   2HD2  ASN  74          2HD2      ASN  74 -10.911 -17.138  -0.215
  558    HA   PRO  75           HA       PRO  75  -4.941 -11.369   1.437
  559   1HB   PRO  75          1HB       PRO  75  -3.251 -12.501   3.043
  560   2HB   PRO  75          2HB       PRO  75  -4.366 -11.189   3.445
  561   1HG   PRO  75          1HG       PRO  75  -4.503 -14.160   4.126
  562   2HG   PRO  75          2HG       PRO  75  -5.185 -12.834   5.077
  563   1HD   PRO  75          1HD       PRO  75  -6.623 -14.507   3.412
  564   2HD   PRO  75          2HD       PRO  75  -7.156 -12.885   3.898
  565    H    GLU  76           H        GLU  76  -5.287 -14.494   0.957
  566    HA   GLU  76           HA       GLU  76  -2.764 -15.359   0.209
  567   1HB   GLU  76          1HB       GLU  76  -4.758 -16.755   0.663
  568   2HB   GLU  76          2HB       GLU  76  -5.478 -16.170  -0.822
  569   1HG   GLU  76          1HG       GLU  76  -3.643 -17.207  -2.066
  570   2HG   GLU  76          2HG       GLU  76  -3.035 -17.846  -0.532
  571    H    ASP  77           H        ASP  77  -4.713 -13.062  -0.930
  572    HA   ASP  77           HA       ASP  77  -3.499 -12.943  -3.633
  573   1HB   ASP  77          1HB       ASP  77  -5.896 -13.630  -3.781
  574   2HB   ASP  77          2HB       ASP  77  -6.312 -12.173  -2.882
  575    H    LEU  78           H        LEU  78  -3.388 -11.689  -0.723
  576    HA   LEU  78           HA       LEU  78  -3.393  -8.910  -1.433
  577   1HB   LEU  78          1HB       LEU  78  -4.308  -9.733   0.702
  578   2HB   LEU  78          2HB       LEU  78  -2.724 -10.451   1.032
  579    HG   LEU  78           HG       LEU  78  -1.847  -8.225   0.835
  580   1HD1  LEU  78          1HD1      LEU  78  -4.745  -7.510   1.180
  581   2HD1  LEU  78          2HD1      LEU  78  -3.654  -6.990  -0.120
  582   3HD1  LEU  78          3HD1      LEU  78  -3.440  -6.382   1.528
  583   1HD2  LEU  78          1HD2      LEU  78  -3.550  -8.980   3.145
  584   2HD2  LEU  78          2HD2      LEU  78  -2.473  -7.583   3.157
  585   3HD2  LEU  78          3HD2      LEU  78  -1.818  -9.194   2.863
  586    H    GLU  79           H        GLU  79  -1.686  -8.723  -2.746
  587    HA   GLU  79           HA       GLU  79   1.027  -9.355  -1.853
  588   1HB   GLU  79          1HB       GLU  79   0.020 -11.172  -3.312
  589   2HB   GLU  79          2HB       GLU  79  -0.288  -9.862  -4.459
  590   1HG   GLU  79          1HG       GLU  79   1.532 -11.090  -5.098
  591   2HG   GLU  79          2HG       GLU  79   2.008  -9.450  -4.709
  592    H    CYS  80           H        CYS  80   2.393  -7.814  -2.638
  593    HA   CYS  80           HA       CYS  80   1.101  -5.468  -3.742
  594   1HB   CYS  80          1HB       CYS  80   2.699  -4.977  -1.975
  595   2HB   CYS  80          2HB       CYS  80   3.970  -5.877  -2.737
  596    HG   CYS  80           HG       CYS  80   4.934  -3.954  -4.046
  597    H    ASN  81           H        ASN  81   0.542  -6.668  -5.536
  598    HA   ASN  81           HA       ASN  81   2.759  -7.264  -7.210
  599   1HB   ASN  81          1HB       ASN  81   1.225  -8.577  -8.681
  600   2HB   ASN  81          2HB       ASN  81   1.037  -9.049  -6.992
  601   1HD2  ASN  81          1HD2      ASN  81  -0.873  -8.593  -6.046
  602   2HD2  ASN  81          2HD2      ASN  81  -2.262  -8.023  -6.873
  603    H    GLU  82           H        GLU  82   1.840  -6.971  -9.724
  604    HA   GLU  82           HA       GLU  82   1.976  -4.478 -10.462
  605   1HB   GLU  82          1HB       GLU  82   0.758  -6.855 -11.441
  606   2HB   GLU  82          2HB       GLU  82   0.631  -5.447 -12.519
  607   1HG   GLU  82          1HG       GLU  82   3.149  -6.578 -11.340
  608   2HG   GLU  82          2HG       GLU  82   2.652  -6.873 -13.025
  609    H    ASN  83           H        ASN  83  -1.034  -6.359 -10.293
  610    HA   ASN  83           HA       ASN  83  -3.060  -4.577 -10.910
  611   1HB   ASN  83          1HB       ASN  83  -3.439  -6.994 -10.487
  612   2HB   ASN  83          2HB       ASN  83  -3.023  -6.767  -8.797
  613   1HD2  ASN  83          1HD2      ASN  83  -5.009  -7.426  -7.985
  614   2HD2  ASN  83          2HD2      ASN  83  -6.453  -6.521  -8.192
  615    H    VAL  84           H        VAL  84  -1.605  -5.420  -7.769
  616    HA   VAL  84           HA       VAL  84  -3.187  -3.606  -6.444
  617    HB   VAL  84           HB       VAL  84  -0.664  -5.010  -5.601
  618   1HG1  VAL  84          1HG1      VAL  84  -2.446  -3.233  -3.929
  619   2HG1  VAL  84          2HG1      VAL  84  -0.718  -3.000  -4.278
  620   3HG1  VAL  84          3HG1      VAL  84  -1.258  -4.380  -3.317
  621   1HG2  VAL  84          1HG2      VAL  84  -3.549  -5.282  -4.904
  622   2HG2  VAL  84          2HG2      VAL  84  -2.223  -6.225  -4.233
  623   3HG2  VAL  84          3HG2      VAL  84  -2.611  -6.351  -5.962
  624    H    LYS  85           H        LYS  85   0.107  -3.370  -7.620
  625    HA   LYS  85           HA       LYS  85   0.767  -0.780  -6.679
  626   1HB   LYS  85          1HB       LYS  85   1.627  -2.197  -9.182
  627   2HB   LYS  85          2HB       LYS  85   2.349  -0.704  -8.580
  628   1HG   LYS  85          1HG       LYS  85   3.038  -1.749  -6.602
  629   2HG   LYS  85          2HG       LYS  85   2.181  -3.238  -7.013
  630   1HD   LYS  85          1HD       LYS  85   3.684  -3.371  -9.025
  631   2HD   LYS  85          2HD       LYS  85   4.617  -2.049  -8.291
  632   1HE   LYS  85          1HE       LYS  85   4.762  -3.356  -6.242
  633   2HE   LYS  85          2HE       LYS  85   3.897  -4.634  -7.102
  634   1HZ   LYS  85          1HZ       LYS  85   5.744  -4.949  -8.570
  635   2HZ   LYS  85          2HZ       LYS  85   6.352  -4.957  -7.002
  636   3HZ   LYS  85          3HZ       LYS  85   6.540  -3.590  -7.968
  637    H    HIS  86           H        HIS  86  -0.666  -1.760  -9.594
  638    HA   HIS  86           HA       HIS  86  -0.934   0.697 -10.881
  639   1HB   HIS  86          1HB       HIS  86  -1.431  -1.444 -11.994
  640   2HB   HIS  86          2HB       HIS  86  -2.860  -1.649 -10.996
  641    HD1  HIS  86           1HD      HIS  86  -4.726  -1.508 -12.669
  642    HD2  HIS  86           2HD      HIS  86  -1.929   1.507 -13.135
  643    HE1  HIS  86           1HE      HIS  86  -5.654  -0.032 -14.459
  644    H    LYS  87           H        LYS  87  -3.201  -1.000  -8.878
  645    HA   LYS  87           HA       LYS  87  -5.300   0.950  -8.451
  646   1HB   LYS  87          1HB       LYS  87  -5.222  -1.576  -7.953
  647   2HB   LYS  87          2HB       LYS  87  -4.210  -1.123  -6.596
  648   1HG   LYS  87          1HG       LYS  87  -6.163   0.453  -6.002
  649   2HG   LYS  87          2HG       LYS  87  -7.095  -0.622  -7.060
  650   1HD   LYS  87          1HD       LYS  87  -5.442  -1.389  -4.712
  651   2HD   LYS  87          2HD       LYS  87  -7.217  -1.372  -4.763
  652   1HE   LYS  87          1HE       LYS  87  -7.133  -3.154  -6.494
  653   2HE   LYS  87          2HE       LYS  87  -5.377  -3.154  -6.403
  654   1HZ   LYS  87          1HZ       LYS  87  -6.391  -4.954  -5.144
  655   2HZ   LYS  87          2HZ       LYS  87  -7.205  -3.854  -4.180
  656   3HZ   LYS  87          3HZ       LYS  87  -5.524  -3.957  -4.107
  657    H    THR  88           H        THR  88  -2.334   0.498  -6.977
  658    HA   THR  88           HA       THR  88  -3.004   2.136  -4.782
  659    HB   THR  88           HB       THR  88  -0.572   0.839  -5.808
  660    HG1  THR  88           1HG      THR  88  -1.845  -0.561  -4.822
  661   1HG2  THR  88          1HG2      THR  88   0.568   1.582  -3.753
  662   2HG2  THR  88          2HG2      THR  88  -0.844   2.631  -3.409
  663   3HG2  THR  88          3HG2      THR  88   0.117   2.864  -4.888
  664    H    LYS  89           H        LYS  89  -0.650   2.510  -7.371
  665    HA   LYS  89           HA       LYS  89  -0.167   5.021  -6.516
  666   1HB   LYS  89          1HB       LYS  89   0.935   5.359  -8.885
  667   2HB   LYS  89          2HB       LYS  89   1.610   4.291  -7.682
  668   1HG   LYS  89          1HG       LYS  89   1.675   3.153  -9.782
  669   2HG   LYS  89          2HG       LYS  89   0.431   2.404  -8.769
  670   1HD   LYS  89          1HD       LYS  89  -0.252   2.545 -10.964
  671   2HD   LYS  89          2HD       LYS  89  -1.187   3.563  -9.882
  672   1HE   LYS  89          1HE       LYS  89   0.056   5.592 -10.658
  673   2HE   LYS  89          2HE       LYS  89   1.073   4.587 -11.685
  674   1HZ   LYS  89          1HZ       LYS  89  -0.530   5.723 -12.974
  675   2HZ   LYS  89          2HZ       LYS  89  -1.805   5.223 -12.054
  676   3HZ   LYS  89          3HZ       LYS  89  -0.956   4.097 -13.016
  677    H    GLU  90           H        GLU  90  -2.499   3.844  -8.833
  678    HA   GLU  90           HA       GLU  90  -3.373   6.402  -9.817
  679   1HB   GLU  90          1HB       GLU  90  -5.025   3.880  -9.564
  680   2HB   GLU  90          2HB       GLU  90  -5.542   5.336 -10.392
  681   1HG   GLU  90          1HG       GLU  90  -3.552   5.020 -11.897
  682   2HG   GLU  90          2HG       GLU  90  -3.379   3.417 -11.174
  683    H    TYR  91           H        TYR  91  -4.117   4.531  -6.930
  684    HA   TYR  91           HA       TYR  91  -6.430   5.992  -6.224
  685   1HB   TYR  91          1HB       TYR  91  -6.339   3.871  -5.274
  686   2HB   TYR  91          2HB       TYR  91  -4.636   4.013  -4.878
  687    HD1  TYR  91           1HD      TYR  91  -7.886   5.629  -3.952
  688    HD2  TYR  91           2HD      TYR  91  -4.071   4.279  -2.683
  689    HE1  TYR  91           1HE      TYR  91  -8.493   6.101  -1.593
  690    HE2  TYR  91           2HE      TYR  91  -4.641   4.758  -0.353
  691    HH   TYR  91           HH       TYR  91  -6.216   6.238   0.866
  692    H    ILE  92           H        ILE  92  -3.093   5.815  -5.193
  693    HA   ILE  92           HA       ILE  92  -2.945   7.853  -3.312
  694    HB   ILE  92           HB       ILE  92  -0.910   7.100  -5.406
  695   1HG1  ILE  92          1HG1      ILE  92  -1.940   5.531  -3.574
  696   2HG1  ILE  92          2HG1      ILE  92  -0.214   5.346  -4.031
  697   1HG2  ILE  92          1HG2      ILE  92  -0.407   9.268  -4.512
  698   2HG2  ILE  92          2HG2      ILE  92   0.782   8.108  -3.879
  699   3HG2  ILE  92          3HG2      ILE  92  -0.563   8.672  -2.867
  700   1HD1  ILE  92          1HD1      ILE  92  -1.558   6.641  -1.729
  701   2HD1  ILE  92          2HD1      ILE  92   0.179   6.819  -2.081
  702   3HD1  ILE  92          3HD1      ILE  92  -0.491   5.222  -1.685
  703    H    LYS  93           H        LYS  93  -2.290   8.223  -6.772
  704    HA   LYS  93           HA       LYS  93  -1.909  10.978  -6.554
  705   1HB   LYS  93          1HB       LYS  93  -2.781   9.311  -8.921
  706   2HB   LYS  93          2HB       LYS  93  -2.375  11.026  -9.022
  707   1HG   LYS  93          1HG       LYS  93  -0.126  10.515  -8.144
  708   2HG   LYS  93          2HG       LYS  93  -0.543   8.806  -8.139
  709   1HD   LYS  93          1HD       LYS  93  -0.717   8.777 -10.524
  710   2HD   LYS  93          2HD       LYS  93  -0.556  10.534 -10.612
  711   1HE   LYS  93          1HE       LYS  93   1.705  10.365  -9.663
  712   2HE   LYS  93          2HE       LYS  93   1.533   8.614  -9.587
  713   1HZ   LYS  93          1HZ       LYS  93   1.463  10.198 -12.109
  714   2HZ   LYS  93          2HZ       LYS  93   1.475   8.513 -11.962
  715   3HZ   LYS  93          3HZ       LYS  93   2.807   9.400 -11.500
  716    H    LYS  94           H        LYS  94  -4.825   9.124  -7.166
  717    HA   LYS  94           HA       LYS  94  -6.362  11.443  -7.672
  718   1HB   LYS  94          1HB       LYS  94  -7.085   9.179  -8.438
  719   2HB   LYS  94          2HB       LYS  94  -7.290   8.694  -6.762
  720   1HG   LYS  94          1HG       LYS  94  -9.042  10.384  -6.497
  721   2HG   LYS  94          2HG       LYS  94  -8.866  10.811  -8.198
  722   1HD   LYS  94          1HD       LYS  94  -9.477   8.516  -8.819
  723   2HD   LYS  94          2HD       LYS  94  -9.671   8.117  -7.111
  724   1HE   LYS  94          1HE       LYS  94 -11.404   9.809  -6.899
  725   2HE   LYS  94          2HE       LYS  94 -11.220  10.233  -8.594
  726   1HZ   LYS  94          1HZ       LYS  94 -13.101   8.822  -8.264
  727   2HZ   LYS  94          2HZ       LYS  94 -12.172   7.648  -7.508
  728   3HZ   LYS  94          3HZ       LYS  94 -11.952   7.953  -9.155
  729    H    TYR  95           H        TYR  95  -5.597   9.533  -4.885
  730    HA   TYR  95           HA       TYR  95  -7.274  10.606  -2.991
  731   1HB   TYR  95          1HB       TYR  95  -6.020   8.637  -2.769
  732   2HB   TYR  95          2HB       TYR  95  -4.495   9.461  -2.880
  733    HD1  TYR  95           1HD      TYR  95  -4.365  11.392  -0.921
  734    HD2  TYR  95           2HD      TYR  95  -6.738   7.971  -0.884
  735    HE1  TYR  95           1HE      TYR  95  -4.454  11.583   1.500
  736    HE2  TYR  95           2HE      TYR  95  -6.889   8.051   1.593
  737    HH   TYR  95           HH       TYR  95  -6.119  10.662   3.327
  738    H    MET  96           H        MET  96  -3.930  11.442  -3.707
  739    HA   MET  96           HA       MET  96  -3.874  13.544  -1.891
  740   1HB   MET  96          1HB       MET  96  -2.067  13.262  -4.257
  741   2HB   MET  96          2HB       MET  96  -1.850  14.210  -2.776
  742   1HG   MET  96          1HG       MET  96  -2.245  11.794  -1.675
  743   2HG   MET  96          2HG       MET  96  -1.505  11.338  -3.219
  744   1HE   MET  96          1HE       MET  96   0.431  14.147  -0.212
  745   2HE   MET  96          2HE       MET  96  -1.303  13.685  -0.269
  746   3HE   MET  96          3HE       MET  96  -0.584  14.686  -1.544
  747    H    GLN  97           H        GLN  97  -5.031  13.438  -5.034
  748    HA   GLN  97           HA       GLN  97  -4.983  16.214  -5.640
  749   1HB   GLN  97          1HB       GLN  97  -7.241  14.407  -6.506
  750   2HB   GLN  97          2HB       GLN  97  -6.749  15.913  -7.257
  751   1HG   GLN  97          1HG       GLN  97  -5.370  13.264  -7.286
  752   2HG   GLN  97          2HG       GLN  97  -5.975  14.186  -8.652
  753   1HE2  GLN  97          1HE2      GLN  97  -3.476  13.667  -6.436
  754   2HE2  GLN  97          2HE2      GLN  97  -2.267  14.691  -7.071
  755    H    LYS  98           H        LYS  98  -6.812  14.543  -3.314
  756    HA   LYS  98           HA       LYS  98  -8.993  16.402  -3.112
  757   1HB   LYS  98          1HB       LYS  98  -9.700  15.123  -1.280
  758   2HB   LYS  98          2HB       LYS  98  -9.007  13.958  -2.391
  759   1HG   LYS  98          1HG       LYS  98  -7.866  13.166  -0.475
  760   2HG   LYS  98          2HG       LYS  98  -6.884  14.474  -0.934
  761   1HD   LYS  98          1HD       LYS  98  -7.315  14.579   1.419
  762   2HD   LYS  98          2HD       LYS  98  -7.831  16.029   0.572
  763   1HE   LYS  98          1HE       LYS  98  -9.658  13.804   1.577
  764   2HE   LYS  98          2HE       LYS  98  -9.369  15.362   2.335
  765   1HZ   LYS  98          1HZ       LYS  98 -10.425  16.432   0.361
  766   2HZ   LYS  98          2HZ       LYS  98 -11.391  15.463   1.292
  767   3HZ   LYS  98          3HZ       LYS  98 -10.884  14.875  -0.169
  768    H    PHE  99           H        PHE  99  -5.773  16.387  -1.960
  769    HA   PHE  99           HA       PHE  99  -6.341  18.141   0.270
  770   1HB   PHE  99          1HB       PHE  99  -3.653  17.351  -0.884
  771   2HB   PHE  99          2HB       PHE  99  -3.886  18.392   0.522
  772    HD1  PHE  99           1HD      PHE  99  -5.304  17.430   2.453
  773    HD2  PHE  99           2HD      PHE  99  -3.389  15.085  -0.559
  774    HE1  PHE  99           1HE      PHE  99  -5.432  15.462   3.896
  775    HE2  PHE  99           2HE      PHE  99  -3.464  13.100   0.938
  776    HZ   PHE  99           HZ       PHE  99  -4.531  13.294   3.140
  777    H    GLY 100           H        GLY 100  -5.313  18.554  -3.009
  778   1HA   GLY 100          1HA       GLY 100  -5.740  20.546  -4.158
  779   2HA   GLY 100          2HA       GLY 100  -5.639  21.415  -2.621
  780    H    ALA 101           H        ALA 101  -3.904  22.500  -2.394
  781    HA   ALA 101           HA       ALA 101  -1.601  21.905  -4.072
  782   1HB   ALA 101          1HB       ALA 101  -2.383  24.212  -3.855
  783   2HB   ALA 101          2HB       ALA 101  -0.718  24.024  -3.294
  784   3HB   ALA 101          3HB       ALA 101  -2.040  24.157  -2.126
  785    H    VAL 102           H        VAL 102  -2.414  21.910  -0.632
  786    HA   VAL 102           HA       VAL 102   0.211  20.654  -0.181
  787    HB   VAL 102           HB       VAL 102  -1.097  22.112   2.042
  788   1HG1  VAL 102          1HG1      VAL 102   1.772  21.775   1.310
  789   2HG1  VAL 102          2HG1      VAL 102   0.857  20.892   2.533
  790   3HG1  VAL 102          3HG1      VAL 102   1.181  22.616   2.746
  791   1HG2  VAL 102          1HG2      VAL 102  -0.034  24.259   1.495
  792   2HG2  VAL 102          2HG2      VAL 102  -1.291  23.761   0.354
  793   3HG2  VAL 102          3HG2      VAL 102   0.416  23.598  -0.090
  794    H    TYR 103           H        TYR 103   0.290  19.206   1.486
  795    HA   TYR 103           HA       TYR 103  -2.069  17.649   1.636
  796   1HB   TYR 103          1HB       TYR 103  -0.226  16.305   1.133
  797   2HB   TYR 103          2HB       TYR 103   0.817  17.182   2.239
  798    HD1  TYR 103           1HD      TYR 103   1.692  15.583   3.612
  799    HD2  TYR 103           2HD      TYR 103  -2.439  15.516   2.877
  800    HE1  TYR 103           1HE      TYR 103   1.415  13.823   5.340
  801    HE2  TYR 103           2HE      TYR 103  -2.758  13.827   4.560
  802    HH   TYR 103           HH       TYR 103  -0.299  13.067   6.815
  803    H    LYS 104           H        LYS 104  -3.395  18.383   2.955
  804    HA   LYS 104           HA       LYS 104  -2.685  18.839   5.759
  805   1HB   LYS 104          1HB       LYS 104  -4.897  20.200   5.666
  806   2HB   LYS 104          2HB       LYS 104  -3.379  20.851   5.014
  807   1HG   LYS 104          1HG       LYS 104  -4.138  20.106   2.783
  808   2HG   LYS 104          2HG       LYS 104  -5.700  19.739   3.527
  809   1HD   LYS 104          1HD       LYS 104  -6.013  22.046   4.144
  810   2HD   LYS 104          2HD       LYS 104  -4.351  22.441   3.720
  811   1HE   LYS 104          1HE       LYS 104  -5.732  23.262   1.973
  812   2HE   LYS 104          2HE       LYS 104  -4.874  21.834   1.390
  813   1HZ   LYS 104          1HZ       LYS 104  -7.150  21.782   0.699
  814   2HZ   LYS 104          2HZ       LYS 104  -7.720  21.918   2.267
  815   3HZ   LYS 104          3HZ       LYS 104  -6.905  20.524   1.772
  816    HA   PRO 105           HA       PRO 105  -4.940  14.901   5.836
  817   1HB   PRO 105          1HB       PRO 105  -4.020  14.285   8.378
  818   2HB   PRO 105          2HB       PRO 105  -3.252  13.807   6.865
  819   1HG   PRO 105          1HG       PRO 105  -2.590  16.015   8.715
  820   2HG   PRO 105          2HG       PRO 105  -1.515  15.042   7.690
  821   1HD   PRO 105          1HD       PRO 105  -2.230  17.600   7.151
  822   2HD   PRO 105          2HD       PRO 105  -1.831  16.479   5.854
  823    H    LYS 106           H        LYS 106  -5.003  17.363   8.285
  824    HA   LYS 106           HA       LYS 106  -7.301  16.536   9.579
  825   1HB   LYS 106          1HB       LYS 106  -7.623  18.778  10.333
  826   2HB   LYS 106          2HB       LYS 106  -5.907  18.425  10.316
  827   1HG   LYS 106          1HG       LYS 106  -5.841  19.598   8.080
  828   2HG   LYS 106          2HG       LYS 106  -7.479  20.148   8.441
  829   1HD   LYS 106          1HD       LYS 106  -6.533  20.967  10.654
  830   2HD   LYS 106          2HD       LYS 106  -4.946  20.684   9.905
  831   1HE   LYS 106          1HE       LYS 106  -5.495  22.972   9.584
  832   2HE   LYS 106          2HE       LYS 106  -5.629  22.090   8.050
  833   1HZ   LYS 106          1HZ       LYS 106  -8.039  22.050   8.293
  834   2HZ   LYS 106          2HZ       LYS 106  -7.464  23.639   8.400
  835   3HZ   LYS 106          3HZ       LYS 106  -7.907  22.819   9.799
  836    H    GLU 107           H        GLU 107  -6.995  17.751   6.403
  837    HA   GLU 107           HA       GLU 107  -9.885  18.202   6.116
  838   1HB   GLU 107          1HB       GLU 107  -7.647  18.675   4.141
  839   2HB   GLU 107          2HB       GLU 107  -9.308  19.196   3.970
  840   1HG   GLU 107          1HG       GLU 107  -7.303  20.211   5.977
  841   2HG   GLU 107          2HG       GLU 107  -7.876  21.049   4.538
  842    H    ASP 108           H        ASP 108  -7.979  15.617   6.172
  843    HA   ASP 108           HA       ASP 108  -8.170  14.548   3.580
  844   1HB   ASP 108          1HB       ASP 108  -6.275  13.948   4.793
  845   2HB   ASP 108          2HB       ASP 108  -7.212  13.426   6.203
  846    H    THR 109           H        THR 109  -9.010  12.414   3.153
  847    HA   THR 109           HA       THR 109 -11.783  12.250   3.284
  848    HB   THR 109           HB       THR 109 -10.436  11.247   1.442
  849    HG1  THR 109           1HG      THR 109 -12.516  10.195   2.447
  850   1HG2  THR 109          1HG2      THR 109  -9.123   9.220   1.804
  851   2HG2  THR 109          2HG2      THR 109  -9.526   9.280   3.529
  852   3HG2  THR 109          3HG2      THR 109  -8.549  10.555   2.821
  Start of MODEL   17
    1    H    THR  10           H        THR  10  -3.601 -23.792   3.823
    2    HA   THR  10           HA       THR  10  -4.024 -22.446   5.474
    3    HB   THR  10           HB       THR  10  -2.200 -22.431   7.359
    4    HG1  THR  10           1HG      THR  10  -1.326 -24.588   5.703
    5   1HG2  THR  10          1HG2      THR  10  -4.276 -23.678   7.475
    6   2HG2  THR  10          2HG2      THR  10  -2.948 -24.683   8.058
    7   3HG2  THR  10          3HG2      THR  10  -3.602 -24.935   6.441
    8    H    SER  11           H        SER  11  -4.198 -20.842   4.089
    9    HA   SER  11           HA       SER  11  -2.197 -18.781   3.656
   10   1HB   SER  11          1HB       SER  11  -5.081 -18.900   3.137
   11   2HB   SER  11          2HB       SER  11  -3.887 -17.857   2.321
   12    HG   SER  11           HG       SER  11  -4.247 -19.619   0.916
   13    H    SER  12           H        SER  12  -4.098 -19.457   6.173
   14    HA   SER  12           HA       SER  12  -4.719 -16.811   6.872
   15   1HB   SER  12          1HB       SER  12  -5.080 -18.048   9.065
   16   2HB   SER  12          2HB       SER  12  -5.966 -18.623   7.628
   17    HG   SER  12           HG       SER  12  -5.153 -20.455   8.381
   18    H    GLU  13           H        GLU  13  -2.161 -19.278   7.860
   19    HA   GLU  13           HA       GLU  13  -0.721 -17.397   9.303
   20   1HB   GLU  13          1HB       GLU  13   0.757 -19.377   9.634
   21   2HB   GLU  13          2HB       GLU  13  -0.900 -19.588  10.174
   22   1HG   GLU  13          1HG       GLU  13  -1.380 -20.842   8.087
   23   2HG   GLU  13          2HG       GLU  13   0.289 -20.640   7.624
   24    H    LEU  14           H        LEU  14  -0.460 -19.001   6.165
   25    HA   LEU  14           HA       LEU  14   2.162 -18.409   5.459
   26   1HB   LEU  14          1HB       LEU  14   0.283 -19.716   4.239
   27   2HB   LEU  14          2HB       LEU  14  -0.166 -18.168   3.570
   28    HG   LEU  14           HG       LEU  14   2.486 -19.563   3.142
   29   1HD1  LEU  14          1HD1      LEU  14   0.144 -19.184   1.303
   30   2HD1  LEU  14          2HD1      LEU  14   0.667 -20.697   2.044
   31   3HD1  LEU  14          3HD1      LEU  14   1.697 -19.893   0.862
   32   1HD2  LEU  14          1HD2      LEU  14   1.398 -17.070   1.826
   33   2HD2  LEU  14          2HD2      LEU  14   2.933 -17.864   1.453
   34   3HD2  LEU  14          3HD2      LEU  14   2.687 -17.110   3.024
   35    H    ALA  15           H        ALA  15  -0.631 -16.701   5.576
   36    HA   ALA  15           HA       ALA  15   0.330 -14.436   4.072
   37   1HB   ALA  15          1HB       ALA  15  -1.951 -15.038   3.531
   38   2HB   ALA  15          2HB       ALA  15  -1.845 -13.411   4.188
   39   3HB   ALA  15          3HB       ALA  15  -2.413 -14.730   5.201
   40    H    LYS  16           H        LYS  16   0.161 -15.374   7.280
   41    HA   LYS  16           HA       LYS  16   0.028 -12.855   8.547
   42   1HB   LYS  16          1HB       LYS  16  -0.113 -14.961   9.834
   43   2HB   LYS  16          2HB       LYS  16   1.518 -15.384   9.350
   44   1HG   LYS  16          1HG       LYS  16   2.379 -13.478  10.632
   45   2HG   LYS  16          2HG       LYS  16   0.737 -13.077  11.127
   46   1HD   LYS  16          1HD       LYS  16   0.530 -15.221  12.262
   47   2HD   LYS  16          2HD       LYS  16   2.139 -15.688  11.714
   48   1HE   LYS  16          1HE       LYS  16   2.235 -14.942  14.021
   49   2HE   LYS  16          2HE       LYS  16   3.093 -13.806  12.982
   50   1HZ   LYS  16          1HZ       LYS  16   1.768 -12.609  14.552
   51   2HZ   LYS  16          2HZ       LYS  16   0.382 -13.447  14.142
   52   3HZ   LYS  16          3HZ       LYS  16   1.077 -12.383  13.039
   53    H    LYS  17           H        LYS  17   2.475 -14.679   6.916
   54    HA   LYS  17           HA       LYS  17   4.550 -12.734   7.377
   55   1HB   LYS  17          1HB       LYS  17   4.482 -15.100   5.463
   56   2HB   LYS  17          2HB       LYS  17   5.886 -14.104   5.762
   57   1HG   LYS  17          1HG       LYS  17   6.194 -16.151   6.945
   58   2HG   LYS  17          2HG       LYS  17   5.828 -14.915   8.146
   59   1HD   LYS  17          1HD       LYS  17   3.516 -15.675   8.241
   60   2HD   LYS  17          2HD       LYS  17   3.844 -16.882   7.006
   61   1HE   LYS  17          1HE       LYS  17   5.150 -16.758   9.715
   62   2HE   LYS  17          2HE       LYS  17   3.799 -17.802   9.286
   63   1HZ   LYS  17          1HZ       LYS  17   6.498 -17.897   8.050
   64   2HZ   LYS  17          2HZ       LYS  17   5.188 -18.862   7.638
   65   3HZ   LYS  17          3HZ       LYS  17   5.870 -18.991   9.171
   66    H    SER  18           H        SER  18   2.413 -13.746   4.694
   67    HA   SER  18           HA       SER  18   3.573 -12.108   2.827
   68   1HB   SER  18          1HB       SER  18   0.711 -13.039   2.813
   69   2HB   SER  18          2HB       SER  18   1.690 -12.568   1.437
   70    HG   SER  18           HG       SER  18   2.539 -14.447   1.385
   71    H    LYS  19           H        LYS  19   1.043 -11.286   5.181
   72    HA   LYS  19           HA       LYS  19   0.312  -8.778   3.939
   73   1HB   LYS  19          1HB       LYS  19   0.192  -9.380   6.897
   74   2HB   LYS  19          2HB       LYS  19  -0.705  -8.155   6.022
   75   1HG   LYS  19          1HG       LYS  19  -1.748 -10.215   4.787
   76   2HG   LYS  19          2HG       LYS  19  -1.164 -11.100   6.185
   77   1HD   LYS  19          1HD       LYS  19  -3.089  -8.765   6.196
   78   2HD   LYS  19          2HD       LYS  19  -3.469 -10.444   6.548
   79   1HE   LYS  19          1HE       LYS  19  -1.626  -8.693   8.162
   80   2HE   LYS  19          2HE       LYS  19  -3.309  -9.025   8.553
   81   1HZ   LYS  19          1HZ       LYS  19  -1.136 -11.064   8.446
   82   2HZ   LYS  19          2HZ       LYS  19  -2.747 -11.373   8.807
   83   3HZ   LYS  19          3HZ       LYS  19  -1.837 -10.427   9.829
   84    H    GLU  20           H        GLU  20   2.870  -9.770   5.999
   85    HA   GLU  20           HA       GLU  20   3.712  -7.104   6.604
   86   1HB   GLU  20          1HB       GLU  20   5.179  -9.722   6.776
   87   2HB   GLU  20          2HB       GLU  20   5.705  -8.192   7.487
   88   1HG   GLU  20          1HG       GLU  20   3.125  -9.404   7.940
   89   2HG   GLU  20          2HG       GLU  20   4.501  -9.806   9.015
   90    H    VAL  21           H        VAL  21   4.724  -9.653   4.434
   91    HA   VAL  21           HA       VAL  21   6.790  -8.197   3.141
   92    HB   VAL  21           HB       VAL  21   4.996 -10.389   2.043
   93   1HG1  VAL  21          1HG1      VAL  21   6.810 -10.789   0.426
   94   2HG1  VAL  21          2HG1      VAL  21   7.691  -9.411   1.087
   95   3HG1  VAL  21          3HG1      VAL  21   6.151  -9.161   0.270
   96   1HG2  VAL  21          1HG2      VAL  21   6.841 -11.921   2.595
   97   2HG2  VAL  21          2HG2      VAL  21   6.170 -11.143   4.028
   98   3HG2  VAL  21          3HG2      VAL  21   7.703 -10.586   3.359
   99    H    PHE  22           H        PHE  22   3.363  -8.462   2.668
  100    HA   PHE  22           HA       PHE  22   3.252  -7.007   0.202
  101   1HB   PHE  22          1HB       PHE  22   1.345  -8.293   0.550
  102   2HB   PHE  22          2HB       PHE  22   1.239  -7.834   2.248
  103    HD1  PHE  22           1HD      PHE  22   1.092  -6.217  -1.102
  104    HD2  PHE  22           2HD      PHE  22  -0.474  -6.422   2.821
  105    HE1  PHE  22           1HE      PHE  22  -0.547  -4.436  -1.656
  106    HE2  PHE  22           2HE      PHE  22  -2.092  -4.698   2.283
  107    HZ   PHE  22           HZ       PHE  22  -2.168  -3.696   0.099
  108    H    ARG  23           H        ARG  23   2.441  -6.123   3.469
  109    HA   ARG  23           HA       ARG  23   2.065  -3.414   2.845
  110   1HB   ARG  23          1HB       ARG  23   2.081  -2.866   5.216
  111   2HB   ARG  23          2HB       ARG  23   1.197  -4.349   4.863
  112   1HG   ARG  23          1HG       ARG  23   2.365  -5.458   6.351
  113   2HG   ARG  23          2HG       ARG  23   3.861  -5.050   5.509
  114   1HD   ARG  23          1HD       ARG  23   4.115  -3.078   6.751
  115   2HD   ARG  23          2HD       ARG  23   2.500  -3.209   7.464
  116    HE   ARG  23           HE       ARG  23   3.549  -5.444   8.348
  117   1HH1  ARG  23          1HH1      ARG  23   5.125  -2.286   8.167
  118   2HH1  ARG  23          2HH1      ARG  23   6.086  -2.505   9.541
  119   1HH2  ARG  23          1HH2      ARG  23   4.898  -5.809  10.208
  120   2HH2  ARG  23          2HH2      ARG  23   5.964  -4.571  10.744
  121    H    LYS  24           H        LYS  24   5.036  -5.122   3.420
  122    HA   LYS  24           HA       LYS  24   6.564  -2.773   3.824
  123   1HB   LYS  24          1HB       LYS  24   7.356  -5.559   3.009
  124   2HB   LYS  24          2HB       LYS  24   8.528  -4.262   3.138
  125   1HG   LYS  24          1HG       LYS  24   6.778  -5.256   5.378
  126   2HG   LYS  24          2HG       LYS  24   8.460  -5.705   5.125
  127   1HD   LYS  24          1HD       LYS  24   9.085  -3.320   5.344
  128   2HD   LYS  24          2HD       LYS  24   7.402  -2.938   5.725
  129   1HE   LYS  24          1HE       LYS  24   8.715  -3.131   7.752
  130   2HE   LYS  24          2HE       LYS  24   7.526  -4.430   7.666
  131   1HZ   LYS  24          1HZ       LYS  24   9.651  -5.249   8.388
  132   2HZ   LYS  24          2HZ       LYS  24  10.422  -4.682   7.004
  133   3HZ   LYS  24          3HZ       LYS  24   9.270  -5.917   6.898
  134    H    GLU  25           H        GLU  25   5.829  -4.789   0.979
  135    HA   GLU  25           HA       GLU  25   7.529  -3.485  -0.848
  136   1HB   GLU  25          1HB       GLU  25   4.845  -4.519  -1.595
  137   2HB   GLU  25          2HB       GLU  25   6.306  -4.508  -2.559
  138   1HG   GLU  25          1HG       GLU  25   6.524  -6.024  -0.137
  139   2HG   GLU  25          2HG       GLU  25   5.205  -6.510  -1.208
  140    H    MET  26           H        MET  26   4.219  -3.205   0.044
  141    HA   MET  26           HA       MET  26   3.623  -1.147  -1.793
  142   1HB   MET  26          1HB       MET  26   2.024  -2.753  -0.941
  143   2HB   MET  26          2HB       MET  26   2.168  -1.990   0.626
  144   1HG   MET  26          1HG       MET  26   0.140  -1.259  -0.812
  145   2HG   MET  26          2HG       MET  26   1.094  -0.039   0.026
  146   1HE   MET  26          1HE       MET  26   1.484  -1.965  -3.579
  147   2HE   MET  26          2HE       MET  26   1.046  -0.517  -4.540
  148   3HE   MET  26          3HE       MET  26  -0.151  -1.254  -3.504
  149    H    SER  27           H        SER  27   4.420  -1.069   1.587
  150    HA   SER  27           HA       SER  27   3.942   1.679   1.877
  151   1HB   SER  27          1HB       SER  27   5.687   1.616   3.704
  152   2HB   SER  27          2HB       SER  27   4.240   0.594   3.959
  153    HG   SER  27           HG       SER  27   5.436  -1.121   3.484
  154    H    GLN  28           H        GLN  28   6.734  -0.129   0.892
  155    HA   GLN  28           HA       GLN  28   8.317   2.193   0.641
  156   1HB   GLN  28          1HB       GLN  28   9.793   0.888  -0.829
  157   2HB   GLN  28          2HB       GLN  28   9.529   0.263   0.846
  158   1HG   GLN  28          1HG       GLN  28   8.137  -1.428  -0.135
  159   2HG   GLN  28          2HG       GLN  28   8.426  -0.746  -1.738
  160   1HE2  GLN  28          1HE2      GLN  28   9.112  -3.447  -0.572
  161   2HE2  GLN  28          2HE2      GLN  28  10.786  -3.630  -0.840
  162    H    PHE  29           H        PHE  29   6.631   0.354  -1.640
  163    HA   PHE  29           HA       PHE  29   6.985   1.861  -3.966
  164   1HB   PHE  29          1HB       PHE  29   5.842  -0.292  -4.153
  165   2HB   PHE  29          2HB       PHE  29   4.534   0.264  -3.124
  166    HD1  PHE  29           1HD      PHE  29   2.676   1.430  -4.037
  167    HD2  PHE  29           2HD      PHE  29   6.089   0.546  -6.463
  168    HE1  PHE  29           1HE      PHE  29   1.436   2.021  -6.025
  169    HE2  PHE  29           2HE      PHE  29   4.807   1.170  -8.440
  170    HZ   PHE  29           HZ       PHE  29   2.449   1.880  -8.186
  171    H    ILE  30           H        ILE  30   4.392   2.250  -1.553
  172    HA   ILE  30           HA       ILE  30   3.266   4.564  -2.650
  173    HB   ILE  30           HB       ILE  30   3.221   3.479   0.165
  174   1HG1  ILE  30          1HG1      ILE  30   1.054   3.772  -1.899
  175   2HG1  ILE  30          2HG1      ILE  30   2.043   2.330  -1.702
  176   1HG2  ILE  30          1HG2      ILE  30   1.510   5.167   0.729
  177   2HG2  ILE  30          2HG2      ILE  30   1.732   5.903  -0.866
  178   3HG2  ILE  30          3HG2      ILE  30   3.042   5.939   0.293
  179   1HD1  ILE  30          1HD1      ILE  30   1.206   2.061   0.545
  180   2HD1  ILE  30          2HD1      ILE  30  -0.099   2.063  -0.615
  181   3HD1  ILE  30          3HD1      ILE  30   0.201   3.491   0.380
  182    H    VAL  31           H        VAL  31   5.712   4.185  -0.090
  183    HA   VAL  31           HA       VAL  31   6.209   6.850   0.331
  184    HB   VAL  31           HB       VAL  31   8.025   4.447   0.377
  185   1HG1  VAL  31          1HG1      VAL  31   9.801   5.760   1.412
  186   2HG1  VAL  31          2HG1      VAL  31   8.817   7.205   1.355
  187   3HG1  VAL  31          3HG1      VAL  31   9.419   6.497  -0.150
  188   1HG2  VAL  31          1HG2      VAL  31   7.944   4.833   2.815
  189   2HG2  VAL  31          2HG2      VAL  31   6.327   4.646   2.115
  190   3HG2  VAL  31          3HG2      VAL  31   6.913   6.239   2.538
  191    H    GLN  32           H        GLN  32   7.584   4.797  -2.244
  192    HA   GLN  32           HA       GLN  32   9.170   6.611  -3.445
  193   1HB   GLN  32          1HB       GLN  32   9.160   4.274  -3.959
  194   2HB   GLN  32          2HB       GLN  32   7.543   4.374  -4.616
  195   1HG   GLN  32          1HG       GLN  32   9.151   4.187  -6.360
  196   2HG   GLN  32          2HG       GLN  32   8.346   5.764  -6.403
  197   1HE2  GLN  32          1HE2      GLN  32   9.533   7.610  -5.943
  198   2HE2  GLN  32          2HE2      GLN  32  11.255   7.617  -5.877
  199    H    CYS  33           H        CYS  33   5.775   5.859  -3.916
  200    HA   CYS  33           HA       CYS  33   5.182   7.573  -6.052
  201   1HB   CYS  33          1HB       CYS  33   3.514   6.320  -3.931
  202   2HB   CYS  33          2HB       CYS  33   2.814   7.200  -5.297
  203    HG   CYS  33           HG       CYS  33   4.523   4.278  -5.224
  204    H    LEU  34           H        LEU  34   5.047   8.016  -2.583
  205    HA   LEU  34           HA       LEU  34   3.907  10.631  -2.767
  206   1HB   LEU  34          1HB       LEU  34   5.132   9.200  -0.436
  207   2HB   LEU  34          2HB       LEU  34   4.459  10.808  -0.330
  208    HG   LEU  34           HG       LEU  34   2.955   8.278  -0.974
  209   1HD1  LEU  34          1HD1      LEU  34   1.868   8.726   1.179
  210   2HD1  LEU  34          2HD1      LEU  34   2.930  10.112   1.423
  211   3HD1  LEU  34          3HD1      LEU  34   3.604   8.486   1.352
  212   1HD2  LEU  34          1HD2      LEU  34   1.966  11.127  -0.741
  213   2HD2  LEU  34          2HD2      LEU  34   0.945   9.701  -0.849
  214   3HD2  LEU  34          3HD2      LEU  34   1.973  10.143  -2.207
  215    H    ASN  35           H        ASN  35   7.182   9.416  -2.695
  216    HA   ASN  35           HA       ASN  35   8.676  11.395  -1.998
  217   1HB   ASN  35          1HB       ASN  35   9.003   9.384  -3.983
  218   2HB   ASN  35          2HB       ASN  35   9.996  10.824  -4.329
  219   1HD2  ASN  35          1HD2      ASN  35   8.959   8.692  -1.831
  220   2HD2  ASN  35          2HD2      ASN  35  10.327   8.936  -0.849
  221    HA   PRO  36           HA       PRO  36   8.268  14.152  -5.981
  222   1HB   PRO  36          1HB       PRO  36   5.955  13.899  -7.435
  223   2HB   PRO  36          2HB       PRO  36   7.454  13.071  -7.857
  224   1HG   PRO  36          1HG       PRO  36   5.071  12.028  -6.395
  225   2HG   PRO  36          2HG       PRO  36   6.057  11.237  -7.634
  226   1HD   PRO  36          1HD       PRO  36   6.319  10.707  -5.000
  227   2HD   PRO  36          2HD       PRO  36   7.705  10.637  -6.097
  228    H    TYR  37           H        TYR  37   5.778  13.298  -3.834
  229    HA   TYR  37           HA       TYR  37   4.374  15.827  -4.074
  230   1HB   TYR  37          1HB       TYR  37   3.946  13.490  -2.218
  231   2HB   TYR  37          2HB       TYR  37   2.951  14.942  -2.243
  232    HD1  TYR  37           1HD      TYR  37   3.964  11.993  -4.157
  233    HD2  TYR  37           2HD      TYR  37   1.289  15.243  -3.876
  234    HE1  TYR  37           1HE      TYR  37   2.606  10.968  -5.871
  235    HE2  TYR  37           2HE      TYR  37  -0.121  14.261  -5.611
  236    HH   TYR  37           HH       TYR  37   0.378  11.024  -6.720
  237    H    ARG  38           H        ARG  38   6.785  14.356  -2.119
  238    HA   ARG  38           HA       ARG  38   6.442  16.337  -0.034
  239   1HB   ARG  38          1HB       ARG  38   8.274  15.274   1.104
  240   2HB   ARG  38          2HB       ARG  38   7.119  14.065   0.559
  241   1HG   ARG  38          1HG       ARG  38   8.550  13.467  -1.258
  242   2HG   ARG  38          2HG       ARG  38   9.682  14.752  -0.841
  243   1HD   ARG  38          1HD       ARG  38   9.940  13.704   1.397
  244   2HD   ARG  38          2HD       ARG  38   8.882  12.401   0.853
  245    HE   ARG  38           HE       ARG  38  10.862  12.253  -0.933
  246   1HH1  ARG  38          1HH1      ARG  38  11.002  12.605   2.596
  247   2HH1  ARG  38          2HH1      ARG  38  12.447  11.715   2.758
  248   1HH2  ARG  38          1HH2      ARG  38  12.890  11.021  -0.661
  249   2HH2  ARG  38          2HH2      ARG  38  13.508  10.814   0.913
  250    H    LYS  39           H        LYS  39   7.694  16.419  -2.929
  251    HA   LYS  39           HA       LYS  39  10.094  17.939  -2.508
  252   1HB   LYS  39          1HB       LYS  39   8.320  17.843  -4.967
  253   2HB   LYS  39          2HB       LYS  39   9.984  18.399  -4.904
  254   1HG   LYS  39          1HG       LYS  39   9.050  15.579  -4.425
  255   2HG   LYS  39          2HG       LYS  39   9.840  16.188  -5.880
  256   1HD   LYS  39          1HD       LYS  39  11.860  16.652  -4.627
  257   2HD   LYS  39          2HD       LYS  39  11.067  16.187  -3.122
  258   1HE   LYS  39          1HE       LYS  39  12.485  14.379  -3.931
  259   2HE   LYS  39          2HE       LYS  39  10.786  13.925  -3.966
  260   1HZ   LYS  39          1HZ       LYS  39  12.354  14.821  -6.327
  261   2HZ   LYS  39          2HZ       LYS  39  10.743  14.282  -6.333
  262   3HZ   LYS  39          3HZ       LYS  39  11.969  13.233  -5.932
  263    HA   PRO  40           HA       PRO  40   8.063  21.634  -1.181
  264   1HB   PRO  40          1HB       PRO  40   9.964  23.472  -1.928
  265   2HB   PRO  40          2HB       PRO  40  10.069  22.463  -0.484
  266   1HG   PRO  40          1HG       PRO  40  11.333  22.064  -3.166
  267   2HG   PRO  40          2HG       PRO  40  12.037  21.829  -1.559
  268   1HD   PRO  40          1HD       PRO  40  11.170  19.766  -3.041
  269   2HD   PRO  40          2HD       PRO  40  10.983  19.774  -1.271
  270    H    ASP  41           H        ASP  41   8.787  21.124  -4.478
  271    HA   ASP  41           HA       ASP  41   7.199  23.498  -5.210
  272   1HB   ASP  41          1HB       ASP  41   9.521  23.319  -6.149
  273   2HB   ASP  41          2HB       ASP  41   9.014  21.876  -7.015
  274    H    CYS  42           H        CYS  42   6.558  20.622  -4.444
  275    HA   CYS  42           HA       CYS  42   5.118  19.518  -6.649
  276   1HB   CYS  42          1HB       CYS  42   5.633  18.205  -4.585
  277   2HB   CYS  42          2HB       CYS  42   4.416  19.160  -3.757
  278    HG   CYS  42           HG       CYS  42   2.402  17.609  -4.402
  279    H    LYS  43           H        LYS  43   3.209  19.953  -7.510
  280    HA   LYS  43           HA       LYS  43   1.994  22.465  -6.746
  281   1HB   LYS  43          1HB       LYS  43   1.407  20.616  -9.031
  282   2HB   LYS  43          2HB       LYS  43   0.644  22.175  -8.808
  283   1HG   LYS  43          1HG       LYS  43   2.296  22.502 -10.467
  284   2HG   LYS  43          2HG       LYS  43   2.979  23.182  -8.995
  285   1HD   LYS  43          1HD       LYS  43   4.325  21.178  -8.669
  286   2HD   LYS  43          2HD       LYS  43   3.578  20.432 -10.082
  287   1HE   LYS  43          1HE       LYS  43   5.768  21.288 -10.635
  288   2HE   LYS  43          2HE       LYS  43   4.524  22.183 -11.494
  289   1HZ   LYS  43          1HZ       LYS  43   6.101  23.711 -10.685
  290   2HZ   LYS  43          2HZ       LYS  43   6.123  23.075  -9.162
  291   3HZ   LYS  43          3HZ       LYS  43   4.748  23.924  -9.706
  292    H    VAL  44           H        VAL  44   1.301  19.127  -6.459
  293    HA   VAL  44           HA       VAL  44  -1.219  19.829  -5.208
  294    HB   VAL  44           HB       VAL  44  -1.828  19.202  -7.495
  295   1HG1  VAL  44          1HG1      VAL  44  -1.512  16.962  -8.371
  296   2HG1  VAL  44          2HG1      VAL  44  -0.511  16.566  -6.974
  297   3HG1  VAL  44          3HG1      VAL  44   0.012  17.811  -8.108
  298   1HG2  VAL  44          1HG2      VAL  44  -2.619  17.093  -5.497
  299   2HG2  VAL  44          2HG2      VAL  44  -3.453  17.439  -7.014
  300   3HG2  VAL  44          3HG2      VAL  44  -3.403  18.655  -5.736
  301    H    GLY  45           H        GLY  45  -1.405  18.975  -3.335
  302   1HA   GLY  45          1HA       GLY  45  -1.257  17.551  -1.555
  303   2HA   GLY  45          2HA       GLY  45  -0.808  16.266  -2.668
  304    H    ARG  46           H        ARG  46   0.945  19.432  -1.925
  305    HA   ARG  46           HA       ARG  46   3.386  18.080  -1.887
  306   1HB   ARG  46          1HB       ARG  46   2.872  20.512  -2.556
  307   2HB   ARG  46          2HB       ARG  46   2.769  20.852  -0.839
  308   1HG   ARG  46          1HG       ARG  46   5.228  19.602  -2.008
  309   2HG   ARG  46          2HG       ARG  46   4.982  21.346  -2.092
  310   1HD   ARG  46          1HD       ARG  46   5.043  19.696   0.438
  311   2HD   ARG  46          2HD       ARG  46   6.430  20.522  -0.288
  312    HE   ARG  46           HE       ARG  46   4.259  22.305   0.117
  313   1HH1  ARG  46          1HH1      ARG  46   6.916  20.751   1.927
  314   2HH1  ARG  46          2HH1      ARG  46   7.035  22.025   3.041
  315   1HH2  ARG  46          1HH2      ARG  46   4.502  24.013   1.637
  316   2HH2  ARG  46          2HH2      ARG  46   5.657  23.893   2.905
  317    H    ILE  47           H        ILE  47   4.150  16.994  -0.311
  318    HA   ILE  47           HA       ILE  47   2.865  17.015   2.247
  319    HB   ILE  47           HB       ILE  47   5.306  15.350   1.483
  320   1HG1  ILE  47          1HG1      ILE  47   2.342  14.674   1.528
  321   2HG1  ILE  47          2HG1      ILE  47   3.288  14.969   0.081
  322   1HG2  ILE  47          1HG2      ILE  47   4.602  14.006   3.372
  323   2HG2  ILE  47          2HG2      ILE  47   3.508  15.301   3.871
  324   3HG2  ILE  47          3HG2      ILE  47   5.235  15.584   3.785
  325   1HD1  ILE  47          1HD1      ILE  47   2.911  12.597   0.528
  326   2HD1  ILE  47          2HD1      ILE  47   3.815  12.758   2.040
  327   3HD1  ILE  47          3HD1      ILE  47   4.616  13.031   0.490
  328    H    THR  48           H        THR  48   3.183  18.252   3.723
  329    HA   THR  48           HA       THR  48   4.904  20.337   3.897
  330    HB   THR  48           HB       THR  48   4.056  20.315   6.298
  331    HG1  THR  48           1HG      THR  48   2.392  18.760   6.616
  332   1HG2  THR  48          1HG2      THR  48   2.957  21.487   4.443
  333   2HG2  THR  48          2HG2      THR  48   1.786  20.765   5.582
  334   3HG2  THR  48          3HG2      THR  48   2.170  19.950   4.051
  335    H    THR  49           H        THR  49   4.916  17.383   5.807
  336    HA   THR  49           HA       THR  49   7.737  17.845   6.420
  337    HB   THR  49           HB       THR  49   6.540  17.003   8.861
  338    HG1  THR  49           1HG      THR  49   4.555  17.900   8.264
  339   1HG2  THR  49          1HG2      THR  49   7.446  19.148   9.669
  340   2HG2  THR  49          2HG2      THR  49   7.694  19.666   8.000
  341   3HG2  THR  49          3HG2      THR  49   8.598  18.296   8.644
  342    H    THR  50           H        THR  50   8.742  16.015   7.541
  343    HA   THR  50           HA       THR  50   8.419  13.670   6.077
  344    HB   THR  50           HB       THR  50  10.433  14.433   6.978
  345    HG1  THR  50           1HG      THR  50   9.856  12.034   6.746
  346   1HG2  THR  50          1HG2      THR  50   9.711  15.310   9.058
  347   2HG2  THR  50          2HG2      THR  50  11.054  14.178   9.359
  348   3HG2  THR  50          3HG2      THR  50   9.366  13.693   9.666
  349    H    GLU  51           H        GLU  51   7.456  14.444   9.396
  350    HA   GLU  51           HA       GLU  51   6.470  11.886   9.945
  351   1HB   GLU  51          1HB       GLU  51   5.159  12.977  11.799
  352   2HB   GLU  51          2HB       GLU  51   6.894  13.264  11.798
  353   1HG   GLU  51          1HG       GLU  51   5.127  15.277  10.526
  354   2HG   GLU  51          2HG       GLU  51   5.200  15.198  12.285
  355    H    ASP  52           H        ASP  52   4.977  14.648   8.201
  356    HA   ASP  52           HA       ASP  52   2.372  13.556   8.210
  357   1HB   ASP  52          1HB       ASP  52   3.871  15.679   6.696
  358   2HB   ASP  52          2HB       ASP  52   2.271  15.189   6.197
  359    H    PHE  53           H        PHE  53   5.192  13.510   6.125
  360    HA   PHE  53           HA       PHE  53   4.124  12.126   3.976
  361   1HB   PHE  53          1HB       PHE  53   6.343  13.229   3.916
  362   2HB   PHE  53          2HB       PHE  53   6.897  12.170   5.196
  363    HD1  PHE  53           1HD      PHE  53   6.188  12.488   1.663
  364    HD2  PHE  53           2HD      PHE  53   7.456   9.890   4.744
  365    HE1  PHE  53           1HE      PHE  53   6.986  10.903  -0.033
  366    HE2  PHE  53           2HE      PHE  53   8.249   8.283   3.092
  367    HZ   PHE  53           HZ       PHE  53   8.020   8.810   0.651
  368    H    LYS  54           H        LYS  54   5.708  10.998   6.842
  369    HA   LYS  54           HA       LYS  54   5.571   8.172   6.408
  370   1HB   LYS  54          1HB       LYS  54   5.849   9.824   8.903
  371   2HB   LYS  54          2HB       LYS  54   5.908   8.066   8.886
  372   1HG   LYS  54          1HG       LYS  54   7.882   8.049   7.561
  373   2HG   LYS  54          2HG       LYS  54   7.727   9.764   7.196
  374   1HD   LYS  54          1HD       LYS  54   9.488   9.338   8.824
  375   2HD   LYS  54          2HD       LYS  54   8.201  10.322   9.516
  376   1HE   LYS  54          1HE       LYS  54   8.917   8.686  11.119
  377   2HE   LYS  54          2HE       LYS  54   7.287   8.279  10.595
  378   1HZ   LYS  54          1HZ       LYS  54   9.809   6.987   9.681
  379   2HZ   LYS  54          2HZ       LYS  54   8.282   6.593   9.119
  380   3HZ   LYS  54          3HZ       LYS  54   8.680   6.335  10.742
  381    H    HIS  55           H        HIS  55   3.363  10.442   8.031
  382    HA   HIS  55           HA       HIS  55   1.569   8.499   9.124
  383   1HB   HIS  55          1HB       HIS  55   1.744  10.881   9.886
  384   2HB   HIS  55          2HB       HIS  55   1.198  11.392   8.310
  385    HD1  HIS  55           1HD      HIS  55  -0.069   9.721  11.434
  386    HD2  HIS  55           2HD      HIS  55  -1.581  11.453   7.961
  387    HE1  HIS  55           1HE      HIS  55  -2.518   9.975  11.828
  388    H    LEU  56           H        LEU  56   1.537  10.429   6.202
  389    HA   LEU  56           HA       LEU  56  -0.910   9.330   5.252
  390   1HB   LEU  56          1HB       LEU  56   0.709  11.427   4.564
  391   2HB   LEU  56          2HB       LEU  56   0.973  10.299   3.261
  392    HG   LEU  56           HG       LEU  56  -1.303  11.952   3.967
  393   1HD1  LEU  56          1HD1      LEU  56  -0.301  10.910   1.368
  394   2HD1  LEU  56          2HD1      LEU  56   0.060  12.453   2.130
  395   3HD1  LEU  56          3HD1      LEU  56  -1.575  12.115   1.586
  396   1HD2  LEU  56          1HD2      LEU  56  -2.447   9.865   4.361
  397   2HD2  LEU  56          2HD2      LEU  56  -1.799   9.181   2.876
  398   3HD2  LEU  56          3HD2      LEU  56  -2.968  10.496   2.815
  399    H    ALA  57           H        ALA  57   2.537   8.532   4.538
  400    HA   ALA  57           HA       ALA  57   1.954   6.616   2.607
  401   1HB   ALA  57          1HB       ALA  57   4.262   7.449   3.077
  402   2HB   ALA  57          2HB       ALA  57   4.181   5.688   3.047
  403   3HB   ALA  57          3HB       ALA  57   4.248   6.541   4.588
  404    H    ARG  58           H        ARG  58   2.009   6.379   6.036
  405    HA   ARG  58           HA       ARG  58   1.628   3.558   6.243
  406   1HB   ARG  58          1HB       ARG  58   0.786   5.755   8.111
  407   2HB   ARG  58          2HB       ARG  58   0.626   4.048   8.478
  408   1HG   ARG  58          1HG       ARG  58   2.993   3.766   8.431
  409   2HG   ARG  58          2HG       ARG  58   3.219   5.433   7.880
  410   1HD   ARG  58          1HD       ARG  58   2.149   6.231   9.905
  411   2HD   ARG  58          2HD       ARG  58   1.990   4.572  10.482
  412    HE   ARG  58           HE       ARG  58   4.554   4.628  10.100
  413   1HH1  ARG  58          1HH1      ARG  58   2.564   7.207  11.479
  414   2HH1  ARG  58          2HH1      ARG  58   3.804   7.830  12.464
  415   1HH2  ARG  58          1HH2      ARG  58   6.256   5.456  11.511
  416   2HH2  ARG  58          2HH2      ARG  58   5.946   6.784  12.506
  417    H    LYS  59           H        LYS  59  -0.660   6.252   6.333
  418    HA   LYS  59           HA       LYS  59  -2.959   4.763   6.684
  419   1HB   LYS  59          1HB       LYS  59  -2.747   7.346   5.137
  420   2HB   LYS  59          2HB       LYS  59  -4.233   6.622   5.726
  421   1HG   LYS  59          1HG       LYS  59  -3.199   6.827   8.053
  422   2HG   LYS  59          2HG       LYS  59  -2.006   7.879   7.294
  423   1HD   LYS  59          1HD       LYS  59  -3.807   9.215   8.253
  424   2HD   LYS  59          2HD       LYS  59  -3.855   9.332   6.489
  425   1HE   LYS  59          1HE       LYS  59  -5.668   7.809   6.344
  426   2HE   LYS  59          2HE       LYS  59  -5.475   7.327   8.026
  427   1HZ   LYS  59          1HZ       LYS  59  -6.164   9.685   8.561
  428   2HZ   LYS  59          2HZ       LYS  59  -7.266   8.596   7.979
  429   3HZ   LYS  59          3HZ       LYS  59  -6.728   9.808   6.949
  430    H    LEU  60           H        LEU  60  -1.443   5.826   3.683
  431    HA   LEU  60           HA       LEU  60  -3.437   4.963   2.097
  432   1HB   LEU  60          1HB       LEU  60  -0.563   5.432   1.449
  433   2HB   LEU  60          2HB       LEU  60  -1.817   5.306   0.203
  434    HG   LEU  60           HG       LEU  60  -2.034   7.169   2.477
  435   1HD1  LEU  60          1HD1      LEU  60  -0.672   7.720  -0.183
  436   2HD1  LEU  60          2HD1      LEU  60  -0.012   7.893   1.437
  437   3HD1  LEU  60          3HD1      LEU  60  -1.271   8.985   0.878
  438   1HD2  LEU  60          1HD2      LEU  60  -4.050   6.708   1.345
  439   2HD2  LEU  60          2HD2      LEU  60  -3.346   7.085  -0.228
  440   3HD2  LEU  60          3HD2      LEU  60  -3.588   8.369   0.963
  441    H    THR  61           H        THR  61  -0.377   3.492   3.033
  442    HA   THR  61           HA       THR  61  -0.390   1.108   1.540
  443    HB   THR  61           HB       THR  61   0.598   1.464   4.398
  444    HG1  THR  61           1HG      THR  61   1.663   2.946   3.121
  445   1HG2  THR  61          1HG2      THR  61   0.449  -0.890   3.705
  446   2HG2  THR  61          2HG2      THR  61   2.133  -0.387   3.866
  447   3HG2  THR  61          3HG2      THR  61   1.408  -0.532   2.267
  448    H    HIS  62           H        HIS  62  -1.774   1.997   4.554
  449    HA   HIS  62           HA       HIS  62  -2.734  -0.640   5.092
  450   1HB   HIS  62          1HB       HIS  62  -1.985   1.050   6.817
  451   2HB   HIS  62          2HB       HIS  62  -3.485   1.909   6.519
  452    HD1  HIS  62           1HD      HIS  62  -2.253  -1.440   7.853
  453    HD2  HIS  62           2HD      HIS  62  -5.585   1.051   8.048
  454    HE1  HIS  62           1HE      HIS  62  -3.753  -2.475   9.548
  455    H    GLY  63           H        GLY  63  -4.160   2.158   3.589
  456   1HA   GLY  63          1HA       GLY  63  -6.826   1.147   3.782
  457   2HA   GLY  63          2HA       GLY  63  -6.351   2.496   2.787
  458    H    VAL  64           H        VAL  64  -4.289   0.964   1.327
  459    HA   VAL  64           HA       VAL  64  -5.963  -0.269  -0.685
  460    HB   VAL  64           HB       VAL  64  -2.931  -0.347  -0.298
  461   1HG1  VAL  64          1HG1      VAL  64  -4.522  -1.172  -2.745
  462   2HG1  VAL  64          2HG1      VAL  64  -3.698  -2.290  -1.674
  463   3HG1  VAL  64          3HG1      VAL  64  -2.774  -1.161  -2.644
  464   1HG2  VAL  64          1HG2      VAL  64  -3.767   1.886  -0.752
  465   2HG2  VAL  64          2HG2      VAL  64  -4.628   1.290  -2.174
  466   3HG2  VAL  64          3HG2      VAL  64  -2.868   1.274  -2.142
  467    H    MET  65           H        MET  65  -4.080  -1.215   1.882
  468    HA   MET  65           HA       MET  65  -4.060  -4.034   1.566
  469   1HB   MET  65          1HB       MET  65  -2.487  -2.942   3.078
  470   2HB   MET  65          2HB       MET  65  -3.801  -2.293   4.006
  471   1HG   MET  65          1HG       MET  65  -4.436  -4.455   4.731
  472   2HG   MET  65          2HG       MET  65  -3.084  -5.177   3.870
  473   1HE   MET  65          1HE       MET  65  -2.285  -6.184   6.194
  474   2HE   MET  65          2HE       MET  65  -3.684  -5.329   6.885
  475   3HE   MET  65          3HE       MET  65  -2.092  -5.184   7.663
  476    H    ASN  66           H        ASN  66  -6.093  -1.933   3.562
  477    HA   ASN  66           HA       ASN  66  -7.800  -4.006   4.440
  478   1HB   ASN  66          1HB       ASN  66  -7.722  -1.086   4.596
  479   2HB   ASN  66          2HB       ASN  66  -9.308  -1.773   4.815
  480   1HD2  ASN  66          1HD2      ASN  66  -6.221  -1.242   6.024
  481   2HD2  ASN  66          2HD2      ASN  66  -6.428  -1.905   7.615
  482    H    LYS  67           H        LYS  67  -8.014  -1.870   1.722
  483    HA   LYS  67           HA       LYS  67 -10.668  -2.576   1.099
  484   1HB   LYS  67          1HB       LYS  67 -10.290  -1.816  -1.175
  485   2HB   LYS  67          2HB       LYS  67  -9.630  -0.634  -0.004
  486   1HG   LYS  67          1HG       LYS  67  -7.429  -1.432  -0.531
  487   2HG   LYS  67          2HG       LYS  67  -8.096  -2.628  -1.621
  488   1HD   LYS  67          1HD       LYS  67  -8.467   0.343  -1.992
  489   2HD   LYS  67          2HD       LYS  67  -7.191  -0.591  -2.766
  490   1HE   LYS  67          1HE       LYS  67 -10.162  -1.050  -3.106
  491   2HE   LYS  67          2HE       LYS  67  -9.101  -0.268  -4.271
  492   1HZ   LYS  67          1HZ       LYS  67  -9.441  -2.562  -4.884
  493   2HZ   LYS  67          2HZ       LYS  67  -8.964  -3.110  -3.403
  494   3HZ   LYS  67          3HZ       LYS  67  -7.841  -2.401  -4.421
  495    H    GLU  68           H        GLU  68  -7.567  -3.934  -0.025
  496    HA   GLU  68           HA       GLU  68  -9.124  -5.746  -1.476
  497   1HB   GLU  68          1HB       GLU  68  -7.078  -6.800  -2.179
  498   2HB   GLU  68          2HB       GLU  68  -7.196  -5.047  -2.413
  499   1HG   GLU  68          1HG       GLU  68  -5.709  -4.641  -0.624
  500   2HG   GLU  68          2HG       GLU  68  -5.532  -6.362  -0.285
  501    H    LEU  69           H        LEU  69  -7.451  -6.020   1.613
  502    HA   LEU  69           HA       LEU  69  -8.099  -8.662   1.961
  503   1HB   LEU  69          1HB       LEU  69  -8.067  -6.383   3.923
  504   2HB   LEU  69          2HB       LEU  69  -8.377  -8.030   4.421
  505    HG   LEU  69           HG       LEU  69  -5.847  -7.132   3.046
  506   1HD1  LEU  69          1HD1      LEU  69  -6.390  -7.647   5.969
  507   2HD1  LEU  69          2HD1      LEU  69  -6.073  -6.073   5.232
  508   3HD1  LEU  69          3HD1      LEU  69  -4.818  -7.305   5.245
  509   1HD2  LEU  69          1HD2      LEU  69  -5.021  -9.292   3.914
  510   2HD2  LEU  69          2HD2      LEU  69  -6.286  -9.463   2.701
  511   3HD2  LEU  69          3HD2      LEU  69  -6.665  -9.693   4.411
  512    H    LYS  70           H        LYS  70 -10.322  -5.877   2.001
  513    HA   LYS  70           HA       LYS  70 -12.332  -7.564   3.121
  514   1HB   LYS  70          1HB       LYS  70 -13.684  -5.628   3.402
  515   2HB   LYS  70          2HB       LYS  70 -12.031  -5.223   3.840
  516   1HG   LYS  70          1HG       LYS  70 -11.807  -4.216   1.570
  517   2HG   LYS  70          2HG       LYS  70 -13.553  -4.390   1.428
  518   1HD   LYS  70          1HD       LYS  70 -12.077  -2.851   3.557
  519   2HD   LYS  70          2HD       LYS  70 -12.994  -2.155   2.221
  520   1HE   LYS  70          1HE       LYS  70 -14.120  -3.841   4.458
  521   2HE   LYS  70          2HE       LYS  70 -14.201  -2.095   4.381
  522   1HZ   LYS  70          1HZ       LYS  70 -15.515  -3.980   2.469
  523   2HZ   LYS  70          2HZ       LYS  70 -15.545  -2.290   2.361
  524   3HZ   LYS  70          3HZ       LYS  70 -16.267  -3.049   3.652
  525    H    TYR  71           H        TYR  71 -11.272  -6.779   0.026
  526    HA   TYR  71           HA       TYR  71 -13.747  -7.975  -1.203
  527   1HB   TYR  71          1HB       TYR  71 -11.718  -6.089  -2.300
  528   2HB   TYR  71          2HB       TYR  71 -12.945  -6.931  -3.276
  529    HD1  TYR  71           1HD      TYR  71 -12.343  -4.271  -0.953
  530    HD2  TYR  71           2HD      TYR  71 -15.311  -6.706  -2.684
  531    HE1  TYR  71           1HE      TYR  71 -14.013  -2.788  -0.072
  532    HE2  TYR  71           2HE      TYR  71 -17.058  -5.186  -1.860
  533    HH   TYR  71           HH       TYR  71 -16.334  -2.122  -0.573
  534    H    CYS  72           H        CYS  72 -10.442  -8.633  -0.757
  535    HA   CYS  72           HA       CYS  72 -10.584 -10.837  -2.637
  536   1HB   CYS  72          1HB       CYS  72  -8.526  -9.822  -0.707
  537   2HB   CYS  72          2HB       CYS  72  -8.234 -11.321  -1.543
  538    HG   CYS  72           HG       CYS  72  -7.034  -8.695  -2.484
  539    H    LYS  73           H        LYS  73 -10.972 -10.085   0.682
  540    HA   LYS  73           HA       LYS  73 -11.671 -11.060   2.484
  541   1HB   LYS  73          1HB       LYS  73 -12.656 -13.333   0.744
  542   2HB   LYS  73          2HB       LYS  73 -13.045 -13.134   2.441
  543   1HG   LYS  73          1HG       LYS  73 -14.944 -12.181   1.520
  544   2HG   LYS  73          2HG       LYS  73 -13.910 -10.757   1.594
  545   1HD   LYS  73          1HD       LYS  73 -14.928 -10.797  -0.545
  546   2HD   LYS  73          2HD       LYS  73 -13.228 -11.197  -0.744
  547   1HE   LYS  73          1HE       LYS  73 -14.617 -12.637  -2.124
  548   2HE   LYS  73          2HE       LYS  73 -13.805 -13.587  -0.887
  549   1HZ   LYS  73          1HZ       LYS  73 -15.882 -13.607   0.384
  550   2HZ   LYS  73          2HZ       LYS  73 -16.136 -14.208  -1.164
  551   3HZ   LYS  73          3HZ       LYS  73 -16.629 -12.661  -0.786
  552    H    ASN  74           H        ASN  74  -9.746 -13.168   0.524
  553    HA   ASN  74           HA       ASN  74  -8.477 -14.035   3.009
  554   1HB   ASN  74          1HB       ASN  74  -8.631 -15.526   0.374
  555   2HB   ASN  74          2HB       ASN  74  -7.686 -16.044   1.764
  556   1HD2  ASN  74          1HD2      ASN  74 -10.847 -15.794   0.398
  557   2HD2  ASN  74          2HD2      ASN  74 -11.682 -16.665   1.625
  558    HA   PRO  75           HA       PRO  75  -5.055 -11.687   1.513
  559   1HB   PRO  75          1HB       PRO  75  -3.190 -12.761   2.962
  560   2HB   PRO  75          2HB       PRO  75  -4.268 -11.441   3.435
  561   1HG   PRO  75          1HG       PRO  75  -4.303 -14.393   4.175
  562   2HG   PRO  75          2HG       PRO  75  -4.836 -13.043   5.198
  563   1HD   PRO  75          1HD       PRO  75  -6.506 -14.723   3.830
  564   2HD   PRO  75          2HD       PRO  75  -6.929 -13.058   4.275
  565    H    GLU  76           H        GLU  76  -5.414 -14.746   0.961
  566    HA   GLU  76           HA       GLU  76  -2.932 -15.606   0.049
  567   1HB   GLU  76          1HB       GLU  76  -4.853 -17.114   0.445
  568   2HB   GLU  76          2HB       GLU  76  -5.685 -16.416  -0.924
  569   1HG   GLU  76          1HG       GLU  76  -3.961 -17.339  -2.411
  570   2HG   GLU  76          2HG       GLU  76  -3.181 -18.075  -1.010
  571    H    ASP  77           H        ASP  77  -4.899 -13.262  -0.951
  572    HA   ASP  77           HA       ASP  77  -3.841 -13.075  -3.757
  573   1HB   ASP  77          1HB       ASP  77  -6.451 -12.009  -2.666
  574   2HB   ASP  77          2HB       ASP  77  -5.785 -11.605  -4.240
  575    H    LEU  78           H        LEU  78  -3.384 -11.954  -0.748
  576    HA   LEU  78           HA       LEU  78  -3.368  -9.162  -1.329
  577   1HB   LEU  78          1HB       LEU  78  -4.119 -10.142   0.805
  578   2HB   LEU  78          2HB       LEU  78  -2.496 -10.816   0.980
  579    HG   LEU  78           HG       LEU  78  -1.707  -8.550   0.852
  580   1HD1  LEU  78          1HD1      LEU  78  -3.294  -6.774   1.690
  581   2HD1  LEU  78          2HD1      LEU  78  -4.601  -7.937   1.473
  582   3HD1  LEU  78          3HD1      LEU  78  -3.676  -7.370   0.073
  583   1HD2  LEU  78          1HD2      LEU  78  -1.546  -9.707   2.835
  584   2HD2  LEU  78          2HD2      LEU  78  -3.253  -9.503   3.202
  585   3HD2  LEU  78          3HD2      LEU  78  -2.160  -8.114   3.280
  586    H    GLU  79           H        GLU  79  -1.775  -8.901  -2.780
  587    HA   GLU  79           HA       GLU  79   0.994  -9.399  -2.028
  588   1HB   GLU  79          1HB       GLU  79   0.175 -11.185  -3.592
  589   2HB   GLU  79          2HB       GLU  79  -0.405  -9.854  -4.601
  590   1HG   GLU  79          1HG       GLU  79   1.523 -10.743  -5.482
  591   2HG   GLU  79          2HG       GLU  79   1.801  -9.086  -4.980
  592    H    CYS  80           H        CYS  80   2.194  -7.761  -2.667
  593    HA   CYS  80           HA       CYS  80   0.793  -5.425  -3.655
  594   1HB   CYS  80          1HB       CYS  80   2.326  -4.972  -1.868
  595   2HB   CYS  80          2HB       CYS  80   3.645  -5.811  -2.683
  596    HG   CYS  80           HG       CYS  80   4.180  -3.943  -4.453
  597    H    ASN  81           H        ASN  81   0.329  -6.605  -5.531
  598    HA   ASN  81           HA       ASN  81   2.645  -7.054  -7.131
  599   1HB   ASN  81          1HB       ASN  81   1.218  -8.270  -8.755
  600   2HB   ASN  81          2HB       ASN  81   0.902  -8.851  -7.120
  601   1HD2  ASN  81          1HD2      ASN  81  -1.066  -8.472  -6.322
  602   2HD2  ASN  81          2HD2      ASN  81  -2.380  -7.824  -7.235
  603    H    GLU  82           H        GLU  82   1.880  -6.615  -9.619
  604    HA   GLU  82           HA       GLU  82   2.066  -3.994 -10.117
  605   1HB   GLU  82          1HB       GLU  82   1.172  -6.344 -11.372
  606   2HB   GLU  82          2HB       GLU  82   0.989  -4.881 -12.357
  607   1HG   GLU  82          1HG       GLU  82   3.143  -5.855 -12.951
  608   2HG   GLU  82          2HG       GLU  82   3.424  -4.449 -11.919
  609    H    ASN  83           H        ASN  83  -0.866  -5.997 -10.426
  610    HA   ASN  83           HA       ASN  83  -2.829  -4.147 -11.046
  611   1HB   ASN  83          1HB       ASN  83  -3.326  -6.558 -10.930
  612   2HB   ASN  83          2HB       ASN  83  -2.949  -6.564  -9.209
  613   1HD2  ASN  83          1HD2      ASN  83  -4.552  -6.039  -7.754
  614   2HD2  ASN  83          2HD2      ASN  83  -6.152  -5.627  -8.219
  615    H    VAL  84           H        VAL  84  -1.679  -5.223  -7.842
  616    HA   VAL  84           HA       VAL  84  -3.332  -3.472  -6.474
  617    HB   VAL  84           HB       VAL  84  -0.754  -4.815  -5.659
  618   1HG1  VAL  84          1HG1      VAL  84  -1.316  -4.252  -3.339
  619   2HG1  VAL  84          2HG1      VAL  84  -2.634  -3.214  -3.898
  620   3HG1  VAL  84          3HG1      VAL  84  -0.955  -2.816  -4.280
  621   1HG2  VAL  84          1HG2      VAL  84  -3.623  -5.247  -4.975
  622   2HG2  VAL  84          2HG2      VAL  84  -2.257  -6.176  -4.360
  623   3HG2  VAL  84          3HG2      VAL  84  -2.656  -6.224  -6.088
  624    H    LYS  85           H        LYS  85   0.025  -3.169  -7.439
  625    HA   LYS  85           HA       LYS  85   0.502  -0.607  -6.393
  626   1HB   LYS  85          1HB       LYS  85   1.805  -2.115  -8.630
  627   2HB   LYS  85          2HB       LYS  85   2.350  -0.513  -8.142
  628   1HG   LYS  85          1HG       LYS  85   2.748  -1.326  -5.886
  629   2HG   LYS  85          2HG       LYS  85   2.212  -2.938  -6.359
  630   1HD   LYS  85          1HD       LYS  85   4.629  -1.451  -7.418
  631   2HD   LYS  85          2HD       LYS  85   4.649  -2.807  -6.281
  632   1HE   LYS  85          1HE       LYS  85   3.541  -4.157  -8.023
  633   2HE   LYS  85          2HE       LYS  85   3.745  -2.750  -9.091
  634   1HZ   LYS  85          1HZ       LYS  85   6.040  -4.171  -7.830
  635   2HZ   LYS  85          2HZ       LYS  85   6.080  -3.015  -9.085
  636   3HZ   LYS  85          3HZ       LYS  85   5.407  -4.518  -9.355
  637    H    HIS  86           H        HIS  86  -0.649  -1.525  -9.475
  638    HA   HIS  86           HA       HIS  86  -0.747   0.949 -10.753
  639   1HB   HIS  86          1HB       HIS  86  -1.165  -1.172 -11.936
  640   2HB   HIS  86          2HB       HIS  86  -2.662  -1.385 -11.051
  641    HD1  HIS  86           1HD      HIS  86  -3.679  -1.582 -13.527
  642    HD2  HIS  86           2HD      HIS  86  -2.299   2.188 -12.461
  643    HE1  HIS  86           1HE      HIS  86  -4.744  -0.001 -15.148
  644    H    LYS  87           H        LYS  87  -3.218  -0.711  -8.887
  645    HA   LYS  87           HA       LYS  87  -5.063   1.422  -9.007
  646   1HB   LYS  87          1HB       LYS  87  -4.893  -0.942  -7.157
  647   2HB   LYS  87          2HB       LYS  87  -6.239   0.189  -7.187
  648   1HG   LYS  87          1HG       LYS  87  -6.689  -0.387  -9.510
  649   2HG   LYS  87          2HG       LYS  87  -5.312  -1.486  -9.501
  650   1HD   LYS  87          1HD       LYS  87  -6.337  -2.864  -7.850
  651   2HD   LYS  87          2HD       LYS  87  -7.654  -1.704  -7.647
  652   1HE   LYS  87          1HE       LYS  87  -7.045  -3.127 -10.221
  653   2HE   LYS  87          2HE       LYS  87  -8.229  -3.721  -9.047
  654   1HZ   LYS  87          1HZ       LYS  87  -8.337  -1.115 -10.496
  655   2HZ   LYS  87          2HZ       LYS  87  -9.417  -1.605  -9.327
  656   3HZ   LYS  87          3HZ       LYS  87  -9.323  -2.455 -10.777
  657    H    THR  88           H        THR  88  -2.446   0.720  -7.010
  658    HA   THR  88           HA       THR  88  -3.187   2.290  -4.771
  659    HB   THR  88           HB       THR  88  -0.664   1.038  -5.713
  660    HG1  THR  88           1HG      THR  88  -2.085  -0.387  -4.910
  661   1HG2  THR  88          1HG2      THR  88   0.312   1.690  -3.554
  662   2HG2  THR  88          2HG2      THR  88  -1.143   2.684  -3.235
  663   3HG2  THR  88          3HG2      THR  88  -0.098   3.031  -4.632
  664    H    LYS  89           H        LYS  89  -0.688   2.742  -7.207
  665    HA   LYS  89           HA       LYS  89  -0.259   5.220  -6.265
  666   1HB   LYS  89          1HB       LYS  89   0.904   5.621  -8.632
  667   2HB   LYS  89          2HB       LYS  89   1.570   4.618  -7.355
  668   1HG   LYS  89          1HG       LYS  89   1.794   3.406  -9.342
  669   2HG   LYS  89          2HG       LYS  89   0.457   2.671  -8.447
  670   1HD   LYS  89          1HD       LYS  89  -0.264   2.699 -10.496
  671   2HD   LYS  89          2HD       LYS  89  -0.949   4.140  -9.784
  672   1HE   LYS  89          1HE       LYS  89   0.697   5.608 -10.817
  673   2HE   LYS  89          2HE       LYS  89   1.628   4.229 -11.393
  674   1HZ   LYS  89          1HZ       LYS  89   0.421   5.214 -13.196
  675   2HZ   LYS  89          2HZ       LYS  89  -1.013   5.141 -12.360
  676   3HZ   LYS  89          3HZ       LYS  89  -0.260   3.707 -12.882
  677    H    GLU  90           H        GLU  90  -2.401   4.079  -8.782
  678    HA   GLU  90           HA       GLU  90  -3.304   6.607  -9.728
  679   1HB   GLU  90          1HB       GLU  90  -4.755   3.966  -9.632
  680   2HB   GLU  90          2HB       GLU  90  -5.437   5.408 -10.369
  681   1HG   GLU  90          1HG       GLU  90  -2.943   3.962 -11.202
  682   2HG   GLU  90          2HG       GLU  90  -4.477   4.016 -12.070
  683    H    TYR  91           H        TYR  91  -4.171   4.714  -6.887
  684    HA   TYR  91           HA       TYR  91  -6.498   6.185  -6.216
  685   1HB   TYR  91          1HB       TYR  91  -6.441   4.066  -5.215
  686   2HB   TYR  91          2HB       TYR  91  -4.731   4.181  -4.832
  687    HD1  TYR  91           1HD      TYR  91  -7.877   6.004  -3.955
  688    HD2  TYR  91           2HD      TYR  91  -4.225   4.310  -2.569
  689    HE1  TYR  91           1HE      TYR  91  -8.455   6.627  -1.670
  690    HE2  TYR  91           2HE      TYR  91  -4.748   4.931  -0.319
  691    HH   TYR  91           HH       TYR  91  -6.217   6.615   0.868
  692    H    ILE  92           H        ILE  92  -3.162   6.020  -5.169
  693    HA   ILE  92           HA       ILE  92  -2.980   8.099  -3.358
  694    HB   ILE  92           HB       ILE  92  -0.984   7.254  -5.458
  695   1HG1  ILE  92          1HG1      ILE  92  -1.926   5.739  -3.517
  696   2HG1  ILE  92          2HG1      ILE  92  -0.209   5.592  -3.995
  697   1HG2  ILE  92          1HG2      ILE  92   0.756   8.337  -4.083
  698   2HG2  ILE  92          2HG2      ILE  92  -0.525   8.931  -3.009
  699   3HG2  ILE  92          3HG2      ILE  92  -0.471   9.474  -4.678
  700   1HD1  ILE  92          1HD1      ILE  92  -1.533   6.989  -1.737
  701   2HD1  ILE  92          2HD1      ILE  92   0.208   7.118  -2.097
  702   3HD1  ILE  92          3HD1      ILE  92  -0.495   5.558  -1.636
  703    H    LYS  93           H        LYS  93  -2.364   8.395  -6.837
  704    HA   LYS  93           HA       LYS  93  -1.955  11.147  -6.794
  705   1HB   LYS  93          1HB       LYS  93  -3.155   9.460  -9.002
  706   2HB   LYS  93          2HB       LYS  93  -2.637  11.132  -9.183
  707   1HG   LYS  93          1HG       LYS  93  -0.339  10.480  -8.655
  708   2HG   LYS  93          2HG       LYS  93  -0.860   8.812  -8.445
  709   1HD   LYS  93          1HD       LYS  93   0.152   9.098 -10.636
  710   2HD   LYS  93          2HD       LYS  93  -1.569   8.758 -10.809
  711   1HE   LYS  93          1HE       LYS  93  -2.015  11.129 -11.169
  712   2HE   LYS  93          2HE       LYS  93  -0.310  11.503 -10.938
  713   1HZ   LYS  93          1HZ       LYS  93  -1.427   9.812 -13.104
  714   2HZ   LYS  93          2HZ       LYS  93   0.207  10.222 -12.906
  715   3HZ   LYS  93          3HZ       LYS  93  -0.899  11.403 -13.272
  716    H    LYS  94           H        LYS  94  -4.933   9.334  -7.212
  717    HA   LYS  94           HA       LYS  94  -6.433  11.667  -7.746
  718   1HB   LYS  94          1HB       LYS  94  -7.092   9.311  -8.468
  719   2HB   LYS  94          2HB       LYS  94  -7.437   8.950  -6.799
  720   1HG   LYS  94          1HG       LYS  94  -8.928  11.043  -8.374
  721   2HG   LYS  94          2HG       LYS  94  -9.413   9.353  -8.305
  722   1HD   LYS  94          1HD       LYS  94  -9.592   9.571  -5.837
  723   2HD   LYS  94          2HD       LYS  94  -9.230  11.286  -5.989
  724   1HE   LYS  94          1HE       LYS  94 -11.603  10.976  -5.794
  725   2HE   LYS  94          2HE       LYS  94 -11.238  11.520  -7.429
  726   1HZ   LYS  94          1HZ       LYS  94 -11.742   8.707  -6.628
  727   2HZ   LYS  94          2HZ       LYS  94 -11.464   9.225  -8.204
  728   3HZ   LYS  94          3HZ       LYS  94 -12.854   9.702  -7.385
  729    H    TYR  95           H        TYR  95  -5.650   9.809  -4.901
  730    HA   TYR  95           HA       TYR  95  -7.338  11.069  -3.097
  731   1HB   TYR  95          1HB       TYR  95  -6.317   9.006  -2.615
  732   2HB   TYR  95          2HB       TYR  95  -4.713   9.690  -2.911
  733    HD1  TYR  95           1HD      TYR  95  -7.701   9.868  -0.724
  734    HD2  TYR  95           2HD      TYR  95  -3.553  10.683  -1.083
  735    HE1  TYR  95           1HE      TYR  95  -7.644  10.541   1.633
  736    HE2  TYR  95           2HE      TYR  95  -3.484  11.381   1.241
  737    HH   TYR  95           HH       TYR  95  -6.265  10.921   3.374
  738    H    MET  96           H        MET  96  -3.946  11.711  -3.849
  739    HA   MET  96           HA       MET  96  -3.707  13.855  -2.094
  740   1HB   MET  96          1HB       MET  96  -2.152  13.553  -4.657
  741   2HB   MET  96          2HB       MET  96  -1.727  14.440  -3.188
  742   1HG   MET  96          1HG       MET  96  -1.993  11.457  -3.381
  743   2HG   MET  96          2HG       MET  96  -0.475  12.345  -3.423
  744   1HE   MET  96          1HE       MET  96  -0.370  13.923   0.103
  745   2HE   MET  96          2HE       MET  96  -1.182  14.623  -1.312
  746   3HE   MET  96          3HE       MET  96   0.369  13.823  -1.516
  747    H    GLN  97           H        GLN  97  -5.021  13.706  -5.199
  748    HA   GLN  97           HA       GLN  97  -4.942  16.491  -5.814
  749   1HB   GLN  97          1HB       GLN  97  -7.184  14.713  -6.761
  750   2HB   GLN  97          2HB       GLN  97  -6.612  16.196  -7.498
  751   1HG   GLN  97          1HG       GLN  97  -5.336  13.493  -7.473
  752   2HG   GLN  97          2HG       GLN  97  -5.848  14.434  -8.858
  753   1HE2  GLN  97          1HE2      GLN  97  -3.459  13.761  -6.603
  754   2HE2  GLN  97          2HE2      GLN  97  -2.177  14.735  -7.182
  755    H    LYS  98           H        LYS  98  -6.853  14.794  -3.584
  756    HA   LYS  98           HA       LYS  98  -9.025  16.677  -3.494
  757   1HB   LYS  98          1HB       LYS  98  -9.955  15.396  -1.747
  758   2HB   LYS  98          2HB       LYS  98  -9.157  14.242  -2.789
  759   1HG   LYS  98          1HG       LYS  98  -7.800  13.559  -1.184
  760   2HG   LYS  98          2HG       LYS  98  -7.418  15.198  -0.678
  761   1HD   LYS  98          1HD       LYS  98  -9.897  13.612   0.053
  762   2HD   LYS  98          2HD       LYS  98  -8.501  13.849   1.086
  763   1HE   LYS  98          1HE       LYS  98 -10.145  15.390   1.828
  764   2HE   LYS  98          2HE       LYS  98  -8.923  16.317   0.984
  765   1HZ   LYS  98          1HZ       LYS  98 -11.512  15.501  -0.256
  766   2HZ   LYS  98          2HZ       LYS  98 -10.455  16.713  -0.819
  767   3HZ   LYS  98          3HZ       LYS  98 -11.302  16.914   0.594
  768    H    PHE  99           H        PHE  99  -5.899  16.559  -2.146
  769    HA   PHE  99           HA       PHE  99  -6.485  18.236   0.131
  770   1HB   PHE  99          1HB       PHE  99  -3.854  17.371  -1.062
  771   2HB   PHE  99          2HB       PHE  99  -3.977  18.429   0.332
  772    HD1  PHE  99           1HD      PHE  99  -5.777  17.374   2.121
  773    HD2  PHE  99           2HD      PHE  99  -3.265  15.235  -0.546
  774    HE1  PHE  99           1HE      PHE  99  -5.819  15.408   3.656
  775    HE2  PHE  99           2HE      PHE  99  -3.313  13.289   0.991
  776    HZ   PHE  99           HZ       PHE  99  -4.637  13.398   3.051
  777    H    GLY 100           H        GLY 100  -5.087  18.692  -3.053
  778   1HA   GLY 100          1HA       GLY 100  -5.548  20.710  -4.211
  779   2HA   GLY 100          2HA       GLY 100  -5.394  21.563  -2.667
  780    H    ALA 101           H        ALA 101  -3.686  22.702  -2.835
  781    HA   ALA 101           HA       ALA 101  -1.347  21.902  -4.311
  782   1HB   ALA 101          1HB       ALA 101  -1.985  24.257  -4.112
  783   2HB   ALA 101          2HB       ALA 101  -0.345  23.968  -3.527
  784   3HB   ALA 101          3HB       ALA 101  -1.670  24.185  -2.380
  785    H    VAL 102           H        VAL 102  -2.118  22.088  -0.849
  786    HA   VAL 102           HA       VAL 102   0.442  20.708  -0.404
  787    HB   VAL 102           HB       VAL 102  -0.918  22.100   1.839
  788   1HG1  VAL 102          1HG1      VAL 102   1.337  22.597   2.620
  789   2HG1  VAL 102          2HG1      VAL 102   1.975  21.778   1.191
  790   3HG1  VAL 102          3HG1      VAL 102   1.019  20.880   2.371
  791   1HG2  VAL 102          1HG2      VAL 102   0.195  24.263   1.370
  792   2HG2  VAL 102          2HG2      VAL 102  -1.079  23.825   0.228
  793   3HG2  VAL 102          3HG2      VAL 102   0.614  23.646  -0.238
  794    H    TYR 103           H        TYR 103   0.473  19.186   1.301
  795    HA   TYR 103           HA       TYR 103  -1.932  17.670   1.352
  796   1HB   TYR 103          1HB       TYR 103  -0.085  16.259   0.993
  797   2HB   TYR 103          2HB       TYR 103   0.919  17.151   2.122
  798    HD1  TYR 103           1HD      TYR 103  -2.434  15.677   2.736
  799    HD2  TYR 103           2HD      TYR 103   1.696  15.481   3.507
  800    HE1  TYR 103           1HE      TYR 103  -2.877  14.053   4.454
  801    HE2  TYR 103           2HE      TYR 103   1.291  13.785   5.263
  802    HH   TYR 103           HH       TYR 103  -0.527  13.202   6.782
  803    H    LYS 104           H        LYS 104  -3.340  18.489   2.582
  804    HA   LYS 104           HA       LYS 104  -2.677  19.189   5.330
  805   1HB   LYS 104          1HB       LYS 104  -4.997  19.992   3.569
  806   2HB   LYS 104          2HB       LYS 104  -4.756  20.561   5.209
  807   1HG   LYS 104          1HG       LYS 104  -2.733  21.736   4.538
  808   2HG   LYS 104          2HG       LYS 104  -2.858  21.064   2.915
  809   1HD   LYS 104          1HD       LYS 104  -4.857  22.937   4.201
  810   2HD   LYS 104          2HD       LYS 104  -3.630  23.408   3.028
  811   1HE   LYS 104          1HE       LYS 104  -4.668  21.873   1.378
  812   2HE   LYS 104          2HE       LYS 104  -5.919  21.492   2.554
  813   1HZ   LYS 104          1HZ       LYS 104  -6.735  23.166   1.044
  814   2HZ   LYS 104          2HZ       LYS 104  -5.411  24.154   1.346
  815   3HZ   LYS 104          3HZ       LYS 104  -6.531  23.865   2.563
  816    HA   PRO 105           HA       PRO 105  -4.924  15.108   5.478
  817   1HB   PRO 105          1HB       PRO 105  -4.153  14.522   8.048
  818   2HB   PRO 105          2HB       PRO 105  -3.222  14.086   6.613
  819   1HG   PRO 105          1HG       PRO 105  -2.905  16.367   8.464
  820   2HG   PRO 105          2HG       PRO 105  -1.650  15.364   7.661
  821   1HD   PRO 105          1HD       PRO 105  -2.271  17.869   6.876
  822   2HD   PRO 105          2HD       PRO 105  -1.771  16.635   5.713
  823    H    LYS 106           H        LYS 106  -5.149  17.719   7.742
  824    HA   LYS 106           HA       LYS 106  -7.584  16.805   8.778
  825   1HB   LYS 106          1HB       LYS 106  -6.579  19.640   8.615
  826   2HB   LYS 106          2HB       LYS 106  -8.177  19.281   9.247
  827   1HG   LYS 106          1HG       LYS 106  -6.854  19.392  11.171
  828   2HG   LYS 106          2HG       LYS 106  -6.972  17.668  10.854
  829   1HD   LYS 106          1HD       LYS 106  -4.714  17.967  11.363
  830   2HD   LYS 106          2HD       LYS 106  -4.723  17.989   9.600
  831   1HE   LYS 106          1HE       LYS 106  -4.817  20.497   9.711
  832   2HE   LYS 106          2HE       LYS 106  -4.650  20.364  11.449
  833   1HZ   LYS 106          1HZ       LYS 106  -2.625  19.398   9.483
  834   2HZ   LYS 106          2HZ       LYS 106  -2.470  19.337  11.156
  835   3HZ   LYS 106          3HZ       LYS 106  -2.551  20.816  10.366
  836    H    GLU 107           H        GLU 107  -7.000  17.736   5.656
  837    HA   GLU 107           HA       GLU 107  -9.782  18.283   4.961
  838   1HB   GLU 107          1HB       GLU 107  -7.363  17.706   3.258
  839   2HB   GLU 107          2HB       GLU 107  -8.940  18.108   2.615
  840   1HG   GLU 107          1HG       GLU 107  -7.246  19.902   4.332
  841   2HG   GLU 107          2HG       GLU 107  -7.365  19.970   2.573
  842    H    ASP 108           H        ASP 108  -7.645  15.576   5.351
  843    HA   ASP 108           HA       ASP 108  -8.366  13.800   3.469
  844   1HB   ASP 108          1HB       ASP 108  -6.531  13.192   4.705
  845   2HB   ASP 108          2HB       ASP 108  -7.300  13.426   6.249
  846    H    THR 109           H        THR 109  -9.672  12.210   3.257
  847    HA   THR 109           HA       THR 109 -12.343  12.809   3.672
  848    HB   THR 109           HB       THR 109 -11.811  11.755   1.672
  849    HG1  THR 109           1HG      THR 109 -13.032   9.686   3.208
  850   1HG2  THR 109          1HG2      THR 109  -9.716  10.739   2.231
  851   2HG2  THR 109          2HG2      THR 109 -10.756   9.493   1.524
  852   3HG2  THR 109          3HG2      THR 109 -10.503   9.567   3.273
  Start of MODEL   18
    1    H    THR  10           H        THR  10  -4.588 -23.832   3.949
    2    HA   THR  10           HA       THR  10  -4.018 -22.700   5.691
    3    HB   THR  10           HB       THR  10  -1.790 -23.233   6.791
    4    HG1  THR  10           1HG      THR  10  -1.259 -24.136   4.280
    5   1HG2  THR  10          1HG2      THR  10  -2.366 -25.596   7.178
    6   2HG2  THR  10          2HG2      THR  10  -3.444 -25.551   5.784
    7   3HG2  THR  10          3HG2      THR  10  -3.794 -24.560   7.200
    8    H    SER  11           H        SER  11  -4.343 -21.027   4.185
    9    HA   SER  11           HA       SER  11  -2.205 -19.111   3.592
   10   1HB   SER  11          1HB       SER  11  -5.126 -18.880   3.559
   11   2HB   SER  11          2HB       SER  11  -3.943 -17.987   2.558
   12    HG   SER  11           HG       SER  11  -4.592 -19.623   1.141
   13    H    SER  12           H        SER  12  -4.100 -19.891   6.206
   14    HA   SER  12           HA       SER  12  -4.225 -17.380   7.331
   15   1HB   SER  12          1HB       SER  12  -4.337 -18.779   9.437
   16   2HB   SER  12          2HB       SER  12  -5.473 -19.154   8.117
   17    HG   SER  12           HG       SER  12  -3.403 -20.686   9.135
   18    H    GLU  13           H        GLU  13  -1.567 -20.031   7.686
   19    HA   GLU  13           HA       GLU  13  -0.061 -18.204   9.014
   20   1HB   GLU  13          1HB       GLU  13   1.667 -20.078   8.794
   21   2HB   GLU  13          2HB       GLU  13   0.172 -20.493   9.628
   22   1HG   GLU  13          1HG       GLU  13  -0.636 -21.733   7.837
   23   2HG   GLU  13          2HG       GLU  13   0.427 -20.960   6.686
   24    H    LEU  14           H        LEU  14  -0.349 -19.308   5.721
   25    HA   LEU  14           HA       LEU  14   2.188 -18.633   4.695
   26   1HB   LEU  14          1HB       LEU  14   0.205 -19.950   3.644
   27   2HB   LEU  14          2HB       LEU  14  -0.403 -18.386   3.210
   28    HG   LEU  14           HG       LEU  14   0.731 -19.598   1.336
   29   1HD1  LEU  14          1HD1      LEU  14   1.946 -16.941   2.061
   30   2HD1  LEU  14          2HD1      LEU  14   0.438 -17.198   1.188
   31   3HD1  LEU  14          3HD1      LEU  14   1.970 -17.688   0.465
   32   1HD2  LEU  14          1HD2      LEU  14   2.530 -20.594   2.642
   33   2HD2  LEU  14          2HD2      LEU  14   3.253 -18.996   2.870
   34   3HD2  LEU  14          3HD2      LEU  14   3.129 -19.694   1.256
   35    H    ALA  15           H        ALA  15  -0.607 -16.961   5.207
   36    HA   ALA  15           HA       ALA  15   0.378 -14.631   3.811
   37   1HB   ALA  15          1HB       ALA  15  -1.866 -15.163   3.232
   38   2HB   ALA  15          2HB       ALA  15  -1.772 -13.606   4.080
   39   3HB   ALA  15          3HB       ALA  15  -2.339 -15.040   4.929
   40    H    LYS  16           H        LYS  16   0.157 -15.837   6.906
   41    HA   LYS  16           HA       LYS  16  -0.063 -13.514   8.486
   42   1HB   LYS  16          1HB       LYS  16  -0.099 -15.854   9.350
   43   2HB   LYS  16          2HB       LYS  16   1.610 -15.989   8.988
   44   1HG   LYS  16          1HG       LYS  16   2.120 -14.281  10.625
   45   2HG   LYS  16          2HG       LYS  16   0.401 -14.057  10.953
   46   1HD   LYS  16          1HD       LYS  16   0.264 -16.421  11.653
   47   2HD   LYS  16          2HD       LYS  16   2.003 -16.572  11.403
   48   1HE   LYS  16          1HE       LYS  16   2.391 -14.849  13.092
   49   2HE   LYS  16          2HE       LYS  16   0.653 -14.687  13.327
   50   1HZ   LYS  16          1HZ       LYS  16   2.223 -17.153  13.836
   51   2HZ   LYS  16          2HZ       LYS  16   0.569 -16.976  14.071
   52   3HZ   LYS  16          3HZ       LYS  16   1.644 -16.102  15.015
   53    H    LYS  17           H        LYS  17   2.614 -14.997   6.824
   54    HA   LYS  17           HA       LYS  17   4.414 -12.904   7.594
   55   1HB   LYS  17          1HB       LYS  17   4.744 -15.151   5.617
   56   2HB   LYS  17          2HB       LYS  17   5.961 -13.909   5.860
   57   1HG   LYS  17          1HG       LYS  17   6.728 -15.631   7.184
   58   2HG   LYS  17          2HG       LYS  17   5.866 -14.632   8.347
   59   1HD   LYS  17          1HD       LYS  17   5.273 -16.883   8.813
   60   2HD   LYS  17          2HD       LYS  17   3.886 -16.175   7.978
   61   1HE   LYS  17          1HE       LYS  17   4.549 -17.213   5.897
   62   2HE   LYS  17          2HE       LYS  17   6.037 -17.812   6.627
   63   1HZ   LYS  17          1HZ       LYS  17   3.280 -18.601   7.342
   64   2HZ   LYS  17          2HZ       LYS  17   4.664 -19.166   8.116
   65   3HZ   LYS  17          3HZ       LYS  17   4.401 -19.547   6.507
   66    H    SER  18           H        SER  18   2.446 -13.742   4.739
   67    HA   SER  18           HA       SER  18   3.570 -11.895   3.028
   68   1HB   SER  18          1HB       SER  18   0.738 -12.942   2.944
   69   2HB   SER  18          2HB       SER  18   1.652 -12.279   1.603
   70    HG   SER  18           HG       SER  18   2.392 -14.167   1.282
   71    H    LYS  19           H        LYS  19   1.238 -11.406   5.576
   72    HA   LYS  19           HA       LYS  19   0.165  -8.801   4.806
   73   1HB   LYS  19          1HB       LYS  19   0.744  -9.980   7.549
   74   2HB   LYS  19          2HB       LYS  19  -0.271  -8.596   7.220
   75   1HG   LYS  19          1HG       LYS  19  -0.931 -11.382   6.246
   76   2HG   LYS  19          2HG       LYS  19  -1.442 -10.779   7.810
   77   1HD   LYS  19          1HD       LYS  19  -2.089  -9.439   5.193
   78   2HD   LYS  19          2HD       LYS  19  -3.152 -10.591   6.002
   79   1HE   LYS  19          1HE       LYS  19  -2.200  -7.954   7.149
   80   2HE   LYS  19          2HE       LYS  19  -3.774  -8.244   6.427
   81   1HZ   LYS  19          1HZ       LYS  19  -3.914  -8.333   8.777
   82   2HZ   LYS  19          2HZ       LYS  19  -2.707  -9.492   8.896
   83   3HZ   LYS  19          3HZ       LYS  19  -4.202  -9.884   8.172
   84    H    GLU  20           H        GLU  20   3.047  -9.874   6.341
   85    HA   GLU  20           HA       GLU  20   3.837  -7.181   6.928
   86   1HB   GLU  20          1HB       GLU  20   5.341  -9.762   7.115
   87   2HB   GLU  20          2HB       GLU  20   5.812  -8.216   7.833
   88   1HG   GLU  20          1HG       GLU  20   3.262  -9.493   8.221
   89   2HG   GLU  20          2HG       GLU  20   4.605  -9.858   9.354
   90    H    VAL  21           H        VAL  21   4.730  -9.754   4.714
   91    HA   VAL  21           HA       VAL  21   6.852  -8.380   3.415
   92    HB   VAL  21           HB       VAL  21   4.923 -10.410   2.277
   93   1HG1  VAL  21          1HG1      VAL  21   6.756 -10.923   0.703
   94   2HG1  VAL  21          2HG1      VAL  21   7.734  -9.669   1.456
   95   3HG1  VAL  21          3HG1      VAL  21   6.262  -9.232   0.589
   96   1HG2  VAL  21          1HG2      VAL  21   6.581 -12.123   2.837
   97   2HG2  VAL  21          2HG2      VAL  21   5.980 -11.305   4.278
   98   3HG2  VAL  21          3HG2      VAL  21   7.569 -10.898   3.629
   99    H    PHE  22           H        PHE  22   3.409  -8.515   2.924
  100    HA   PHE  22           HA       PHE  22   3.477  -6.940   0.503
  101   1HB   PHE  22          1HB       PHE  22   1.548  -8.232   0.568
  102   2HB   PHE  22          2HB       PHE  22   1.327  -7.952   2.295
  103    HD1  PHE  22           1HD      PHE  22  -0.380  -6.502   2.937
  104    HD2  PHE  22           2HD      PHE  22   1.265  -6.031  -0.962
  105    HE1  PHE  22           1HE      PHE  22  -1.967  -4.710   2.479
  106    HE2  PHE  22           2HE      PHE  22  -0.354  -4.202  -1.405
  107    HZ   PHE  22           HZ       PHE  22  -1.986  -3.581   0.347
  108    H    ARG  23           H        ARG  23   2.431  -6.252   3.828
  109    HA   ARG  23           HA       ARG  23   2.029  -3.544   3.219
  110   1HB   ARG  23          1HB       ARG  23   2.036  -2.954   5.543
  111   2HB   ARG  23          2HB       ARG  23   1.248  -4.506   5.278
  112   1HG   ARG  23          1HG       ARG  23   2.646  -5.595   6.603
  113   2HG   ARG  23          2HG       ARG  23   4.064  -4.790   5.930
  114   1HD   ARG  23          1HD       ARG  23   3.894  -3.012   7.341
  115   2HD   ARG  23          2HD       ARG  23   2.210  -3.343   7.798
  116    HE   ARG  23           HE       ARG  23   3.508  -5.520   8.709
  117   1HH1  ARG  23          1HH1      ARG  23   4.210  -2.069   9.182
  118   2HH1  ARG  23          2HH1      ARG  23   4.865  -2.281  10.718
  119   1HH2  ARG  23          1HH2      ARG  23   4.455  -5.813  10.760
  120   2HH2  ARG  23          2HH2      ARG  23   5.051  -4.471  11.655
  121    H    LYS  24           H        LYS  24   5.065  -5.162   3.930
  122    HA   LYS  24           HA       LYS  24   6.455  -2.793   4.414
  123   1HB   LYS  24          1HB       LYS  24   7.425  -5.526   3.606
  124   2HB   LYS  24          2HB       LYS  24   8.527  -4.179   3.829
  125   1HG   LYS  24          1HG       LYS  24   6.680  -5.297   5.938
  126   2HG   LYS  24          2HG       LYS  24   8.404  -5.625   5.804
  127   1HD   LYS  24          1HD       LYS  24   8.889  -3.255   6.150
  128   2HD   LYS  24          2HD       LYS  24   7.164  -2.907   6.261
  129   1HE   LYS  24          1HE       LYS  24   7.000  -4.349   8.229
  130   2HE   LYS  24          2HE       LYS  24   8.721  -4.705   8.106
  131   1HZ   LYS  24          1HZ       LYS  24   9.190  -2.359   8.509
  132   2HZ   LYS  24          2HZ       LYS  24   8.296  -3.004   9.766
  133   3HZ   LYS  24          3HZ       LYS  24   7.548  -2.014   8.632
  134    H    GLU  25           H        GLU  25   6.044  -4.820   1.402
  135    HA   GLU  25           HA       GLU  25   7.743  -3.046  -0.039
  136   1HB   GLU  25          1HB       GLU  25   6.570  -4.336  -1.970
  137   2HB   GLU  25          2HB       GLU  25   7.891  -5.122  -1.053
  138   1HG   GLU  25          1HG       GLU  25   6.017  -6.180   0.211
  139   2HG   GLU  25          2HG       GLU  25   4.917  -5.472  -0.956
  140    H    MET  26           H        MET  26   4.385  -3.272   0.556
  141    HA   MET  26           HA       MET  26   3.738  -1.514  -1.548
  142   1HB   MET  26          1HB       MET  26   2.243  -3.176  -0.444
  143   2HB   MET  26          2HB       MET  26   2.035  -1.954   0.851
  144   1HG   MET  26          1HG       MET  26   0.300  -1.877  -0.879
  145   2HG   MET  26          2HG       MET  26   1.305  -0.410  -0.922
  146   1HE   MET  26          1HE       MET  26  -0.342  -1.279  -3.306
  147   2HE   MET  26          2HE       MET  26   0.772  -1.125  -4.698
  148   3HE   MET  26          3HE       MET  26   0.753   0.101  -3.433
  149    H    SER  27           H        SER  27   4.259  -1.132   1.817
  150    HA   SER  27           HA       SER  27   3.647   1.607   1.951
  151   1HB   SER  27          1HB       SER  27   5.221   1.720   3.923
  152   2HB   SER  27          2HB       SER  27   3.839   0.602   4.094
  153    HG   SER  27           HG       SER  27   5.216  -1.039   3.687
  154    H    GLN  28           H        GLN  28   6.571  -0.114   1.293
  155    HA   GLN  28           HA       GLN  28   8.213   2.163   0.928
  156   1HB   GLN  28          1HB       GLN  28   8.414  -0.612  -0.230
  157   2HB   GLN  28          2HB       GLN  28   9.644   0.618  -0.478
  158   1HG   GLN  28          1HG       GLN  28  10.008   0.734   1.944
  159   2HG   GLN  28          2HG       GLN  28   8.769  -0.492   2.176
  160   1HE2  GLN  28          1HE2      GLN  28  10.250  -1.853   3.158
  161   2HE2  GLN  28          2HE2      GLN  28  11.433  -2.733   2.264
  162    H    PHE  29           H        PHE  29   6.286   0.287  -1.377
  163    HA   PHE  29           HA       PHE  29   6.837   1.729  -3.688
  164   1HB   PHE  29          1HB       PHE  29   5.660  -0.399  -3.779
  165   2HB   PHE  29          2HB       PHE  29   4.324   0.261  -2.856
  166    HD1  PHE  29           1HD      PHE  29   2.543   1.389  -3.917
  167    HD2  PHE  29           2HD      PHE  29   6.060   0.415  -6.108
  168    HE1  PHE  29           1HE      PHE  29   1.400   1.970  -6.030
  169    HE2  PHE  29           2HE      PHE  29   4.893   1.008  -8.198
  170    HZ   PHE  29           HZ       PHE  29   2.537   1.770  -8.103
  171    H    ILE  30           H        ILE  30   4.286   2.159  -1.327
  172    HA   ILE  30           HA       ILE  30   3.146   4.439  -2.494
  173    HB   ILE  30           HB       ILE  30   3.037   3.376   0.327
  174   1HG1  ILE  30          1HG1      ILE  30   0.959   3.505  -1.865
  175   2HG1  ILE  30          2HG1      ILE  30   2.027   2.134  -1.620
  176   1HG2  ILE  30          1HG2      ILE  30   1.435   5.668  -0.837
  177   2HG2  ILE  30          2HG2      ILE  30   2.783   5.858   0.245
  178   3HG2  ILE  30          3HG2      ILE  30   1.317   5.031   0.819
  179   1HD1  ILE  30          1HD1      ILE  30   1.049   1.764   0.567
  180   2HD1  ILE  30          2HD1      ILE  30  -0.176   1.734  -0.684
  181   3HD1  ILE  30          3HD1      ILE  30  -0.012   3.145   0.354
  182    H    VAL  31           H        VAL  31   5.592   4.109   0.061
  183    HA   VAL  31           HA       VAL  31   6.102   6.785   0.461
  184    HB   VAL  31           HB       VAL  31   7.954   4.382   0.466
  185   1HG1  VAL  31          1HG1      VAL  31   8.705   7.163   1.380
  186   2HG1  VAL  31          2HG1      VAL  31   9.281   6.428  -0.107
  187   3HG1  VAL  31          3HG1      VAL  31   9.722   5.725   1.452
  188   1HG2  VAL  31          1HG2      VAL  31   6.314   4.527   2.252
  189   2HG2  VAL  31          2HG2      VAL  31   6.862   6.147   2.651
  190   3HG2  VAL  31          3HG2      VAL  31   7.940   4.769   2.896
  191    H    GLN  32           H        GLN  32   7.438   4.689  -2.095
  192    HA   GLN  32           HA       GLN  32   9.028   6.415  -3.394
  193   1HB   GLN  32          1HB       GLN  32   8.938   4.074  -3.834
  194   2HB   GLN  32          2HB       GLN  32   7.294   4.183  -4.407
  195   1HG   GLN  32          1HG       GLN  32   8.094   5.520  -6.299
  196   2HG   GLN  32          2HG       GLN  32   9.749   5.241  -5.743
  197   1HE2  GLN  32          1HE2      GLN  32  10.612   3.186  -5.896
  198   2HE2  GLN  32          2HE2      GLN  32   9.918   1.922  -6.829
  199    H    CYS  33           H        CYS  33   5.609   5.752  -3.745
  200    HA   CYS  33           HA       CYS  33   4.988   7.416  -5.893
  201   1HB   CYS  33          1HB       CYS  33   3.351   6.315  -3.664
  202   2HB   CYS  33          2HB       CYS  33   2.628   7.159  -5.046
  203    HG   CYS  33           HG       CYS  33   4.379   4.239  -5.035
  204    H    LEU  34           H        LEU  34   4.971   7.967  -2.455
  205    HA   LEU  34           HA       LEU  34   3.861  10.612  -2.655
  206   1HB   LEU  34          1HB       LEU  34   5.186   9.255  -0.337
  207   2HB   LEU  34          2HB       LEU  34   4.357  10.793  -0.259
  208    HG   LEU  34           HG       LEU  34   3.101   8.159  -0.950
  209   1HD1  LEU  34          1HD1      LEU  34   2.028   8.394   1.245
  210   2HD1  LEU  34          2HD1      LEU  34   2.926   9.884   1.522
  211   3HD1  LEU  34          3HD1      LEU  34   3.782   8.345   1.390
  212   1HD2  LEU  34          1HD2      LEU  34   1.878  10.878  -0.536
  213   2HD2  LEU  34          2HD2      LEU  34   0.988   9.371  -0.742
  214   3HD2  LEU  34          3HD2      LEU  34   1.975   9.993  -2.057
  215    H    ASN  35           H        ASN  35   7.033   9.302  -2.664
  216    HA   ASN  35           HA       ASN  35   8.719  11.227  -1.992
  217   1HB   ASN  35          1HB       ASN  35   8.836   9.285  -4.122
  218   2HB   ASN  35          2HB       ASN  35   9.997  10.632  -4.337
  219   1HD2  ASN  35          1HD2      ASN  35   8.663   9.365  -1.431
  220   2HD2  ASN  35          2HD2      ASN  35  10.113   8.698  -0.863
  221    HA   PRO  36           HA       PRO  36   8.263  14.042  -5.936
  222   1HB   PRO  36          1HB       PRO  36   5.959  13.821  -7.385
  223   2HB   PRO  36          2HB       PRO  36   7.431  12.943  -7.794
  224   1HG   PRO  36          1HG       PRO  36   5.023  11.990  -6.297
  225   2HG   PRO  36          2HG       PRO  36   5.960  11.163  -7.549
  226   1HD   PRO  36          1HD       PRO  36   6.235  10.635  -4.939
  227   2HD   PRO  36          2HD       PRO  36   7.607  10.518  -6.040
  228    H    TYR  37           H        TYR  37   5.691  13.256  -3.789
  229    HA   TYR  37           HA       TYR  37   4.331  15.788  -4.176
  230   1HB   TYR  37          1HB       TYR  37   3.834  13.546  -2.212
  231   2HB   TYR  37          2HB       TYR  37   2.858  15.003  -2.316
  232    HD1  TYR  37           1HD      TYR  37   3.887  11.977  -4.156
  233    HD2  TYR  37           2HD      TYR  37   1.127  15.192  -3.930
  234    HE1  TYR  37           1HE      TYR  37   2.534  10.899  -5.845
  235    HE2  TYR  37           2HE      TYR  37  -0.249  14.166  -5.632
  236    HH   TYR  37           HH       TYR  37  -0.011  12.576  -7.447
  237    H    ARG  38           H        ARG  38   6.725  14.512  -2.130
  238    HA   ARG  38           HA       ARG  38   6.348  16.638  -0.171
  239   1HB   ARG  38          1HB       ARG  38   8.245  15.687   1.016
  240   2HB   ARG  38          2HB       ARG  38   7.069  14.441   0.611
  241   1HG   ARG  38          1HG       ARG  38   8.405  13.735  -1.237
  242   2HG   ARG  38          2HG       ARG  38   9.568  15.017  -0.929
  243   1HD   ARG  38          1HD       ARG  38   9.991  14.037   1.304
  244   2HD   ARG  38          2HD       ARG  38   8.813  12.772   0.923
  245    HE   ARG  38           HE       ARG  38  10.833  12.880  -1.033
  246   1HH1  ARG  38          1HH1      ARG  38  10.411  11.905   2.340
  247   2HH1  ARG  38          2HH1      ARG  38  11.492  10.601   2.244
  248   1HH2  ARG  38          1HH2      ARG  38  12.375  11.101  -1.149
  249   2HH2  ARG  38          2HH2      ARG  38  12.611  10.115   0.218
  250    H    LYS  39           H        LYS  39   7.608  16.574  -3.113
  251    HA   LYS  39           HA       LYS  39  10.045  18.066  -2.802
  252   1HB   LYS  39          1HB       LYS  39   8.192  17.853  -5.185
  253   2HB   LYS  39          2HB       LYS  39   9.845  18.437  -5.207
  254   1HG   LYS  39          1HG       LYS  39   9.020  15.643  -4.487
  255   2HG   LYS  39          2HG       LYS  39   9.574  16.165  -6.075
  256   1HD   LYS  39          1HD       LYS  39  11.738  16.758  -5.156
  257   2HD   LYS  39          2HD       LYS  39  11.177  16.364  -3.526
  258   1HE   LYS  39          1HE       LYS  39  10.860  14.078  -4.132
  259   2HE   LYS  39          2HE       LYS  39  11.282  14.401  -5.805
  260   1HZ   LYS  39          1HZ       LYS  39  13.128  13.413  -4.576
  261   2HZ   LYS  39          2HZ       LYS  39  13.126  14.714  -3.499
  262   3HZ   LYS  39          3HZ       LYS  39  13.522  14.963  -5.115
  263    HA   PRO  40           HA       PRO  40   8.057  21.898  -1.901
  264   1HB   PRO  40          1HB       PRO  40   9.914  23.669  -2.757
  265   2HB   PRO  40          2HB       PRO  40  10.086  22.724  -1.275
  266   1HG   PRO  40          1HG       PRO  40  11.283  22.235  -3.978
  267   2HG   PRO  40          2HG       PRO  40  12.031  22.068  -2.378
  268   1HD   PRO  40          1HD       PRO  40  11.107  19.951  -3.795
  269   2HD   PRO  40          2HD       PRO  40  11.091  19.990  -2.021
  270    H    ASP  41           H        ASP  41   8.768  20.987  -5.086
  271    HA   ASP  41           HA       ASP  41   7.447  23.360  -6.185
  272   1HB   ASP  41          1HB       ASP  41   9.704  22.650  -7.105
  273   2HB   ASP  41          2HB       ASP  41   8.931  21.195  -7.710
  274    H    CYS  42           H        CYS  42   6.563  20.558  -4.977
  275    HA   CYS  42           HA       CYS  42   4.985  19.307  -6.960
  276   1HB   CYS  42          1HB       CYS  42   5.578  18.282  -4.706
  277   2HB   CYS  42          2HB       CYS  42   4.381  19.353  -4.021
  278    HG   CYS  42           HG       CYS  42   2.369  17.676  -4.394
  279    H    LYS  43           H        LYS  43   3.064  19.760  -7.758
  280    HA   LYS  43           HA       LYS  43   1.926  22.351  -7.178
  281   1HB   LYS  43          1HB       LYS  43   1.159  20.264  -9.202
  282   2HB   LYS  43          2HB       LYS  43   0.518  21.898  -9.127
  283   1HG   LYS  43          1HG       LYS  43   2.750  22.784  -9.543
  284   2HG   LYS  43          2HG       LYS  43   3.380  21.138  -9.631
  285   1HD   LYS  43          1HD       LYS  43   1.981  20.679 -11.549
  286   2HD   LYS  43          2HD       LYS  43   1.247  22.280 -11.433
  287   1HE   LYS  43          1HE       LYS  43   4.139  21.660 -12.024
  288   2HE   LYS  43          2HE       LYS  43   2.934  22.254 -13.164
  289   1HZ   LYS  43          1HZ       LYS  43   4.326  24.041 -12.406
  290   2HZ   LYS  43          2HZ       LYS  43   3.990  23.711 -10.804
  291   3HZ   LYS  43          3HZ       LYS  43   2.762  24.292 -11.813
  292    H    VAL  44           H        VAL  44   1.176  19.013  -6.564
  293    HA   VAL  44           HA       VAL  44  -1.327  19.848  -5.355
  294    HB   VAL  44           HB       VAL  44  -1.937  19.083  -7.576
  295   1HG1  VAL  44          1HG1      VAL  44  -0.059  17.686  -8.136
  296   2HG1  VAL  44          2HG1      VAL  44  -1.556  16.770  -8.322
  297   3HG1  VAL  44          3HG1      VAL  44  -0.532  16.505  -6.915
  298   1HG2  VAL  44          1HG2      VAL  44  -3.507  17.297  -6.999
  299   2HG2  VAL  44          2HG2      VAL  44  -3.487  18.576  -5.782
  300   3HG2  VAL  44          3HG2      VAL  44  -2.656  17.047  -5.474
  301    H    GLY  45           H        GLY  45  -1.532  19.080  -3.408
  302   1HA   GLY  45          1HA       GLY  45  -1.384  17.719  -1.576
  303   2HA   GLY  45          2HA       GLY  45  -0.985  16.385  -2.656
  304    H    ARG  46           H        ARG  46   0.846  19.540  -2.050
  305    HA   ARG  46           HA       ARG  46   3.250  18.170  -2.019
  306   1HB   ARG  46          1HB       ARG  46   2.887  20.477  -2.831
  307   2HB   ARG  46          2HB       ARG  46   2.477  20.964  -1.198
  308   1HG   ARG  46          1HG       ARG  46   4.679  20.698  -0.445
  309   2HG   ARG  46          2HG       ARG  46   5.149  19.789  -1.886
  310   1HD   ARG  46          1HD       ARG  46   6.004  22.052  -2.021
  311   2HD   ARG  46          2HD       ARG  46   4.782  21.792  -3.254
  312    HE   ARG  46           HE       ARG  46   4.179  23.141  -0.726
  313   1HH1  ARG  46          1HH1      ARG  46   3.928  23.066  -4.300
  314   2HH1  ARG  46          2HH1      ARG  46   3.346  24.641  -4.444
  315   1HH2  ARG  46          1HH2      ARG  46   3.224  25.309  -0.953
  316   2HH2  ARG  46          2HH2      ARG  46   2.887  25.939  -2.488
  317    H    ILE  47           H        ILE  47   4.023  17.083  -0.439
  318    HA   ILE  47           HA       ILE  47   2.833  17.123   2.156
  319    HB   ILE  47           HB       ILE  47   5.293  15.496   1.346
  320   1HG1  ILE  47          1HG1      ILE  47   2.347  14.753   1.410
  321   2HG1  ILE  47          2HG1      ILE  47   3.282  15.047  -0.050
  322   1HG2  ILE  47          1HG2      ILE  47   4.655  14.119   3.212
  323   2HG2  ILE  47          2HG2      ILE  47   3.560  15.390   3.767
  324   3HG2  ILE  47          3HG2      ILE  47   5.281  15.700   3.626
  325   1HD1  ILE  47          1HD1      ILE  47   3.808  12.858   1.938
  326   2HD1  ILE  47          2HD1      ILE  47   4.664  13.127   0.415
  327   3HD1  ILE  47          3HD1      ILE  47   2.962  12.675   0.404
  328    H    THR  48           H        THR  48   3.177  18.392   3.627
  329    HA   THR  48           HA       THR  48   4.973  20.411   3.840
  330    HB   THR  48           HB       THR  48   4.189  20.201   6.307
  331    HG1  THR  48           1HG      THR  48   3.072  18.380   6.631
  332   1HG2  THR  48          1HG2      THR  48   3.327  21.751   4.635
  333   2HG2  THR  48          2HG2      THR  48   2.029  21.052   5.648
  334   3HG2  THR  48          3HG2      THR  48   2.337  20.416   4.015
  335    H    THR  49           H        THR  49   4.910  17.451   5.735
  336    HA   THR  49           HA       THR  49   7.742  17.952   6.440
  337    HB   THR  49           HB       THR  49   5.814  16.910   8.494
  338    HG1  THR  49           1HG      THR  49   4.831  18.713   8.099
  339   1HG2  THR  49          1HG2      THR  49   7.404  17.935  10.045
  340   2HG2  THR  49          2HG2      THR  49   8.327  18.586   8.692
  341   3HG2  THR  49          3HG2      THR  49   8.239  16.842   8.945
  342    H    THR  50           H        THR  50   8.846  16.059   7.154
  343    HA   THR  50           HA       THR  50   8.394  13.710   5.772
  344    HB   THR  50           HB       THR  50  10.436  14.542   6.636
  345    HG1  THR  50           1HG      THR  50  10.804  12.211   7.834
  346   1HG2  THR  50          1HG2      THR  50   9.515  13.578   9.322
  347   2HG2  THR  50          2HG2      THR  50   9.736  15.243   8.819
  348   3HG2  THR  50          3HG2      THR  50  11.153  14.176   8.971
  349    H    GLU  51           H        GLU  51   7.539  14.604   9.104
  350    HA   GLU  51           HA       GLU  51   6.500  12.092   9.841
  351   1HB   GLU  51          1HB       GLU  51   5.270  13.233  11.631
  352   2HB   GLU  51          2HB       GLU  51   6.938  13.758  11.571
  353   1HG   GLU  51          1HG       GLU  51   6.290  15.843  10.554
  354   2HG   GLU  51          2HG       GLU  51   4.617  15.294  10.417
  355    H    ASP  52           H        ASP  52   5.004  14.752   7.996
  356    HA   ASP  52           HA       ASP  52   2.377  13.708   8.053
  357   1HB   ASP  52          1HB       ASP  52   3.914  15.621   6.329
  358   2HB   ASP  52          2HB       ASP  52   2.225  15.261   6.072
  359    H    PHE  53           H        PHE  53   5.169  13.560   5.974
  360    HA   PHE  53           HA       PHE  53   4.080  12.170   3.858
  361   1HB   PHE  53          1HB       PHE  53   6.320  13.247   3.785
  362   2HB   PHE  53          2HB       PHE  53   6.862  12.193   5.066
  363    HD1  PHE  53           1HD      PHE  53   6.326  12.562   1.534
  364    HD2  PHE  53           2HD      PHE  53   7.293   9.831   4.622
  365    HE1  PHE  53           1HE      PHE  53   7.194  10.993  -0.133
  366    HE2  PHE  53           2HE      PHE  53   8.141   8.255   3.003
  367    HZ   PHE  53           HZ       PHE  53   8.107   8.845   0.567
  368    H    LYS  54           H        LYS  54   5.748  11.060   6.701
  369    HA   LYS  54           HA       LYS  54   5.603   8.232   6.365
  370   1HB   LYS  54          1HB       LYS  54   5.893   9.970   8.798
  371   2HB   LYS  54          2HB       LYS  54   6.002   8.212   8.832
  372   1HG   LYS  54          1HG       LYS  54   7.924   8.218   7.436
  373   2HG   LYS  54          2HG       LYS  54   7.718   9.923   7.066
  374   1HD   LYS  54          1HD       LYS  54   9.566   9.560   8.618
  375   2HD   LYS  54          2HD       LYS  54   8.286  10.513   9.354
  376   1HE   LYS  54          1HE       LYS  54   8.433   7.543   9.773
  377   2HE   LYS  54          2HE       LYS  54   9.442   8.630  10.717
  378   1HZ   LYS  54          1HZ       LYS  54   6.449   8.722  10.636
  379   2HZ   LYS  54          2HZ       LYS  54   7.485   9.707  11.559
  380   3HZ   LYS  54          3HZ       LYS  54   7.419   8.061  11.850
  381    H    HIS  55           H        HIS  55   3.414  10.495   8.004
  382    HA   HIS  55           HA       HIS  55   1.656   8.527   9.120
  383   1HB   HIS  55          1HB       HIS  55   1.828  10.951   9.856
  384   2HB   HIS  55          2HB       HIS  55   1.163  11.398   8.313
  385    HD1  HIS  55           1HD      HIS  55   0.114   9.734  11.518
  386    HD2  HIS  55           2HD      HIS  55  -1.581  11.229   8.040
  387    HE1  HIS  55           1HE      HIS  55  -2.360   9.725  11.936
  388    H    LEU  56           H        LEU  56   1.586  10.391   6.176
  389    HA   LEU  56           HA       LEU  56  -0.899   9.169   5.298
  390   1HB   LEU  56          1HB       LEU  56   0.262  11.400   4.577
  391   2HB   LEU  56          2HB       LEU  56   0.999  10.352   3.410
  392    HG   LEU  56           HG       LEU  56  -1.185   9.467   2.768
  393   1HD1  LEU  56          1HD1      LEU  56  -3.193  10.726   3.278
  394   2HD1  LEU  56          2HD1      LEU  56  -2.258  11.843   4.252
  395   3HD1  LEU  56          3HD1      LEU  56  -2.448  10.179   4.776
  396   1HD2  LEU  56          1HD2      LEU  56  -0.703  12.392   2.367
  397   2HD2  LEU  56          2HD2      LEU  56  -1.595  11.283   1.276
  398   3HD2  LEU  56          3HD2      LEU  56   0.130  11.058   1.569
  399    H    ALA  57           H        ALA  57   2.535   8.521   4.601
  400    HA   ALA  57           HA       ALA  57   1.978   6.574   2.666
  401   1HB   ALA  57          1HB       ALA  57   4.297   7.413   3.167
  402   2HB   ALA  57          2HB       ALA  57   4.207   5.654   3.138
  403   3HB   ALA  57          3HB       ALA  57   4.247   6.510   4.680
  404    H    ARG  58           H        ARG  58   2.036   6.401   6.101
  405    HA   ARG  58           HA       ARG  58   1.566   3.598   6.405
  406   1HB   ARG  58          1HB       ARG  58   0.699   5.898   8.140
  407   2HB   ARG  58          2HB       ARG  58   0.468   4.220   8.570
  408   1HG   ARG  58          1HG       ARG  58   2.883   3.915   8.622
  409   2HG   ARG  58          2HG       ARG  58   3.095   5.621   8.190
  410   1HD   ARG  58          1HD       ARG  58   1.857   6.288  10.161
  411   2HD   ARG  58          2HD       ARG  58   1.613   4.601  10.597
  412    HE   ARG  58           HE       ARG  58   4.358   5.246  10.298
  413   1HH1  ARG  58          1HH1      ARG  58   1.639   5.425  12.556
  414   2HH1  ARG  58          2HH1      ARG  58   2.602   5.489  13.952
  415   1HH2  ARG  58          1HH2      ARG  58   5.699   5.317  12.191
  416   2HH2  ARG  58          2HH2      ARG  58   5.003   5.433  13.742
  417    H    LYS  59           H        LYS  59  -0.603   6.406   6.168
  418    HA   LYS  59           HA       LYS  59  -2.965   4.974   6.672
  419   1HB   LYS  59          1HB       LYS  59  -2.755   7.360   7.058
  420   2HB   LYS  59          2HB       LYS  59  -2.483   7.633   5.350
  421   1HG   LYS  59          1HG       LYS  59  -4.717   7.206   4.810
  422   2HG   LYS  59          2HG       LYS  59  -5.040   6.451   6.375
  423   1HD   LYS  59          1HD       LYS  59  -4.714   8.592   7.495
  424   2HD   LYS  59          2HD       LYS  59  -4.319   9.348   5.955
  425   1HE   LYS  59          1HE       LYS  59  -6.521   9.104   5.160
  426   2HE   LYS  59          2HE       LYS  59  -6.938   7.979   6.453
  427   1HZ   LYS  59          1HZ       LYS  59  -7.775  10.343   6.723
  428   2HZ   LYS  59          2HZ       LYS  59  -6.162  10.780   7.042
  429   3HZ   LYS  59          3HZ       LYS  59  -6.943   9.678   8.015
  430    H    LEU  60           H        LEU  60  -1.427   5.971   3.661
  431    HA   LEU  60           HA       LEU  60  -3.464   5.141   2.120
  432   1HB   LEU  60          1HB       LEU  60  -0.582   5.483   1.452
  433   2HB   LEU  60          2HB       LEU  60  -1.856   5.397   0.224
  434    HG   LEU  60           HG       LEU  60  -1.936   7.327   2.468
  435   1HD1  LEU  60          1HD1      LEU  60  -1.140   9.043   0.789
  436   2HD1  LEU  60          2HD1      LEU  60  -0.651   7.702  -0.250
  437   3HD1  LEU  60          3HD1      LEU  60   0.063   7.897   1.343
  438   1HD2  LEU  60          1HD2      LEU  60  -3.305   7.205  -0.193
  439   2HD2  LEU  60          2HD2      LEU  60  -3.457   8.537   0.959
  440   3HD2  LEU  60          3HD2      LEU  60  -4.009   6.918   1.399
  441    H    THR  61           H        THR  61  -0.454   3.588   3.093
  442    HA   THR  61           HA       THR  61  -0.572   1.158   1.654
  443    HB   THR  61           HB       THR  61   0.468   1.520   4.487
  444    HG1  THR  61           1HG      THR  61   1.545   2.953   3.178
  445   1HG2  THR  61          1HG2      THR  61   1.208  -0.518   2.355
  446   2HG2  THR  61          2HG2      THR  61   0.240  -0.856   3.787
  447   3HG2  THR  61          3HG2      THR  61   1.932  -0.396   3.954
  448    H    HIS  62           H        HIS  62  -1.954   2.189   4.633
  449    HA   HIS  62           HA       HIS  62  -3.050  -0.373   5.284
  450   1HB   HIS  62          1HB       HIS  62  -2.428   1.420   6.968
  451   2HB   HIS  62          2HB       HIS  62  -3.838   2.315   6.431
  452    HD1  HIS  62           1HD      HIS  62  -2.799  -0.610   8.461
  453    HD2  HIS  62           2HD      HIS  62  -6.299   1.331   7.383
  454    HE1  HIS  62           1HE      HIS  62  -4.569  -1.576   9.953
  455    H    GLY  63           H        GLY  63  -4.362   2.412   3.592
  456   1HA   GLY  63          1HA       GLY  63  -7.031   1.416   3.724
  457   2HA   GLY  63          2HA       GLY  63  -6.528   2.740   2.713
  458    H    VAL  64           H        VAL  64  -4.452   1.169   1.313
  459    HA   VAL  64           HA       VAL  64  -6.111  -0.037  -0.730
  460    HB   VAL  64           HB       VAL  64  -3.093  -0.210  -0.314
  461   1HG1  VAL  64          1HG1      VAL  64  -3.004  -0.922  -2.724
  462   2HG1  VAL  64          2HG1      VAL  64  -4.758  -0.997  -2.720
  463   3HG1  VAL  64          3HG1      VAL  64  -3.838  -2.081  -1.701
  464   1HG2  VAL  64          1HG2      VAL  64  -4.723   1.558  -2.139
  465   2HG2  VAL  64          2HG2      VAL  64  -2.967   1.451  -2.128
  466   3HG2  VAL  64          3HG2      VAL  64  -3.817   2.077  -0.714
  467    H    MET  65           H        MET  65  -4.208  -1.048   1.796
  468    HA   MET  65           HA       MET  65  -4.095  -3.855   1.482
  469   1HB   MET  65          1HB       MET  65  -2.667  -2.785   3.100
  470   2HB   MET  65          2HB       MET  65  -4.036  -2.135   3.960
  471   1HG   MET  65          1HG       MET  65  -4.664  -4.304   4.697
  472   2HG   MET  65          2HG       MET  65  -3.274  -5.018   3.880
  473   1HE   MET  65          1HE       MET  65  -2.429  -4.937   7.742
  474   2HE   MET  65          2HE       MET  65  -2.717  -5.976   6.323
  475   3HE   MET  65          3HE       MET  65  -4.039  -4.999   7.005
  476    H    ASN  66           H        ASN  66  -6.280  -1.867   3.362
  477    HA   ASN  66           HA       ASN  66  -8.050  -3.943   4.151
  478   1HB   ASN  66          1HB       ASN  66  -7.906  -1.034   4.287
  479   2HB   ASN  66          2HB       ASN  66  -9.528  -1.654   4.434
  480   1HD2  ASN  66          1HD2      ASN  66  -6.417  -1.327   5.765
  481   2HD2  ASN  66          2HD2      ASN  66  -6.756  -1.932   7.350
  482    H    LYS  67           H        LYS  67  -8.101  -1.715   1.448
  483    HA   LYS  67           HA       LYS  67 -10.671  -2.440   0.615
  484   1HB   LYS  67          1HB       LYS  67  -9.625  -0.391  -0.186
  485   2HB   LYS  67          2HB       LYS  67  -8.380  -1.314  -1.007
  486   1HG   LYS  67          1HG       LYS  67  -9.997  -2.216  -2.561
  487   2HG   LYS  67          2HG       LYS  67 -11.314  -1.450  -1.682
  488   1HD   LYS  67          1HD       LYS  67  -9.069   0.066  -3.019
  489   2HD   LYS  67          2HD       LYS  67 -10.619  -0.271  -3.783
  490   1HE   LYS  67          1HE       LYS  67 -11.763   0.948  -1.990
  491   2HE   LYS  67          2HE       LYS  67 -10.210   1.305  -1.241
  492   1HZ   LYS  67          1HZ       LYS  67 -11.047   2.209  -3.953
  493   2HZ   LYS  67          2HZ       LYS  67  -9.590   2.583  -3.201
  494   3HZ   LYS  67          3HZ       LYS  67 -11.026   3.155  -2.562
  495    H    GLU  68           H        GLU  68  -7.472  -3.808  -0.238
  496    HA   GLU  68           HA       GLU  68  -8.835  -5.571  -1.923
  497   1HB   GLU  68          1HB       GLU  68  -6.668  -6.640  -2.230
  498   2HB   GLU  68          2HB       GLU  68  -6.789  -4.902  -2.568
  499   1HG   GLU  68          1HG       GLU  68  -5.688  -4.430  -0.443
  500   2HG   GLU  68          2HG       GLU  68  -5.376  -6.162  -0.239
  501    H    LEU  69           H        LEU  69  -7.570  -5.862   1.357
  502    HA   LEU  69           HA       LEU  69  -8.280  -8.508   1.595
  503   1HB   LEU  69          1HB       LEU  69  -8.301  -6.284   3.613
  504   2HB   LEU  69          2HB       LEU  69  -8.676  -7.940   4.046
  505    HG   LEU  69           HG       LEU  69  -6.066  -7.073   2.809
  506   1HD1  LEU  69          1HD1      LEU  69  -6.725  -7.662   5.692
  507   2HD1  LEU  69          2HD1      LEU  69  -6.351  -6.074   5.010
  508   3HD1  LEU  69          3HD1      LEU  69  -5.121  -7.331   5.027
  509   1HD2  LEU  69          1HD2      LEU  69  -7.027  -9.651   4.038
  510   2HD2  LEU  69          2HD2      LEU  69  -5.352  -9.297   3.679
  511   3HD2  LEU  69          3HD2      LEU  69  -6.524  -9.387   2.362
  512    H    LYS  70           H        LYS  70 -10.478  -5.719   1.444
  513    HA   LYS  70           HA       LYS  70 -12.694  -7.331   2.390
  514   1HB   LYS  70          1HB       LYS  70 -14.005  -5.379   2.202
  515   2HB   LYS  70          2HB       LYS  70 -12.464  -4.883   2.879
  516   1HG   LYS  70          1HG       LYS  70 -11.820  -4.198   0.572
  517   2HG   LYS  70          2HG       LYS  70 -13.489  -4.474   0.112
  518   1HD   LYS  70          1HD       LYS  70 -12.577  -2.562   2.255
  519   2HD   LYS  70          2HD       LYS  70 -12.966  -2.138   0.579
  520   1HE   LYS  70          1HE       LYS  70 -14.883  -1.542   1.902
  521   2HE   LYS  70          2HE       LYS  70 -15.290  -3.002   1.016
  522   1HZ   LYS  70          1HZ       LYS  70 -14.464  -2.938   3.885
  523   2HZ   LYS  70          2HZ       LYS  70 -15.036  -4.290   3.074
  524   3HZ   LYS  70          3HZ       LYS  70 -16.039  -2.994   3.354
  525    H    TYR  71           H        TYR  71 -11.254  -6.474  -0.656
  526    HA   TYR  71           HA       TYR  71 -13.519  -7.792  -2.046
  527   1HB   TYR  71          1HB       TYR  71 -11.396  -5.948  -3.096
  528   2HB   TYR  71          2HB       TYR  71 -12.680  -6.692  -4.061
  529    HD1  TYR  71           1HD      TYR  71 -14.984  -6.575  -2.311
  530    HD2  TYR  71           2HD      TYR  71 -11.964  -3.623  -2.925
  531    HE1  TYR  71           1HE      TYR  71 -16.505  -4.902  -1.570
  532    HE2  TYR  71           2HE      TYR  71 -13.533  -1.899  -2.219
  533    HH   TYR  71           HH       TYR  71 -16.568  -2.636  -0.747
  534    H    CYS  72           H        CYS  72 -10.464  -8.597  -1.063
  535    HA   CYS  72           HA       CYS  72 -10.371 -10.788  -3.004
  536   1HB   CYS  72          1HB       CYS  72  -8.397  -9.670  -1.051
  537   2HB   CYS  72          2HB       CYS  72  -8.065 -11.167  -1.884
  538    HG   CYS  72           HG       CYS  72  -7.300 -10.118  -4.113
  539    H    LYS  73           H        LYS  73 -10.945  -9.985   0.292
  540    HA   LYS  73           HA       LYS  73 -11.765 -11.023   2.060
  541   1HB   LYS  73          1HB       LYS  73 -12.221 -13.369   0.200
  542   2HB   LYS  73          2HB       LYS  73 -12.744 -13.342   1.869
  543   1HG   LYS  73          1HG       LYS  73 -13.665 -11.416  -0.268
  544   2HG   LYS  73          2HG       LYS  73 -14.578 -12.817   0.303
  545   1HD   LYS  73          1HD       LYS  73 -14.536 -11.797   2.596
  546   2HD   LYS  73          2HD       LYS  73 -13.788 -10.366   1.890
  547   1HE   LYS  73          1HE       LYS  73 -16.498 -11.482   1.159
  548   2HE   LYS  73          2HE       LYS  73 -16.218 -10.084   2.183
  549   1HZ   LYS  73          1HZ       LYS  73 -15.196  -8.959   0.257
  550   2HZ   LYS  73          2HZ       LYS  73 -16.781  -9.439  -0.088
  551   3HZ   LYS  73          3HZ       LYS  73 -15.509 -10.312  -0.693
  552    H    ASN  74           H        ASN  74  -9.679 -13.149   0.291
  553    HA   ASN  74           HA       ASN  74  -8.431 -14.047   2.799
  554   1HB   ASN  74          1HB       ASN  74  -8.393 -15.266   0.025
  555   2HB   ASN  74          2HB       ASN  74  -7.479 -15.878   1.392
  556   1HD2  ASN  74          1HD2      ASN  74  -9.534 -17.175  -0.224
  557   2HD2  ASN  74          2HD2      ASN  74 -10.771 -17.660   0.863
  558    HA   PRO  75           HA       PRO  75  -4.881 -11.610   1.573
  559   1HB   PRO  75          1HB       PRO  75  -3.083 -12.753   2.967
  560   2HB   PRO  75          2HB       PRO  75  -4.186 -11.512   3.579
  561   1HG   PRO  75          1HG       PRO  75  -4.242 -14.566   3.959
  562   2HG   PRO  75          2HG       PRO  75  -4.716 -13.354   5.158
  563   1HD   PRO  75          1HD       PRO  75  -6.488 -14.747   3.650
  564   2HD   PRO  75          2HD       PRO  75  -6.814 -13.098   4.228
  565    H    GLU  76           H        GLU  76  -5.340 -14.619   0.889
  566    HA   GLU  76           HA       GLU  76  -2.845 -15.565   0.088
  567   1HB   GLU  76          1HB       GLU  76  -4.793 -16.966   0.595
  568   2HB   GLU  76          2HB       GLU  76  -5.639 -16.301  -0.778
  569   1HG   GLU  76          1HG       GLU  76  -3.970 -17.370  -2.252
  570   2HG   GLU  76          2HG       GLU  76  -3.259 -18.126  -0.816
  571    H    ASP  77           H        ASP  77  -4.643 -13.124  -0.896
  572    HA   ASP  77           HA       ASP  77  -3.597 -13.018  -3.666
  573   1HB   ASP  77          1HB       ASP  77  -6.057 -13.716  -3.572
  574   2HB   ASP  77          2HB       ASP  77  -6.343 -12.138  -2.838
  575    H    LEU  78           H        LEU  78  -3.269 -11.872  -0.770
  576    HA   LEU  78           HA       LEU  78  -3.397  -9.050  -1.290
  577   1HB   LEU  78          1HB       LEU  78  -4.207 -10.018   0.802
  578   2HB   LEU  78          2HB       LEU  78  -2.616 -10.755   1.018
  579    HG   LEU  78           HG       LEU  78  -1.706  -8.533   1.011
  580   1HD1  LEU  78          1HD1      LEU  78  -3.241  -6.660   1.721
  581   2HD1  LEU  78          2HD1      LEU  78  -4.600  -7.744   1.403
  582   3HD1  LEU  78          3HD1      LEU  78  -3.532  -7.253   0.087
  583   1HD2  LEU  78          1HD2      LEU  78  -1.807  -9.737   3.018
  584   2HD2  LEU  78          2HD2      LEU  78  -3.499  -9.333   3.258
  585   3HD2  LEU  78          3HD2      LEU  78  -2.265  -8.076   3.389
  586    H    GLU  79           H        GLU  79  -1.709  -8.646  -2.594
  587    HA   GLU  79           HA       GLU  79   1.031  -9.273  -1.782
  588   1HB   GLU  79          1HB       GLU  79   0.058 -11.029  -3.305
  589   2HB   GLU  79          2HB       GLU  79  -0.265  -9.693  -4.411
  590   1HG   GLU  79          1HG       GLU  79   1.580 -10.829  -5.066
  591   2HG   GLU  79          2HG       GLU  79   2.046  -9.209  -4.545
  592    H    CYS  80           H        CYS  80   2.388  -7.691  -2.459
  593    HA   CYS  80           HA       CYS  80   1.205  -5.294  -3.532
  594   1HB   CYS  80          1HB       CYS  80   2.864  -4.826  -1.885
  595   2HB   CYS  80          2HB       CYS  80   4.044  -5.923  -2.515
  596    HG   CYS  80           HG       CYS  80   3.209  -2.803  -3.438
  597    H    ASN  81           H        ASN  81   0.508  -6.479  -5.328
  598    HA   ASN  81           HA       ASN  81   2.683  -7.129  -7.035
  599   1HB   ASN  81          1HB       ASN  81   1.133  -8.413  -8.506
  600   2HB   ASN  81          2HB       ASN  81   0.950  -8.898  -6.820
  601   1HD2  ASN  81          1HD2      ASN  81  -0.906  -8.419  -5.869
  602   2HD2  ASN  81          2HD2      ASN  81  -2.314  -7.840  -6.664
  603    H    GLU  82           H        GLU  82   1.500  -6.899  -9.539
  604    HA   GLU  82           HA       GLU  82   1.933  -4.345 -10.250
  605   1HB   GLU  82          1HB       GLU  82   0.511  -6.618 -11.278
  606   2HB   GLU  82          2HB       GLU  82   0.877  -5.257 -12.388
  607   1HG   GLU  82          1HG       GLU  82   2.750  -7.039 -10.843
  608   2HG   GLU  82          2HG       GLU  82   2.581  -7.028 -12.612
  609    H    ASN  83           H        ASN  83  -1.105  -6.177 -10.131
  610    HA   ASN  83           HA       ASN  83  -3.094  -4.333 -10.711
  611   1HB   ASN  83          1HB       ASN  83  -3.575  -6.719 -10.369
  612   2HB   ASN  83          2HB       ASN  83  -3.062  -6.599  -8.683
  613   1HD2  ASN  83          1HD2      ASN  83  -5.042  -7.337  -7.948
  614   2HD2  ASN  83          2HD2      ASN  83  -6.480  -6.389  -7.977
  615    H    VAL  84           H        VAL  84  -1.660  -5.263  -7.590
  616    HA   VAL  84           HA       VAL  84  -3.188  -3.456  -6.202
  617    HB   VAL  84           HB       VAL  84  -0.680  -4.951  -5.472
  618   1HG1  VAL  84          1HG1      VAL  84  -2.268  -3.143  -3.624
  619   2HG1  VAL  84          2HG1      VAL  84  -0.533  -3.033  -4.027
  620   3HG1  VAL  84          3HG1      VAL  84  -1.133  -4.385  -3.115
  621   1HG2  VAL  84          1HG2      VAL  84  -3.545  -5.136  -4.659
  622   2HG2  VAL  84          2HG2      VAL  84  -2.238  -6.179  -4.105
  623   3HG2  VAL  84          3HG2      VAL  84  -2.701  -6.169  -5.817
  624    H    LYS  85           H        LYS  85   0.071  -3.203  -7.446
  625    HA   LYS  85           HA       LYS  85   0.764  -0.621  -6.559
  626   1HB   LYS  85          1HB       LYS  85   1.475  -1.979  -9.141
  627   2HB   LYS  85          2HB       LYS  85   2.235  -0.513  -8.541
  628   1HG   LYS  85          1HG       LYS  85   3.100  -1.658  -6.656
  629   2HG   LYS  85          2HG       LYS  85   2.199  -3.120  -7.078
  630   1HD   LYS  85          1HD       LYS  85   3.466  -3.048  -9.273
  631   2HD   LYS  85          2HD       LYS  85   4.526  -1.872  -8.482
  632   1HE   LYS  85          1HE       LYS  85   4.953  -3.444  -6.703
  633   2HE   LYS  85          2HE       LYS  85   3.821  -4.560  -7.480
  634   1HZ   LYS  85          1HZ       LYS  85   5.270  -4.679  -9.393
  635   2HZ   LYS  85          2HZ       LYS  85   6.110  -5.165  -8.016
  636   3HZ   LYS  85          3HZ       LYS  85   6.398  -3.646  -8.682
  637    H    HIS  86           H        HIS  86  -0.820  -1.616  -9.458
  638    HA   HIS  86           HA       HIS  86  -1.143   0.790 -10.766
  639   1HB   HIS  86          1HB       HIS  86  -1.784  -1.177 -11.958
  640   2HB   HIS  86          2HB       HIS  86  -2.968  -1.620 -10.743
  641    HD1  HIS  86           1HD      HIS  86  -2.484   1.024 -13.466
  642    HD2  HIS  86           2HD      HIS  86  -5.515  -0.828 -11.306
  643    HE1  HIS  86           1HE      HIS  86  -4.622   1.848 -14.473
  644    H    LYS  87           H        LYS  87  -3.325  -0.821  -8.637
  645    HA   LYS  87           HA       LYS  87  -5.439   1.112  -8.216
  646   1HB   LYS  87          1HB       LYS  87  -5.297  -1.410  -7.705
  647   2HB   LYS  87          2HB       LYS  87  -4.270  -0.929  -6.372
  648   1HG   LYS  87          1HG       LYS  87  -6.263   0.581  -5.729
  649   2HG   LYS  87          2HG       LYS  87  -7.183  -0.520  -6.769
  650   1HD   LYS  87          1HD       LYS  87  -5.426  -1.223  -4.495
  651   2HD   LYS  87          2HD       LYS  87  -7.205  -1.292  -4.463
  652   1HE   LYS  87          1HE       LYS  87  -7.097  -3.079  -6.191
  653   2HE   LYS  87          2HE       LYS  87  -5.339  -2.981  -6.180
  654   1HZ   LYS  87          1HZ       LYS  87  -7.046  -3.784  -3.901
  655   2HZ   LYS  87          2HZ       LYS  87  -5.358  -3.792  -3.837
  656   3HZ   LYS  87          3HZ       LYS  87  -6.179  -4.838  -4.854
  657    H    THR  88           H        THR  88  -2.442   0.709  -6.814
  658    HA   THR  88           HA       THR  88  -3.124   2.480  -4.712
  659    HB   THR  88           HB       THR  88  -0.711   1.066  -5.573
  660    HG1  THR  88           1HG      THR  88  -2.137  -0.197  -4.590
  661   1HG2  THR  88          1HG2      THR  88   0.381   1.938  -3.506
  662   2HG2  THR  88          2HG2      THR  88  -1.041   2.988  -3.272
  663   3HG2  THR  88          3HG2      THR  88  -0.034   3.148  -4.725
  664    H    LYS  89           H        LYS  89  -0.699   2.744  -7.285
  665    HA   LYS  89           HA       LYS  89  -0.178   5.313  -6.502
  666   1HB   LYS  89          1HB       LYS  89   0.862   5.485  -8.954
  667   2HB   LYS  89          2HB       LYS  89   1.588   4.581  -7.632
  668   1HG   LYS  89          1HG       LYS  89   1.692   3.203  -9.524
  669   2HG   LYS  89          2HG       LYS  89   0.411   2.552  -8.500
  670   1HD   LYS  89          1HD       LYS  89  -0.430   2.424 -10.486
  671   2HD   LYS  89          2HD       LYS  89  -1.074   3.938  -9.880
  672   1HE   LYS  89          1HE       LYS  89   0.659   5.230 -11.102
  673   2HE   LYS  89          2HE       LYS  89   1.354   3.739 -11.718
  674   1HZ   LYS  89          1HZ       LYS  89  -0.821   3.401 -12.927
  675   2HZ   LYS  89          2HZ       LYS  89   0.087   4.699 -13.425
  676   3HZ   LYS  89          3HZ       LYS  89  -1.242   4.973 -12.441
  677    H    GLU  90           H        GLU  90  -2.462   4.050  -8.797
  678    HA   GLU  90           HA       GLU  90  -3.369   6.580  -9.769
  679   1HB   GLU  90          1HB       GLU  90  -4.843   3.956  -9.603
  680   2HB   GLU  90          2HB       GLU  90  -5.504   5.391 -10.372
  681   1HG   GLU  90          1HG       GLU  90  -3.028   3.893 -11.191
  682   2HG   GLU  90          2HG       GLU  90  -4.574   3.922 -12.037
  683    H    TYR  91           H        TYR  91  -4.194   4.694  -6.872
  684    HA   TYR  91           HA       TYR  91  -6.488   6.229  -6.228
  685   1HB   TYR  91          1HB       TYR  91  -6.545   4.163  -5.147
  686   2HB   TYR  91          2HB       TYR  91  -4.821   4.179  -4.807
  687    HD1  TYR  91           1HD      TYR  91  -7.905   6.122  -3.877
  688    HD2  TYR  91           2HD      TYR  91  -4.207   4.422  -2.612
  689    HE1  TYR  91           1HE      TYR  91  -8.353   6.845  -1.567
  690    HE2  TYR  91           2HE      TYR  91  -4.629   5.135  -0.344
  691    HH   TYR  91           HH       TYR  91  -5.942   6.841   0.814
  692    H    ILE  92           H        ILE  92  -3.146   6.049  -5.172
  693    HA   ILE  92           HA       ILE  92  -2.977   8.092  -3.325
  694    HB   ILE  92           HB       ILE  92  -0.960   7.335  -5.437
  695   1HG1  ILE  92          1HG1      ILE  92  -1.915   5.738  -3.619
  696   2HG1  ILE  92          2HG1      ILE  92  -0.177   5.634  -4.023
  697   1HG2  ILE  92          1HG2      ILE  92   0.752   8.382  -4.000
  698   2HG2  ILE  92          2HG2      ILE  92  -0.545   8.907  -2.908
  699   3HG2  ILE  92          3HG2      ILE  92  -0.488   9.529  -4.549
  700   1HD1  ILE  92          1HD1      ILE  92  -1.619   6.896  -1.755
  701   2HD1  ILE  92          2HD1      ILE  92   0.136   7.053  -2.049
  702   3HD1  ILE  92          3HD1      ILE  92  -0.570   5.470  -1.694
  703    H    LYS  93           H        LYS  93  -2.369   8.434  -6.801
  704    HA   LYS  93           HA       LYS  93  -1.996  11.180  -6.675
  705   1HB   LYS  93          1HB       LYS  93  -3.133   9.532  -8.933
  706   2HB   LYS  93          2HB       LYS  93  -2.636  11.214  -9.077
  707   1HG   LYS  93          1HG       LYS  93  -0.365  10.587  -8.421
  708   2HG   LYS  93          2HG       LYS  93  -0.873   8.904  -8.329
  709   1HD   LYS  93          1HD       LYS  93  -1.425   8.942 -10.698
  710   2HD   LYS  93          2HD       LYS  93  -0.912  10.634 -10.794
  711   1HE   LYS  93          1HE       LYS  93   1.329   9.983 -10.051
  712   2HE   LYS  93          2HE       LYS  93   0.809   8.304  -9.979
  713   1HZ   LYS  93          1HZ       LYS  93   0.982   9.977 -12.426
  714   2HZ   LYS  93          2HZ       LYS  93   0.380   8.404 -12.370
  715   3HZ   LYS  93          3HZ       LYS  93   1.982   8.691 -11.988
  716    H    LYS  94           H        LYS  94  -4.953   9.345  -7.157
  717    HA   LYS  94           HA       LYS  94  -6.461  11.691  -7.643
  718   1HB   LYS  94          1HB       LYS  94  -7.266   9.535  -8.474
  719   2HB   LYS  94          2HB       LYS  94  -7.375   8.913  -6.837
  720   1HG   LYS  94          1HG       LYS  94  -9.140  10.555  -6.367
  721   2HG   LYS  94          2HG       LYS  94  -9.064  11.092  -8.047
  722   1HD   LYS  94          1HD       LYS  94  -9.710   8.881  -8.811
  723   2HD   LYS  94          2HD       LYS  94  -9.679   8.280  -7.152
  724   1HE   LYS  94          1HE       LYS  94 -11.480   9.872  -6.574
  725   2HE   LYS  94          2HE       LYS  94 -11.526  10.394  -8.253
  726   1HZ   LYS  94          1HZ       LYS  94 -13.248   8.787  -7.729
  727   2HZ   LYS  94          2HZ       LYS  94 -12.112   7.636  -7.308
  728   3HZ   LYS  94          3HZ       LYS  94 -12.207   8.194  -8.907
  729    H    TYR  95           H        TYR  95  -5.671   9.791  -4.846
  730    HA   TYR  95           HA       TYR  95  -7.352  10.977  -2.993
  731   1HB   TYR  95          1HB       TYR  95  -6.244   8.922  -2.602
  732   2HB   TYR  95          2HB       TYR  95  -4.679   9.711  -2.846
  733    HD1  TYR  95           1HD      TYR  95  -3.570  10.579  -0.932
  734    HD2  TYR  95           2HD      TYR  95  -7.723   9.761  -0.708
  735    HE1  TYR  95           1HE      TYR  95  -3.567  11.192   1.441
  736    HE2  TYR  95           2HE      TYR  95  -7.726  10.322   1.664
  737    HH   TYR  95           HH       TYR  95  -5.063  11.817   3.194
  738    H    MET  96           H        MET  96  -3.977  11.684  -3.743
  739    HA   MET  96           HA       MET  96  -3.858  13.768  -1.917
  740   1HB   MET  96          1HB       MET  96  -2.133  13.400  -4.311
  741   2HB   MET  96          2HB       MET  96  -1.777  14.368  -2.875
  742   1HG   MET  96          1HG       MET  96  -2.227  12.077  -1.632
  743   2HG   MET  96          2HG       MET  96  -1.789  11.432  -3.226
  744   1HE   MET  96          1HE       MET  96  -0.823  13.678  -0.348
  745   2HE   MET  96          2HE       MET  96  -0.330  14.656  -1.753
  746   3HE   MET  96          3HE       MET  96   0.896  14.019  -0.649
  747    H    GLN  97           H        GLN  97  -5.077  13.646  -5.000
  748    HA   GLN  97           HA       GLN  97  -4.929  16.385  -5.734
  749   1HB   GLN  97          1HB       GLN  97  -7.251  14.614  -6.484
  750   2HB   GLN  97          2HB       GLN  97  -6.737  16.085  -7.291
  751   1HG   GLN  97          1HG       GLN  97  -5.397  13.413  -7.244
  752   2HG   GLN  97          2HG       GLN  97  -6.030  14.273  -8.637
  753   1HE2  GLN  97          1HE2      GLN  97  -3.451  13.797  -6.488
  754   2HE2  GLN  97          2HE2      GLN  97  -2.259  14.783  -7.211
  755    H    LYS  98           H        LYS  98  -6.859  14.852  -3.391
  756    HA   LYS  98           HA       LYS  98  -8.917  16.831  -3.375
  757   1HB   LYS  98          1HB       LYS  98  -9.881  15.649  -1.551
  758   2HB   LYS  98          2HB       LYS  98  -9.309  14.513  -2.753
  759   1HG   LYS  98          1HG       LYS  98  -8.528  13.422  -0.868
  760   2HG   LYS  98          2HG       LYS  98  -7.234  14.416  -1.308
  761   1HD   LYS  98          1HD       LYS  98  -7.574  14.502   1.099
  762   2HD   LYS  98          2HD       LYS  98  -7.623  16.081   0.328
  763   1HE   LYS  98          1HE       LYS  98 -10.021  14.482   1.297
  764   2HE   LYS  98          2HE       LYS  98  -9.251  15.841   2.103
  765   1HZ   LYS  98          1HZ       LYS  98  -9.929  17.221   0.087
  766   2HZ   LYS  98          2HZ       LYS  98 -11.103  16.700   1.125
  767   3HZ   LYS  98          3HZ       LYS  98 -10.966  15.930  -0.318
  768    H    PHE  99           H        PHE  99  -5.824  16.548  -1.980
  769    HA   PHE  99           HA       PHE  99  -6.316  18.300   0.241
  770   1HB   PHE  99          1HB       PHE  99  -3.681  17.413  -0.967
  771   2HB   PHE  99          2HB       PHE  99  -3.822  18.477   0.431
  772    HD1  PHE  99           1HD      PHE  99  -5.328  17.539   2.386
  773    HD2  PHE  99           2HD      PHE  99  -3.370  15.175  -0.584
  774    HE1  PHE  99           1HE      PHE  99  -5.476  15.563   3.841
  775    HE2  PHE  99           2HE      PHE  99  -3.469  13.188   0.949
  776    HZ   PHE  99           HZ       PHE  99  -4.556  13.408   3.108
  777    H    GLY 100           H        GLY 100  -5.317  18.698  -3.052
  778   1HA   GLY 100          1HA       GLY 100  -5.731  20.693  -4.191
  779   2HA   GLY 100          2HA       GLY 100  -5.543  21.562  -2.665
  780    H    ALA 101           H        ALA 101  -3.813  22.634  -2.590
  781    HA   ALA 101           HA       ALA 101  -1.547  21.967  -4.288
  782   1HB   ALA 101          1HB       ALA 101  -2.302  24.295  -4.087
  783   2HB   ALA 101          2HB       ALA 101  -0.628  24.082  -3.547
  784   3HB   ALA 101          3HB       ALA 101  -1.930  24.238  -2.363
  785    H    VAL 102           H        VAL 102  -2.295  22.169  -0.833
  786    HA   VAL 102           HA       VAL 102   0.304  20.877  -0.393
  787    HB   VAL 102           HB       VAL 102  -1.085  22.292   1.827
  788   1HG1  VAL 102          1HG1      VAL 102   1.809  21.913   1.247
  789   2HG1  VAL 102          2HG1      VAL 102   0.817  21.041   2.418
  790   3HG1  VAL 102          3HG1      VAL 102   1.159  22.760   2.653
  791   1HG2  VAL 102          1HG2      VAL 102  -1.161  23.948   0.134
  792   2HG2  VAL 102          2HG2      VAL 102   0.570  23.773  -0.197
  793   3HG2  VAL 102          3HG2      VAL 102   0.016  24.427   1.359
  794    H    TYR 103           H        TYR 103   0.398  19.420   1.299
  795    HA   TYR 103           HA       TYR 103  -1.971  17.846   1.420
  796   1HB   TYR 103          1HB       TYR 103  -0.174  16.476   0.860
  797   2HB   TYR 103          2HB       TYR 103   0.922  17.317   1.945
  798    HD1  TYR 103           1HD      TYR 103   1.797  15.674   3.265
  799    HD2  TYR 103           2HD      TYR 103  -2.361  15.718   2.670
  800    HE1  TYR 103           1HE      TYR 103   1.535  13.920   4.987
  801    HE2  TYR 103           2HE      TYR 103  -2.653  14.019   4.359
  802    HH   TYR 103           HH       TYR 103  -0.060  13.115   6.462
  803    H    LYS 104           H        LYS 104  -3.272  18.561   2.763
  804    HA   LYS 104           HA       LYS 104  -2.484  18.952   5.536
  805   1HB   LYS 104          1HB       LYS 104  -4.726  20.274   5.579
  806   2HB   LYS 104          2HB       LYS 104  -3.235  20.944   4.886
  807   1HG   LYS 104          1HG       LYS 104  -4.042  20.331   2.672
  808   2HG   LYS 104          2HG       LYS 104  -5.566  19.837   3.429
  809   1HD   LYS 104          1HD       LYS 104  -6.055  22.045   4.113
  810   2HD   LYS 104          2HD       LYS 104  -4.387  22.570   3.895
  811   1HE   LYS 104          1HE       LYS 104  -5.632  23.513   2.104
  812   2HE   LYS 104          2HE       LYS 104  -4.680  22.172   1.471
  813   1HZ   LYS 104          1HZ       LYS 104  -7.580  21.995   2.132
  814   2HZ   LYS 104          2HZ       LYS 104  -6.628  20.790   1.427
  815   3HZ   LYS 104          3HZ       LYS 104  -6.928  22.195   0.606
  816    HA   PRO 105           HA       PRO 105  -4.693  14.978   5.626
  817   1HB   PRO 105          1HB       PRO 105  -3.723  14.329   8.136
  818   2HB   PRO 105          2HB       PRO 105  -2.944  13.914   6.609
  819   1HG   PRO 105          1HG       PRO 105  -2.367  16.105   8.508
  820   2HG   PRO 105          2HG       PRO 105  -1.233  15.181   7.501
  821   1HD   PRO 105          1HD       PRO 105  -2.018  17.719   6.965
  822   2HD   PRO 105          2HD       PRO 105  -1.588  16.616   5.656
  823    H    LYS 106           H        LYS 106  -4.623  17.371   8.173
  824    HA   LYS 106           HA       LYS 106  -6.833  16.625   9.631
  825   1HB   LYS 106          1HB       LYS 106  -7.012  18.894  10.372
  826   2HB   LYS 106          2HB       LYS 106  -5.312  18.533  10.145
  827   1HG   LYS 106          1HG       LYS 106  -5.454  19.634   7.912
  828   2HG   LYS 106          2HG       LYS 106  -7.096  20.120   8.331
  829   1HD   LYS 106          1HD       LYS 106  -6.141  21.242  10.355
  830   2HD   LYS 106          2HD       LYS 106  -4.540  20.900   9.692
  831   1HE   LYS 106          1HE       LYS 106  -5.023  23.084   8.956
  832   2HE   LYS 106          2HE       LYS 106  -5.323  22.000   7.592
  833   1HZ   LYS 106          1HZ       LYS 106  -7.730  22.085   8.115
  834   2HZ   LYS 106          2HZ       LYS 106  -7.087  23.600   7.767
  835   3HZ   LYS 106          3HZ       LYS 106  -7.383  23.180   9.363
  836    H    GLU 107           H        GLU 107  -6.767  17.674   6.410
  837    HA   GLU 107           HA       GLU 107  -9.652  18.233   6.353
  838   1HB   GLU 107          1HB       GLU 107  -7.507  18.979   4.365
  839   2HB   GLU 107          2HB       GLU 107  -9.212  19.350   4.208
  840   1HG   GLU 107          1HG       GLU 107  -7.301  20.429   6.255
  841   2HG   GLU 107          2HG       GLU 107  -8.045  21.298   4.917
  842    H    ASP 108           H        ASP 108  -8.091  15.606   6.309
  843    HA   ASP 108           HA       ASP 108  -8.124  14.637   3.689
  844   1HB   ASP 108          1HB       ASP 108  -7.515  12.554   4.523
  845   2HB   ASP 108          2HB       ASP 108  -6.879  13.668   5.724
  846    H    THR 109           H        THR 109  -9.301  12.559   3.302
  847    HA   THR 109           HA       THR 109 -11.947  13.329   2.721
  848    HB   THR 109           HB       THR 109 -10.600  12.123   1.124
  849    HG1  THR 109           1HG      THR 109 -12.066  10.210   0.861
  850   1HG2  THR 109          1HG2      THR 109  -9.293  10.848   2.785
  851   2HG2  THR 109          2HG2      THR 109  -9.864   9.845   1.455
  852   3HG2  THR 109          3HG2      THR 109 -10.675   9.782   3.029
  Start of MODEL   19
    1    H    THR  10           H        THR  10  -1.606 -23.014   2.325
    2    HA   THR  10           HA       THR  10  -3.123 -23.078   4.832
    3    HB   THR  10           HB       THR  10  -0.762 -22.833   5.909
    4    HG1  THR  10           1HG      THR  10  -0.034 -24.350   3.612
    5   1HG2  THR  10          1HG2      THR  10  -2.257 -24.762   6.270
    6   2HG2  THR  10          2HG2      THR  10  -0.574 -25.271   6.148
    7   3HG2  THR  10          3HG2      THR  10  -1.663 -25.494   4.778
    8    H    SER  11           H        SER  11  -3.655 -21.171   3.159
    9    HA   SER  11           HA       SER  11  -1.957 -18.820   3.165
   10   1HB   SER  11          1HB       SER  11  -4.774 -19.200   2.499
   11   2HB   SER  11          2HB       SER  11  -3.670 -17.927   1.913
   12    HG   SER  11           HG       SER  11  -4.068 -19.764   0.428
   13    H    SER  12           H        SER  12  -3.967 -20.002   5.498
   14    HA   SER  12           HA       SER  12  -4.731 -17.419   6.389
   15   1HB   SER  12          1HB       SER  12  -5.923 -19.469   7.043
   16   2HB   SER  12          2HB       SER  12  -4.502 -20.019   7.927
   17    HG   SER  12           HG       SER  12  -5.348 -18.999   9.519
   18    H    GLU  13           H        GLU  13  -2.032 -19.767   7.290
   19    HA   GLU  13           HA       GLU  13  -0.896 -17.873   9.025
   20   1HB   GLU  13          1HB       GLU  13   0.816 -19.669   9.215
   21   2HB   GLU  13          2HB       GLU  13  -0.815 -20.148   9.651
   22   1HG   GLU  13          1HG       GLU  13  -1.100 -21.288   7.555
   23   2HG   GLU  13          2HG       GLU  13   0.431 -20.691   6.972
   24    H    LEU  14           H        LEU  14  -0.365 -19.097   5.777
   25    HA   LEU  14           HA       LEU  14   2.196 -18.270   5.135
   26   1HB   LEU  14          1HB       LEU  14   0.302 -19.517   3.830
   27   2HB   LEU  14          2HB       LEU  14  -0.121 -17.915   3.281
   28    HG   LEU  14           HG       LEU  14   2.457 -19.393   2.719
   29   1HD1  LEU  14          1HD1      LEU  14   0.179 -18.593   0.944
   30   2HD1  LEU  14          2HD1      LEU  14   0.570 -20.221   1.493
   31   3HD1  LEU  14          3HD1      LEU  14   1.677 -19.360   0.420
   32   1HD2  LEU  14          1HD2      LEU  14   3.040 -17.548   1.218
   33   2HD2  LEU  14          2HD2      LEU  14   2.915 -16.983   2.888
   34   3HD2  LEU  14          3HD2      LEU  14   1.612 -16.657   1.747
   35    H    ALA  15           H        ALA  15  -0.700 -16.667   5.427
   36    HA   ALA  15           HA       ALA  15   0.141 -14.373   3.923
   37   1HB   ALA  15          1HB       ALA  15  -2.082 -15.095   3.432
   38   2HB   ALA  15          2HB       ALA  15  -2.053 -13.471   4.121
   39   3HB   ALA  15          3HB       ALA  15  -2.536 -14.840   5.119
   40    H    LYS  16           H        LYS  16  -0.064 -15.329   7.164
   41    HA   LYS  16           HA       LYS  16  -0.276 -12.739   8.334
   42   1HB   LYS  16          1HB       LYS  16   1.156 -15.170   9.444
   43   2HB   LYS  16          2HB       LYS  16   0.638 -13.760  10.354
   44   1HG   LYS  16          1HG       LYS  16  -1.168 -15.751   9.004
   45   2HG   LYS  16          2HG       LYS  16  -0.830 -15.656  10.730
   46   1HD   LYS  16          1HD       LYS  16  -1.852 -13.441  10.809
   47   2HD   LYS  16          2HD       LYS  16  -2.162 -13.516   9.071
   48   1HE   LYS  16          1HE       LYS  16  -3.568 -15.492   9.408
   49   2HE   LYS  16          2HE       LYS  16  -3.270 -15.404  11.142
   50   1HZ   LYS  16          1HZ       LYS  16  -5.386 -14.442  10.510
   51   2HZ   LYS  16          2HZ       LYS  16  -4.620 -13.301   9.540
   52   3HZ   LYS  16          3HZ       LYS  16  -4.390 -13.290  11.210
   53    H    LYS  17           H        LYS  17   2.224 -14.635   6.929
   54    HA   LYS  17           HA       LYS  17   4.285 -12.728   7.546
   55   1HB   LYS  17          1HB       LYS  17   4.273 -15.146   5.715
   56   2HB   LYS  17          2HB       LYS  17   5.663 -14.096   5.912
   57   1HG   LYS  17          1HG       LYS  17   6.043 -16.022   7.243
   58   2HG   LYS  17          2HG       LYS  17   5.670 -14.702   8.339
   59   1HD   LYS  17          1HD       LYS  17   3.373 -15.547   8.570
   60   2HD   LYS  17          2HD       LYS  17   3.756 -16.874   7.470
   61   1HE   LYS  17          1HE       LYS  17   5.457 -17.683   9.021
   62   2HE   LYS  17          2HE       LYS  17   5.120 -16.335  10.101
   63   1HZ   LYS  17          1HZ       LYS  17   4.047 -18.312  10.868
   64   2HZ   LYS  17          2HZ       LYS  17   3.243 -18.531   9.400
   65   3HZ   LYS  17          3HZ       LYS  17   2.861 -17.220  10.387
   66    H    SER  18           H        SER  18   2.259 -13.652   4.760
   67    HA   SER  18           HA       SER  18   3.499 -12.016   2.918
   68   1HB   SER  18          1HB       SER  18   0.591 -12.817   2.877
   69   2HB   SER  18          2HB       SER  18   1.580 -12.327   1.516
   70    HG   SER  18           HG       SER  18   1.483 -14.537   1.572
   71    H    LYS  19           H        LYS  19   1.014 -11.189   5.297
   72    HA   LYS  19           HA       LYS  19   0.334  -8.694   4.077
   73   1HB   LYS  19          1HB       LYS  19   0.231  -9.278   7.029
   74   2HB   LYS  19          2HB       LYS  19  -0.648  -8.036   6.158
   75   1HG   LYS  19          1HG       LYS  19  -1.781 -10.059   4.954
   76   2HG   LYS  19          2HG       LYS  19  -1.192 -10.994   6.310
   77   1HD   LYS  19          1HD       LYS  19  -3.128  -8.678   6.340
   78   2HD   LYS  19          2HD       LYS  19  -3.380 -10.321   6.924
   79   1HE   LYS  19          1HE       LYS  19  -1.714  -9.908   8.696
   80   2HE   LYS  19          2HE       LYS  19  -1.533  -8.271   8.052
   81   1HZ   LYS  19          1HZ       LYS  19  -3.937  -9.411   9.371
   82   2HZ   LYS  19          2HZ       LYS  19  -3.948  -7.948   8.538
   83   3HZ   LYS  19          3HZ       LYS  19  -2.975  -8.123   9.896
   84    H    GLU  20           H        GLU  20   2.913  -9.702   6.145
   85    HA   GLU  20           HA       GLU  20   3.746  -7.033   6.782
   86   1HB   GLU  20          1HB       GLU  20   5.374  -9.565   6.873
   87   2HB   GLU  20          2HB       GLU  20   5.685  -8.065   7.745
   88   1HG   GLU  20          1HG       GLU  20   3.317  -9.746   7.968
   89   2HG   GLU  20          2HG       GLU  20   4.666  -9.839   9.137
   90    H    VAL  21           H        VAL  21   4.772  -9.581   4.609
   91    HA   VAL  21           HA       VAL  21   6.841  -8.154   3.279
   92    HB   VAL  21           HB       VAL  21   5.027 -10.355   2.231
   93   1HG1  VAL  21          1HG1      VAL  21   7.731  -9.439   1.238
   94   2HG1  VAL  21          2HG1      VAL  21   6.189  -9.134   0.438
   95   3HG1  VAL  21          3HG1      VAL  21   6.796 -10.785   0.586
   96   1HG2  VAL  21          1HG2      VAL  21   6.223 -11.086   4.216
   97   2HG2  VAL  21          2HG2      VAL  21   7.750 -10.551   3.516
   98   3HG2  VAL  21          3HG2      VAL  21   6.869 -11.890   2.785
   99    H    PHE  22           H        PHE  22   3.419  -8.386   2.815
  100    HA   PHE  22           HA       PHE  22   3.328  -6.918   0.352
  101   1HB   PHE  22          1HB       PHE  22   1.406  -8.186   0.658
  102   2HB   PHE  22          2HB       PHE  22   1.304  -7.777   2.368
  103    HD1  PHE  22           1HD      PHE  22   1.109  -6.129  -0.968
  104    HD2  PHE  22           2HD      PHE  22  -0.320  -6.272   3.017
  105    HE1  PHE  22           1HE      PHE  22  -0.473  -4.289  -1.455
  106    HE2  PHE  22           2HE      PHE  22  -1.890  -4.483   2.537
  107    HZ   PHE  22           HZ       PHE  22  -2.004  -3.484   0.328
  108    H    ARG  23           H        ARG  23   2.515  -6.086   3.647
  109    HA   ARG  23           HA       ARG  23   2.045  -3.385   3.071
  110   1HB   ARG  23          1HB       ARG  23   2.021  -2.909   5.434
  111   2HB   ARG  23          2HB       ARG  23   1.292  -4.481   5.158
  112   1HG   ARG  23          1HG       ARG  23   2.571  -4.994   6.993
  113   2HG   ARG  23          2HG       ARG  23   3.724  -5.296   5.691
  114   1HD   ARG  23          1HD       ARG  23   4.762  -4.026   7.491
  115   2HD   ARG  23          2HD       ARG  23   4.730  -3.148   5.969
  116    HE   ARG  23           HE       ARG  23   2.458  -2.446   7.377
  117   1HH1  ARG  23          1HH1      ARG  23   5.937  -2.179   7.851
  118   2HH1  ARG  23          2HH1      ARG  23   5.886  -0.649   8.579
  119   1HH2  ARG  23          1HH2      ARG  23   2.370  -0.318   8.407
  120   2HH2  ARG  23          2HH2      ARG  23   3.820   0.427   8.913
  121    H    LYS  24           H        LYS  24   5.034  -5.051   3.567
  122    HA   LYS  24           HA       LYS  24   6.550  -2.717   4.037
  123   1HB   LYS  24          1HB       LYS  24   7.441  -4.891   4.704
  124   2HB   LYS  24          2HB       LYS  24   7.418  -5.429   3.039
  125   1HG   LYS  24          1HG       LYS  24   9.694  -4.878   3.685
  126   2HG   LYS  24          2HG       LYS  24   9.123  -3.751   2.458
  127   1HD   LYS  24          1HD       LYS  24  10.345  -2.547   4.177
  128   2HD   LYS  24          2HD       LYS  24   8.641  -2.108   4.248
  129   1HE   LYS  24          1HE       LYS  24   8.305  -3.649   6.087
  130   2HE   LYS  24          2HE       LYS  24   9.990  -4.151   6.003
  131   1HZ   LYS  24          1HZ       LYS  24   9.080  -1.388   6.618
  132   2HZ   LYS  24          2HZ       LYS  24  10.673  -1.960   6.669
  133   3HZ   LYS  24          3HZ       LYS  24   9.537  -2.546   7.751
  134    H    GLU  25           H        GLU  25   5.843  -4.717   1.154
  135    HA   GLU  25           HA       GLU  25   7.486  -3.437  -0.668
  136   1HB   GLU  25          1HB       GLU  25   4.705  -4.411  -1.199
  137   2HB   GLU  25          2HB       GLU  25   6.004  -4.262  -2.358
  138   1HG   GLU  25          1HG       GLU  25   6.325  -5.983  -0.038
  139   2HG   GLU  25          2HG       GLU  25   5.211  -6.415  -1.341
  140    H    MET  26           H        MET  26   4.118  -3.189   0.143
  141    HA   MET  26           HA       MET  26   3.469  -1.038  -1.526
  142   1HB   MET  26          1HB       MET  26   1.941  -2.632  -0.568
  143   2HB   MET  26          2HB       MET  26   2.196  -1.907   1.015
  144   1HG   MET  26          1HG       MET  26   0.383  -0.640   0.582
  145   2HG   MET  26          2HG       MET  26   1.459   0.262  -0.471
  146   1HE   MET  26          1HE       MET  26   1.634  -2.002  -3.071
  147   2HE   MET  26          2HE       MET  26   1.558  -0.220  -3.259
  148   3HE   MET  26          3HE       MET  26   0.370  -1.221  -4.018
  149    H    SER  27           H        SER  27   4.484  -1.014   1.807
  150    HA   SER  27           HA       SER  27   4.059   1.732   2.214
  151   1HB   SER  27          1HB       SER  27   6.145  -0.020   3.548
  152   2HB   SER  27          2HB       SER  27   5.780   1.634   4.031
  153    HG   SER  27           HG       SER  27   4.031  -0.575   4.011
  154    H    GLN  28           H        GLN  28   6.783  -0.108   0.898
  155    HA   GLN  28           HA       GLN  28   8.429   2.226   0.782
  156   1HB   GLN  28          1HB       GLN  28  10.116   0.804  -0.014
  157   2HB   GLN  28          2HB       GLN  28   9.004  -0.205   0.945
  158   1HG   GLN  28          1HG       GLN  28   8.053  -1.133  -0.966
  159   2HG   GLN  28          2HG       GLN  28   8.983  -0.069  -2.012
  160   1HE2  GLN  28          1HE2      GLN  28   8.925  -2.954  -2.029
  161   2HE2  GLN  28          2HE2      GLN  28  10.522  -3.504  -1.693
  162    H    PHE  29           H        PHE  29   6.573   0.429  -1.331
  163    HA   PHE  29           HA       PHE  29   6.954   1.803  -3.734
  164   1HB   PHE  29          1HB       PHE  29   5.755  -0.313  -3.664
  165   2HB   PHE  29          2HB       PHE  29   4.483   0.406  -2.696
  166    HD1  PHE  29           1HD      PHE  29   2.683   1.541  -3.699
  167    HD2  PHE  29           2HD      PHE  29   6.008   0.294  -6.036
  168    HE1  PHE  29           1HE      PHE  29   1.408   1.968  -5.765
  169    HE2  PHE  29           2HE      PHE  29   4.716   0.732  -8.081
  170    HZ   PHE  29           HZ       PHE  29   2.384   1.558  -7.882
  171    H    ILE  30           H        ILE  30   4.467   2.311  -1.282
  172    HA   ILE  30           HA       ILE  30   3.343   4.601  -2.427
  173    HB   ILE  30           HB       ILE  30   3.236   3.537   0.387
  174   1HG1  ILE  30          1HG1      ILE  30   1.139   3.752  -1.772
  175   2HG1  ILE  30          2HG1      ILE  30   2.135   2.331  -1.492
  176   1HG2  ILE  30          1HG2      ILE  30   1.720   5.914  -0.711
  177   2HG2  ILE  30          2HG2      ILE  30   3.031   5.998   0.441
  178   3HG2  ILE  30          3HG2      ILE  30   1.512   5.204   0.901
  179   1HD1  ILE  30          1HD1      ILE  30   0.181   3.518   0.471
  180   2HD1  ILE  30          2HD1      ILE  30   1.205   2.113   0.719
  181   3HD1  ILE  30          3HD1      ILE  30  -0.050   2.061  -0.497
  182    H    VAL  31           H        VAL  31   5.747   4.249   0.193
  183    HA   VAL  31           HA       VAL  31   6.239   6.899   0.635
  184    HB   VAL  31           HB       VAL  31   8.068   4.495   0.645
  185   1HG1  VAL  31          1HG1      VAL  31   8.847   7.270   1.578
  186   2HG1  VAL  31          2HG1      VAL  31   9.464   6.501   0.116
  187   3HG1  VAL  31          3HG1      VAL  31   9.832   5.813   1.698
  188   1HG2  VAL  31          1HG2      VAL  31   6.389   4.657   2.398
  189   2HG2  VAL  31          2HG2      VAL  31   6.957   6.262   2.825
  190   3HG2  VAL  31          3HG2      VAL  31   8.003   4.864   3.081
  191    H    GLN  32           H        GLN  32   7.667   4.874  -1.952
  192    HA   GLN  32           HA       GLN  32   9.214   6.777  -3.070
  193   1HB   GLN  32          1HB       GLN  32   9.335   4.423  -3.575
  194   2HB   GLN  32          2HB       GLN  32   7.775   4.478  -4.367
  195   1HG   GLN  32          1HG       GLN  32   9.530   4.433  -5.978
  196   2HG   GLN  32          2HG       GLN  32   8.644   5.968  -6.021
  197   1HE2  GLN  32          1HE2      GLN  32  10.296   7.095  -6.950
  198   2HE2  GLN  32          2HE2      GLN  32  11.773   7.492  -6.157
  199    H    CYS  33           H        CYS  33   5.868   5.849  -3.656
  200    HA   CYS  33           HA       CYS  33   5.246   7.478  -5.824
  201   1HB   CYS  33          1HB       CYS  33   3.573   6.338  -3.634
  202   2HB   CYS  33          2HB       CYS  33   2.872   7.158  -5.035
  203    HG   CYS  33           HG       CYS  33   4.697   4.288  -4.983
  204    H    LEU  34           H        LEU  34   5.114   8.049  -2.390
  205    HA   LEU  34           HA       LEU  34   3.953  10.663  -2.600
  206   1HB   LEU  34          1HB       LEU  34   5.283   9.316  -0.276
  207   2HB   LEU  34          2HB       LEU  34   4.432  10.841  -0.198
  208    HG   LEU  34           HG       LEU  34   3.208   8.205  -0.927
  209   1HD1  LEU  34          1HD1      LEU  34   2.146   8.396   1.308
  210   2HD1  LEU  34          2HD1      LEU  34   3.072   9.869   1.607
  211   3HD1  LEU  34          3HD1      LEU  34   3.903   8.326   1.426
  212   1HD2  LEU  34          1HD2      LEU  34   1.086   9.393  -0.644
  213   2HD2  LEU  34          2HD2      LEU  34   2.051  10.049  -1.963
  214   3HD2  LEU  34          3HD2      LEU  34   1.972  10.900  -0.419
  215    H    ASN  35           H        ASN  35   7.192   9.433  -2.600
  216    HA   ASN  35           HA       ASN  35   8.743  11.445  -1.865
  217   1HB   ASN  35          1HB       ASN  35   9.062   9.487  -3.969
  218   2HB   ASN  35          2HB       ASN  35  10.154  10.894  -4.149
  219   1HD2  ASN  35          1HD2      ASN  35   8.750   9.530  -1.317
  220   2HD2  ASN  35          2HD2      ASN  35  10.212   8.976  -0.661
  221    HA   PRO  36           HA       PRO  36   8.218  14.170  -5.853
  222   1HB   PRO  36          1HB       PRO  36   5.921  13.796  -7.301
  223   2HB   PRO  36          2HB       PRO  36   7.475  13.078  -7.723
  224   1HG   PRO  36          1HG       PRO  36   5.144  11.866  -6.341
  225   2HG   PRO  36          2HG       PRO  36   6.243  11.156  -7.535
  226   1HD   PRO  36          1HD       PRO  36   6.399  10.665  -4.878
  227   2HD   PRO  36          2HD       PRO  36   7.817  10.612  -5.922
  228    H    TYR  37           H        TYR  37   5.714  13.209  -3.746
  229    HA   TYR  37           HA       TYR  37   4.240  15.673  -4.066
  230   1HB   TYR  37          1HB       TYR  37   3.845  13.345  -2.187
  231   2HB   TYR  37          2HB       TYR  37   2.814  14.771  -2.213
  232    HD1  TYR  37           1HD      TYR  37   3.936  11.884  -4.185
  233    HD2  TYR  37           2HD      TYR  37   1.077  14.985  -3.824
  234    HE1  TYR  37           1HE      TYR  37   2.631  10.837  -5.917
  235    HE2  TYR  37           2HE      TYR  37  -0.262  13.992  -5.571
  236    HH   TYR  37           HH       TYR  37  -0.020  12.502  -7.442
  237    H    ARG  38           H        ARG  38   6.650  14.361  -2.021
  238    HA   ARG  38           HA       ARG  38   6.273  16.456  -0.023
  239   1HB   ARG  38          1HB       ARG  38   8.113  15.464   1.175
  240   2HB   ARG  38          2HB       ARG  38   7.008  14.200   0.658
  241   1HG   ARG  38          1HG       ARG  38   8.437  13.610  -1.143
  242   2HG   ARG  38          2HG       ARG  38   9.521  14.948  -0.784
  243   1HD   ARG  38          1HD       ARG  38   9.852  13.926   1.475
  244   2HD   ARG  38          2HD       ARG  38   8.883  12.557   0.922
  245    HE   ARG  38           HE       ARG  38  10.951  12.899  -0.905
  246   1HH1  ARG  38          1HH1      ARG  38  10.662  12.057   2.538
  247   2HH1  ARG  38          2HH1      ARG  38  12.064  11.109   2.551
  248   1HH2  ARG  38          1HH2      ARG  38  12.882  11.668  -0.855
  249   2HH2  ARG  38          2HH2      ARG  38  13.367  10.868   0.573
  250    H    LYS  39           H        LYS  39   7.454  16.433  -2.931
  251    HA   LYS  39           HA       LYS  39   9.859  17.988  -2.717
  252   1HB   LYS  39          1HB       LYS  39   7.903  17.612  -4.990
  253   2HB   LYS  39          2HB       LYS  39   9.454  18.409  -5.116
  254   1HG   LYS  39          1HG       LYS  39   9.123  15.506  -4.386
  255   2HG   LYS  39          2HG       LYS  39   9.326  16.083  -6.038
  256   1HD   LYS  39          1HD       LYS  39  11.486  15.525  -5.482
  257   2HD   LYS  39          2HD       LYS  39  11.421  17.236  -5.074
  258   1HE   LYS  39          1HE       LYS  39  11.067  16.622  -2.680
  259   2HE   LYS  39          2HE       LYS  39  11.171  14.931  -3.147
  260   1HZ   LYS  39          1HZ       LYS  39  13.415  15.300  -3.894
  261   2HZ   LYS  39          2HZ       LYS  39  13.277  15.784  -2.288
  262   3HZ   LYS  39          3HZ       LYS  39  13.315  16.932  -3.521
  263    HA   PRO  40           HA       PRO  40   7.765  21.755  -1.739
  264   1HB   PRO  40          1HB       PRO  40   9.733  23.494  -2.426
  265   2HB   PRO  40          2HB       PRO  40   9.805  22.508  -0.962
  266   1HG   PRO  40          1HG       PRO  40  11.065  22.016  -3.633
  267   2HG   PRO  40          2HG       PRO  40  11.798  21.878  -2.027
  268   1HD   PRO  40          1HD       PRO  40  10.932  19.729  -3.364
  269   2HD   PRO  40          2HD       PRO  40  10.761  19.841  -1.598
  270    H    ASP  41           H        ASP  41   8.770  20.812  -4.928
  271    HA   ASP  41           HA       ASP  41   7.542  23.083  -6.167
  272   1HB   ASP  41          1HB       ASP  41   8.539  22.164  -8.127
  273   2HB   ASP  41          2HB       ASP  41   9.772  22.421  -6.891
  274    H    CYS  42           H        CYS  42   6.638  20.307  -4.913
  275    HA   CYS  42           HA       CYS  42   5.228  18.844  -6.857
  276   1HB   CYS  42          1HB       CYS  42   5.465  17.957  -4.630
  277   2HB   CYS  42          2HB       CYS  42   4.430  19.228  -3.975
  278    HG   CYS  42           HG       CYS  42   2.550  17.377  -3.909
  279    H    LYS  43           H        LYS  43   3.269  18.928  -7.810
  280    HA   LYS  43           HA       LYS  43   2.143  21.563  -8.105
  281   1HB   LYS  43          1HB       LYS  43   1.338  18.921  -9.326
  282   2HB   LYS  43          2HB       LYS  43   0.659  20.472  -9.749
  283   1HG   LYS  43          1HG       LYS  43   3.526  19.627 -10.189
  284   2HG   LYS  43          2HG       LYS  43   2.260  19.638 -11.410
  285   1HD   LYS  43          1HD       LYS  43   3.207  21.661 -11.881
  286   2HD   LYS  43          2HD       LYS  43   2.089  22.186 -10.627
  287   1HE   LYS  43          1HE       LYS  43   4.248  23.152 -10.211
  288   2HE   LYS  43          2HE       LYS  43   3.933  21.939  -8.975
  289   1HZ   LYS  43          1HZ       LYS  43   5.636  21.572 -11.378
  290   2HZ   LYS  43          2HZ       LYS  43   5.316  20.382 -10.230
  291   3HZ   LYS  43          3HZ       LYS  43   6.161  21.751  -9.787
  292    H    VAL  44           H        VAL  44   1.081  18.426  -6.881
  293    HA   VAL  44           HA       VAL  44  -1.216  19.706  -5.609
  294    HB   VAL  44           HB       VAL  44  -1.440  17.246  -7.389
  295   1HG1  VAL  44          1HG1      VAL  44  -3.549  18.647  -5.758
  296   2HG1  VAL  44          2HG1      VAL  44  -2.901  17.023  -5.491
  297   3HG1  VAL  44          3HG1      VAL  44  -3.844  17.373  -6.940
  298   1HG2  VAL  44          1HG2      VAL  44  -1.333  19.286  -8.723
  299   2HG2  VAL  44          2HG2      VAL  44  -2.631  19.994  -7.760
  300   3HG2  VAL  44          3HG2      VAL  44  -2.954  18.590  -8.775
  301    H    GLY  45           H        GLY  45  -1.531  18.908  -3.643
  302   1HA   GLY  45          1HA       GLY  45  -1.391  17.558  -1.796
  303   2HA   GLY  45          2HA       GLY  45  -0.953  16.230  -2.861
  304    H    ARG  46           H        ARG  46   0.733  19.406  -2.145
  305    HA   ARG  46           HA       ARG  46   3.202  18.087  -2.113
  306   1HB   ARG  46          1HB       ARG  46   2.698  20.396  -2.947
  307   2HB   ARG  46          2HB       ARG  46   2.354  20.830  -1.280
  308   1HG   ARG  46          1HG       ARG  46   4.571  20.686  -0.639
  309   2HG   ARG  46          2HG       ARG  46   5.039  19.775  -2.077
  310   1HD   ARG  46          1HD       ARG  46   5.754  22.097  -2.274
  311   2HD   ARG  46          2HD       ARG  46   4.527  21.722  -3.476
  312    HE   ARG  46           HE       ARG  46   4.032  23.144  -0.975
  313   1HH1  ARG  46          1HH1      ARG  46   3.377  22.719  -4.477
  314   2HH1  ARG  46          2HH1      ARG  46   2.333  24.035  -4.596
  315   1HH2  ARG  46          1HH2      ARG  46   2.533  25.009  -1.182
  316   2HH2  ARG  46          2HH2      ARG  46   1.852  25.386  -2.687
  317    H    ILE  47           H        ILE  47   3.945  17.068  -0.468
  318    HA   ILE  47           HA       ILE  47   2.678  17.169   2.101
  319    HB   ILE  47           HB       ILE  47   5.184  15.563   1.387
  320   1HG1  ILE  47          1HG1      ILE  47   2.266  14.730   1.522
  321   2HG1  ILE  47          2HG1      ILE  47   3.142  15.027   0.030
  322   1HG2  ILE  47          1HG2      ILE  47   5.156  15.900   3.663
  323   2HG2  ILE  47          2HG2      ILE  47   4.570  14.262   3.335
  324   3HG2  ILE  47          3HG2      ILE  47   3.452  15.523   3.804
  325   1HD1  ILE  47          1HD1      ILE  47   2.937  12.655   0.571
  326   2HD1  ILE  47          2HD1      ILE  47   3.858  12.933   2.057
  327   3HD1  ILE  47          3HD1      ILE  47   4.610  13.195   0.481
  328    H    THR  48           H        THR  48   3.004  18.381   3.648
  329    HA   THR  48           HA       THR  48   4.830  20.434   3.791
  330    HB   THR  48           HB       THR  48   4.017  20.348   6.244
  331    HG1  THR  48           1HG      THR  48   2.138  19.068   6.450
  332   1HG2  THR  48          1HG2      THR  48   3.217  21.847   4.496
  333   2HG2  THR  48          2HG2      THR  48   1.913  21.268   5.568
  334   3HG2  THR  48          3HG2      THR  48   2.145  20.538   3.960
  335    H    THR  49           H        THR  49   4.588  17.582   5.860
  336    HA   THR  49           HA       THR  49   7.329  18.187   6.751
  337    HB   THR  49           HB       THR  49   5.373  16.727   8.482
  338    HG1  THR  49           1HG      THR  49   4.163  18.385   8.452
  339   1HG2  THR  49          1HG2      THR  49   7.721  16.920   9.179
  340   2HG2  THR  49          2HG2      THR  49   6.658  17.808  10.265
  341   3HG2  THR  49          3HG2      THR  49   7.611  18.676   9.060
  342    H    THR  50           H        THR  50   8.642  16.417   7.142
  343    HA   THR  50           HA       THR  50   8.368  14.027   5.758
  344    HB   THR  50           HB       THR  50  10.374  14.946   6.573
  345    HG1  THR  50           1HG      THR  50  11.323  13.027   6.870
  346   1HG2  THR  50          1HG2      THR  50  11.115  14.754   8.944
  347   2HG2  THR  50          2HG2      THR  50   9.484  14.172   9.330
  348   3HG2  THR  50          3HG2      THR  50   9.700  15.806   8.709
  349    H    GLU  51           H        GLU  51   7.551  14.834   9.088
  350    HA   GLU  51           HA       GLU  51   6.547  12.328   9.950
  351   1HB   GLU  51          1HB       GLU  51   5.630  15.087  10.707
  352   2HB   GLU  51          2HB       GLU  51   5.287  13.611  11.597
  353   1HG   GLU  51          1HG       GLU  51   7.641  13.355  12.096
  354   2HG   GLU  51          2HG       GLU  51   8.007  14.803  11.151
  355    H    ASP  52           H        ASP  52   4.958  14.941   8.092
  356    HA   ASP  52           HA       ASP  52   2.387  13.748   8.180
  357   1HB   ASP  52          1HB       ASP  52   3.772  15.928   6.674
  358   2HB   ASP  52          2HB       ASP  52   2.191  15.392   6.170
  359    H    PHE  53           H        PHE  53   5.144  13.717   6.038
  360    HA   PHE  53           HA       PHE  53   4.051  12.293   3.943
  361   1HB   PHE  53          1HB       PHE  53   6.256  13.406   3.821
  362   2HB   PHE  53          2HB       PHE  53   6.832  12.416   5.136
  363    HD1  PHE  53           1HD      PHE  53   6.198  12.561   1.597
  364    HD2  PHE  53           2HD      PHE  53   7.419  10.098   4.804
  365    HE1  PHE  53           1HE      PHE  53   7.098  10.939  -0.004
  366    HE2  PHE  53           2HE      PHE  53   8.308   8.461   3.240
  367    HZ   PHE  53           HZ       PHE  53   8.162   8.901   0.788
  368    H    LYS  54           H        LYS  54   5.754  11.238   6.794
  369    HA   LYS  54           HA       LYS  54   5.690   8.412   6.468
  370   1HB   LYS  54          1HB       LYS  54   5.877  10.133   8.925
  371   2HB   LYS  54          2HB       LYS  54   6.146   8.393   8.893
  372   1HG   LYS  54          1HG       LYS  54   8.056   8.603   7.538
  373   2HG   LYS  54          2HG       LYS  54   7.673  10.274   7.133
  374   1HD   LYS  54          1HD       LYS  54   9.505  10.186   8.679
  375   2HD   LYS  54          2HD       LYS  54   8.108  10.915   9.458
  376   1HE   LYS  54          1HE       LYS  54   7.640   8.834  10.605
  377   2HE   LYS  54          2HE       LYS  54   8.974   8.046   9.768
  378   1HZ   LYS  54          1HZ       LYS  54  10.471   9.685  10.820
  379   2HZ   LYS  54          2HZ       LYS  54   9.705   8.707  11.944
  380   3HZ   LYS  54          3HZ       LYS  54   9.177  10.292  11.701
  381    H    HIS  55           H        HIS  55   3.458  10.622   8.091
  382    HA   HIS  55           HA       HIS  55   1.722   8.646   9.246
  383   1HB   HIS  55          1HB       HIS  55   1.907  11.059   9.977
  384   2HB   HIS  55          2HB       HIS  55   1.244  11.519   8.437
  385    HD1  HIS  55           1HD      HIS  55   0.196   9.954  11.691
  386    HD2  HIS  55           2HD      HIS  55  -1.530  11.363   8.177
  387    HE1  HIS  55           1HE      HIS  55  -2.267   9.978  12.122
  388    H    LEU  56           H        LEU  56   1.632  10.485   6.299
  389    HA   LEU  56           HA       LEU  56  -0.837   9.258   5.459
  390   1HB   LEU  56          1HB       LEU  56   0.307  11.453   4.739
  391   2HB   LEU  56          2HB       LEU  56   1.091  10.430   3.584
  392    HG   LEU  56           HG       LEU  56  -1.081   9.505   2.914
  393   1HD1  LEU  56          1HD1      LEU  56  -3.103  10.806   3.399
  394   2HD1  LEU  56          2HD1      LEU  56  -2.164  11.867   4.430
  395   3HD1  LEU  56          3HD1      LEU  56  -2.392  10.188   4.879
  396   1HD2  LEU  56          1HD2      LEU  56  -1.474  11.354   1.427
  397   2HD2  LEU  56          2HD2      LEU  56   0.241  11.060   1.732
  398   3HD2  LEU  56          3HD2      LEU  56  -0.574  12.417   2.539
  399    H    ALA  57           H        ALA  57   2.596   8.576   4.732
  400    HA   ALA  57           HA       ALA  57   2.017   6.559   2.876
  401   1HB   ALA  57          1HB       ALA  57   4.333   7.399   3.306
  402   2HB   ALA  57          2HB       ALA  57   4.248   5.639   3.404
  403   3HB   ALA  57          3HB       ALA  57   4.300   6.603   4.879
  404    H    ARG  58           H        ARG  58   2.051   6.533   6.323
  405    HA   ARG  58           HA       ARG  58   1.565   3.798   6.841
  406   1HB   ARG  58          1HB       ARG  58   0.710   6.304   8.270
  407   2HB   ARG  58          2HB       ARG  58   0.263   4.714   8.851
  408   1HG   ARG  58          1HG       ARG  58   3.089   5.624   8.438
  409   2HG   ARG  58          2HG       ARG  58   2.225   5.710   9.980
  410   1HD   ARG  58          1HD       ARG  58   1.766   3.331   9.791
  411   2HD   ARG  58          2HD       ARG  58   2.758   3.293   8.340
  412    HE   ARG  58           HE       ARG  58   4.590   4.210   9.884
  413   1HH1  ARG  58          1HH1      ARG  58   2.140   1.907  11.013
  414   2HH1  ARG  58          2HH1      ARG  58   3.126   1.198  12.183
  415   1HH2  ARG  58          1HH2      ARG  58   5.957   3.228  11.499
  416   2HH2  ARG  58          2HH2      ARG  58   5.355   1.979  12.497
  417    H    LYS  59           H        LYS  59  -0.672   6.469   6.469
  418    HA   LYS  59           HA       LYS  59  -2.987   4.884   6.830
  419   1HB   LYS  59          1HB       LYS  59  -3.088   7.301   7.168
  420   2HB   LYS  59          2HB       LYS  59  -2.823   7.573   5.449
  421   1HG   LYS  59          1HG       LYS  59  -4.925   6.529   4.902
  422   2HG   LYS  59          2HG       LYS  59  -5.181   6.073   6.579
  423   1HD   LYS  59          1HD       LYS  59  -5.105   8.888   5.484
  424   2HD   LYS  59          2HD       LYS  59  -6.550   7.998   5.965
  425   1HE   LYS  59          1HE       LYS  59  -5.370   7.793   8.258
  426   2HE   LYS  59          2HE       LYS  59  -4.356   9.112   7.674
  427   1HZ   LYS  59          1HZ       LYS  59  -6.523  10.375   7.271
  428   2HZ   LYS  59          2HZ       LYS  59  -6.181  10.034   8.886
  429   3HZ   LYS  59          3HZ       LYS  59  -7.276   9.106   8.053
  430    H    LEU  60           H        LEU  60  -1.409   5.983   3.874
  431    HA   LEU  60           HA       LEU  60  -3.347   5.117   2.270
  432   1HB   LEU  60          1HB       LEU  60  -0.460   5.533   1.669
  433   2HB   LEU  60          2HB       LEU  60  -1.692   5.399   0.407
  434    HG   LEU  60           HG       LEU  60  -1.896   7.322   2.643
  435   1HD1  LEU  60          1HD1      LEU  60   0.117   7.954   1.544
  436   2HD1  LEU  60          2HD1      LEU  60  -1.125   9.060   0.933
  437   3HD1  LEU  60          3HD1      LEU  60  -0.573   7.714  -0.046
  438   1HD2  LEU  60          1HD2      LEU  60  -3.426   8.485   1.083
  439   2HD2  LEU  60          2HD2      LEU  60  -3.940   6.862   1.548
  440   3HD2  LEU  60          3HD2      LEU  60  -3.219   7.136  -0.041
  441    H    THR  61           H        THR  61  -0.325   3.618   3.262
  442    HA   THR  61           HA       THR  61  -0.359   1.235   1.758
  443    HB   THR  61           HB       THR  61   0.670   1.589   4.591
  444    HG1  THR  61           1HG      THR  61   1.822   2.984   3.422
  445   1HG2  THR  61          1HG2      THR  61   0.456  -0.782   3.898
  446   2HG2  THR  61          2HG2      THR  61   2.143  -0.301   4.075
  447   3HG2  THR  61          3HG2      THR  61   1.437  -0.444   2.469
  448    H    HIS  62           H        HIS  62  -1.820   2.146   4.748
  449    HA   HIS  62           HA       HIS  62  -2.833  -0.496   5.214
  450   1HB   HIS  62          1HB       HIS  62  -2.255   1.225   6.979
  451   2HB   HIS  62          2HB       HIS  62  -3.766   2.026   6.554
  452    HD1  HIS  62           1HD      HIS  62  -2.456  -1.161   8.024
  453    HD2  HIS  62           2HD      HIS  62  -6.021   0.920   7.702
  454    HE1  HIS  62           1HE      HIS  62  -4.054  -2.381   9.510
  455    H    GLY  63           H        GLY  63  -4.225   2.376   3.681
  456   1HA   GLY  63          1HA       GLY  63  -6.864   1.361   3.809
  457   2HA   GLY  63          2HA       GLY  63  -6.377   2.688   2.802
  458    H    VAL  64           H        VAL  64  -4.345   1.145   1.343
  459    HA   VAL  64           HA       VAL  64  -6.043  -0.069  -0.688
  460    HB   VAL  64           HB       VAL  64  -3.026  -0.298  -0.295
  461   1HG1  VAL  64          1HG1      VAL  64  -3.907  -2.152  -1.708
  462   2HG1  VAL  64          2HG1      VAL  64  -2.914  -1.066  -2.649
  463   3HG1  VAL  64          3HG1      VAL  64  -4.662  -0.979  -2.780
  464   1HG2  VAL  64          1HG2      VAL  64  -3.709   2.006  -0.685
  465   2HG2  VAL  64          2HG2      VAL  64  -4.610   1.510  -2.120
  466   3HG2  VAL  64          3HG2      VAL  64  -2.853   1.365  -2.088
  467    H    MET  65           H        MET  65  -4.254  -1.062   1.883
  468    HA   MET  65           HA       MET  65  -4.213  -3.885   1.514
  469   1HB   MET  65          1HB       MET  65  -2.689  -2.773   3.079
  470   2HB   MET  65          2HB       MET  65  -4.042  -2.252   4.038
  471   1HG   MET  65          1HG       MET  65  -4.539  -4.431   4.729
  472   2HG   MET  65          2HG       MET  65  -3.290  -5.124   3.698
  473   1HE   MET  65          1HE       MET  65  -2.568  -6.234   6.123
  474   2HE   MET  65          2HE       MET  65  -3.732  -5.154   6.931
  475   3HE   MET  65          3HE       MET  65  -2.053  -5.214   7.497
  476    H    ASN  66           H        ASN  66  -6.326  -1.746   3.418
  477    HA   ASN  66           HA       ASN  66  -8.192  -3.669   4.302
  478   1HB   ASN  66          1HB       ASN  66  -8.254  -0.722   3.811
  479   2HB   ASN  66          2HB       ASN  66  -9.644  -1.535   4.460
  480   1HD2  ASN  66          1HD2      ASN  66  -8.335   0.571   5.631
  481   2HD2  ASN  66          2HD2      ASN  66  -7.546   0.003   7.051
  482    H    LYS  67           H        LYS  67  -8.182  -1.633   1.452
  483    HA   LYS  67           HA       LYS  67 -10.702  -2.410   0.548
  484   1HB   LYS  67          1HB       LYS  67  -8.397  -1.043  -0.724
  485   2HB   LYS  67          2HB       LYS  67  -9.564  -1.786  -1.803
  486   1HG   LYS  67          1HG       LYS  67 -10.063   0.575  -1.455
  487   2HG   LYS  67          2HG       LYS  67 -11.350  -0.442  -0.825
  488   1HD   LYS  67          1HD       LYS  67 -10.449  -0.142   1.447
  489   2HD   LYS  67          2HD       LYS  67  -9.178   0.891   0.799
  490   1HE   LYS  67          1HE       LYS  67 -12.145   1.432   0.640
  491   2HE   LYS  67          2HE       LYS  67 -11.026   2.189   1.762
  492   1HZ   LYS  67          1HZ       LYS  67 -11.479   3.620  -0.120
  493   2HZ   LYS  67          2HZ       LYS  67 -10.953   2.449  -1.205
  494   3HZ   LYS  67          3HZ       LYS  67  -9.862   3.152  -0.129
  495    H    GLU  68           H        GLU  68  -7.492  -3.799  -0.188
  496    HA   GLU  68           HA       GLU  68  -8.846  -5.630  -1.813
  497   1HB   GLU  68          1HB       GLU  68  -6.688  -6.701  -2.114
  498   2HB   GLU  68          2HB       GLU  68  -6.778  -4.964  -2.463
  499   1HG   GLU  68          1HG       GLU  68  -5.640  -4.478  -0.415
  500   2HG   GLU  68          2HG       GLU  68  -5.437  -6.195  -0.067
  501    H    LEU  69           H        LEU  69  -7.530  -5.819   1.471
  502    HA   LEU  69           HA       LEU  69  -8.173  -8.449   1.902
  503   1HB   LEU  69          1HB       LEU  69  -8.097  -6.021   3.604
  504   2HB   LEU  69          2HB       LEU  69  -8.997  -7.365   4.248
  505    HG   LEU  69           HG       LEU  69  -6.655  -7.078   5.035
  506   1HD1  LEU  69          1HD1      LEU  69  -7.336  -9.700   3.655
  507   2HD1  LEU  69          2HD1      LEU  69  -7.847  -9.221   5.275
  508   3HD1  LEU  69          3HD1      LEU  69  -6.142  -9.515   4.941
  509   1HD2  LEU  69          1HD2      LEU  69  -4.851  -7.901   3.656
  510   2HD2  LEU  69          2HD2      LEU  69  -5.637  -6.503   2.917
  511   3HD2  LEU  69          3HD2      LEU  69  -5.970  -8.130   2.315
  512    H    LYS  70           H        LYS  70 -10.441  -5.729   1.584
  513    HA   LYS  70           HA       LYS  70 -12.516  -7.432   2.516
  514   1HB   LYS  70          1HB       LYS  70 -13.970  -5.493   2.398
  515   2HB   LYS  70          2HB       LYS  70 -12.408  -5.134   3.131
  516   1HG   LYS  70          1HG       LYS  70 -11.660  -3.967   1.283
  517   2HG   LYS  70          2HG       LYS  70 -13.079  -4.405   0.327
  518   1HD   LYS  70          1HD       LYS  70 -13.295  -2.134   1.229
  519   2HD   LYS  70          2HD       LYS  70 -14.521  -3.225   1.875
  520   1HE   LYS  70          1HE       LYS  70 -13.095  -3.529   3.913
  521   2HE   LYS  70          2HE       LYS  70 -11.998  -2.303   3.275
  522   1HZ   LYS  70          1HZ       LYS  70 -13.573  -1.452   4.905
  523   2HZ   LYS  70          2HZ       LYS  70 -14.855  -1.905   3.955
  524   3HZ   LYS  70          3HZ       LYS  70 -13.812  -0.701   3.424
  525    H    TYR  71           H        TYR  71 -11.244  -6.451  -0.562
  526    HA   TYR  71           HA       TYR  71 -13.568  -7.590  -1.951
  527   1HB   TYR  71          1HB       TYR  71 -11.018  -6.416  -3.062
  528   2HB   TYR  71          2HB       TYR  71 -12.402  -6.936  -4.017
  529    HD1  TYR  71           1HD      TYR  71 -11.583  -4.290  -4.494
  530    HD2  TYR  71           2HD      TYR  71 -13.976  -5.707  -1.288
  531    HE1  TYR  71           1HE      TYR  71 -12.562  -2.061  -4.215
  532    HE2  TYR  71           2HE      TYR  71 -14.932  -3.589  -0.978
  533    HH   TYR  71           HH       TYR  71 -14.732  -1.146  -3.271
  534    H    CYS  72           H        CYS  72 -10.342  -8.483  -1.188
  535    HA   CYS  72           HA       CYS  72 -10.316 -10.758  -2.944
  536   1HB   CYS  72          1HB       CYS  72  -8.489  -9.597  -0.889
  537   2HB   CYS  72          2HB       CYS  72  -8.040 -11.080  -1.657
  538    HG   CYS  72           HG       CYS  72  -7.292 -10.007  -3.976
  539    H    LYS  73           H        LYS  73 -10.501  -9.912   0.467
  540    HA   LYS  73           HA       LYS  73 -11.387 -10.864   2.254
  541   1HB   LYS  73          1HB       LYS  73 -12.496 -12.846   0.278
  542   2HB   LYS  73          2HB       LYS  73 -12.928 -12.817   1.986
  543   1HG   LYS  73          1HG       LYS  73 -14.129 -10.871   1.802
  544   2HG   LYS  73          2HG       LYS  73 -13.205 -10.310   0.409
  545   1HD   LYS  73          1HD       LYS  73 -14.213 -11.774  -0.999
  546   2HD   LYS  73          2HD       LYS  73 -15.053 -12.687   0.287
  547   1HE   LYS  73          1HE       LYS  73 -16.695 -11.272  -0.747
  548   2HE   LYS  73          2HE       LYS  73 -16.256 -10.481   0.762
  549   1HZ   LYS  73          1HZ       LYS  73 -16.388  -8.931  -1.061
  550   2HZ   LYS  73          2HZ       LYS  73 -15.235  -9.783  -1.929
  551   3HZ   LYS  73          3HZ       LYS  73 -14.810  -8.987  -0.478
  552    H    ASN  74           H        ASN  74  -9.908 -13.212   0.134
  553    HA   ASN  74           HA       ASN  74  -8.579 -14.387   2.439
  554   1HB   ASN  74          1HB       ASN  74  -7.858 -16.191   0.916
  555   2HB   ASN  74          2HB       ASN  74  -9.602 -16.000   0.842
  556   1HD2  ASN  74          1HD2      ASN  74 -10.536 -15.277  -1.099
  557   2HD2  ASN  74          2HD2      ASN  74  -9.637 -15.168  -2.560
  558    HA   PRO  75           HA       PRO  75  -5.106 -11.809   1.328
  559   1HB   PRO  75          1HB       PRO  75  -3.338 -12.843   2.859
  560   2HB   PRO  75          2HB       PRO  75  -4.543 -11.637   3.350
  561   1HG   PRO  75          1HG       PRO  75  -4.471 -14.655   3.838
  562   2HG   PRO  75          2HG       PRO  75  -5.080 -13.424   4.962
  563   1HD   PRO  75          1HD       PRO  75  -6.668 -14.986   3.377
  564   2HD   PRO  75          2HD       PRO  75  -7.137 -13.362   3.925
  565    H    GLU  76           H        GLU  76  -5.418 -14.882   0.760
  566    HA   GLU  76           HA       GLU  76  -2.923 -15.674  -0.164
  567   1HB   GLU  76          1HB       GLU  76  -4.788 -17.209   0.281
  568   2HB   GLU  76          2HB       GLU  76  -5.711 -16.485  -1.010
  569   1HG   GLU  76          1HG       GLU  76  -4.094 -17.370  -2.623
  570   2HG   GLU  76          2HG       GLU  76  -3.236 -18.144  -1.283
  571    H    ASP  77           H        ASP  77  -4.980 -13.369  -1.082
  572    HA   ASP  77           HA       ASP  77  -3.996 -13.117  -3.888
  573   1HB   ASP  77          1HB       ASP  77  -6.502 -13.669  -3.524
  574   2HB   ASP  77          2HB       ASP  77  -6.616 -12.041  -2.868
  575    H    LEU  78           H        LEU  78  -3.546 -12.017  -0.877
  576    HA   LEU  78           HA       LEU  78  -3.433  -9.210  -1.383
  577   1HB   LEU  78          1HB       LEU  78  -4.295 -10.055   0.716
  578   2HB   LEU  78          2HB       LEU  78  -2.848 -11.024   0.898
  579    HG   LEU  78           HG       LEU  78  -1.534  -9.006   0.980
  580   1HD1  LEU  78          1HD1      LEU  78  -3.008  -7.373   0.009
  581   2HD1  LEU  78          2HD1      LEU  78  -2.635  -6.918   1.686
  582   3HD1  LEU  78          3HD1      LEU  78  -4.184  -7.647   1.303
  583   1HD2  LEU  78          1HD2      LEU  78  -1.968 -10.173   2.960
  584   2HD2  LEU  78          2HD2      LEU  78  -3.531  -9.365   3.167
  585   3HD2  LEU  78          3HD2      LEU  78  -2.019  -8.439   3.282
  586    H    GLU  79           H        GLU  79  -1.767  -8.844  -2.606
  587    HA   GLU  79           HA       GLU  79   0.961  -9.406  -1.767
  588   1HB   GLU  79          1HB       GLU  79   0.268 -11.235  -3.316
  589   2HB   GLU  79          2HB       GLU  79  -0.330  -9.947  -4.375
  590   1HG   GLU  79          1HG       GLU  79   1.626 -10.784  -5.161
  591   2HG   GLU  79          2HG       GLU  79   1.841  -9.106  -4.702
  592    H    CYS  80           H        CYS  80   2.211  -7.776  -2.475
  593    HA   CYS  80           HA       CYS  80   0.818  -5.492  -3.610
  594   1HB   CYS  80          1HB       CYS  80   2.342  -4.871  -1.859
  595   2HB   CYS  80          2HB       CYS  80   3.673  -5.773  -2.550
  596    HG   CYS  80           HG       CYS  80   4.583  -3.914  -4.017
  597    H    ASN  81           H        ASN  81   0.334  -6.695  -5.385
  598    HA   ASN  81           HA       ASN  81   2.539  -7.341  -7.025
  599   1HB   ASN  81          1HB       ASN  81   0.933  -8.620  -8.485
  600   2HB   ASN  81          2HB       ASN  81   0.773  -9.069  -6.788
  601   1HD2  ASN  81          1HD2      ASN  81  -1.093  -8.517  -5.781
  602   2HD2  ASN  81          2HD2      ASN  81  -2.499  -7.948  -6.577
  603    H    GLU  82           H        GLU  82   1.328  -7.137  -9.557
  604    HA   GLU  82           HA       GLU  82   1.753  -4.620 -10.396
  605   1HB   GLU  82          1HB       GLU  82   0.119  -6.850 -11.279
  606   2HB   GLU  82          2HB       GLU  82   0.492  -5.540 -12.428
  607   1HG   GLU  82          1HG       GLU  82   2.854  -6.140 -12.275
  608   2HG   GLU  82          2HG       GLU  82   2.489  -7.305 -11.004
  609    H    ASN  83           H        ASN  83  -1.327  -6.347 -10.068
  610    HA   ASN  83           HA       ASN  83  -3.308  -4.497 -10.624
  611   1HB   ASN  83          1HB       ASN  83  -3.200  -6.671  -8.508
  612   2HB   ASN  83          2HB       ASN  83  -4.649  -5.730  -8.817
  613   1HD2  ASN  83          1HD2      ASN  83  -4.175  -8.557  -8.966
  614   2HD2  ASN  83          2HD2      ASN  83  -4.570  -9.056 -10.565
  615    H    VAL  84           H        VAL  84  -1.730  -5.357  -7.578
  616    HA   VAL  84           HA       VAL  84  -3.213  -3.548  -6.171
  617    HB   VAL  84           HB       VAL  84  -0.637  -4.903  -5.465
  618   1HG1  VAL  84          1HG1      VAL  84  -2.385  -3.198  -3.665
  619   2HG1  VAL  84          2HG1      VAL  84  -0.714  -2.837  -4.134
  620   3HG1  VAL  84          3HG1      VAL  84  -1.081  -4.265  -3.162
  621   1HG2  VAL  84          1HG2      VAL  84  -3.448  -5.179  -4.564
  622   2HG2  VAL  84          2HG2      VAL  84  -2.067  -6.149  -4.049
  623   3HG2  VAL  84          3HG2      VAL  84  -2.616  -6.213  -5.738
  624    H    LYS  85           H        LYS  85   0.058  -3.338  -7.374
  625    HA   LYS  85           HA       LYS  85   0.766  -0.789  -6.486
  626   1HB   LYS  85          1HB       LYS  85   1.533  -2.155  -9.043
  627   2HB   LYS  85          2HB       LYS  85   2.297  -0.693  -8.421
  628   1HG   LYS  85          1HG       LYS  85   2.943  -1.840  -6.434
  629   2HG   LYS  85          2HG       LYS  85   2.129  -3.299  -6.985
  630   1HD   LYS  85          1HD       LYS  85   3.670  -3.269  -8.959
  631   2HD   LYS  85          2HD       LYS  85   4.568  -1.982  -8.126
  632   1HE   LYS  85          1HE       LYS  85   4.647  -3.407  -6.150
  633   2HE   LYS  85          2HE       LYS  85   3.869  -4.653  -7.120
  634   1HZ   LYS  85          1HZ       LYS  85   6.534  -3.471  -7.770
  635   2HZ   LYS  85          2HZ       LYS  85   5.822  -4.806  -8.530
  636   3HZ   LYS  85          3HZ       LYS  85   6.326  -4.903  -6.928
  637    H    HIS  86           H        HIS  86  -0.811  -1.729  -9.346
  638    HA   HIS  86           HA       HIS  86  -1.091   0.845 -10.490
  639   1HB   HIS  86          1HB       HIS  86  -1.626  -1.254 -11.760
  640   2HB   HIS  86          2HB       HIS  86  -3.127  -1.368 -10.850
  641    HD1  HIS  86           1HD      HIS  86  -1.523   0.432 -13.683
  642    HD2  HIS  86           2HD      HIS  86  -5.102   0.578 -11.579
  643    HE1  HIS  86           1HE      HIS  86  -2.990   1.936 -15.003
  644    H    LYS  87           H        LYS  87  -3.281  -0.910  -8.425
  645    HA   LYS  87           HA       LYS  87  -5.332   1.079  -8.022
  646   1HB   LYS  87          1HB       LYS  87  -4.238  -1.151  -6.367
  647   2HB   LYS  87          2HB       LYS  87  -5.522  -0.100  -5.807
  648   1HG   LYS  87          1HG       LYS  87  -7.073  -1.112  -7.101
  649   2HG   LYS  87          2HG       LYS  87  -5.907  -1.505  -8.372
  650   1HD   LYS  87          1HD       LYS  87  -6.762  -3.461  -7.055
  651   2HD   LYS  87          2HD       LYS  87  -5.008  -3.231  -7.194
  652   1HE   LYS  87          1HE       LYS  87  -4.915  -2.332  -4.903
  653   2HE   LYS  87          2HE       LYS  87  -6.661  -2.449  -4.759
  654   1HZ   LYS  87          1HZ       LYS  87  -5.208  -4.269  -3.712
  655   2HZ   LYS  87          2HZ       LYS  87  -5.026  -4.861  -5.275
  656   3HZ   LYS  87          3HZ       LYS  87  -6.551  -4.754  -4.600
  657    H    THR  88           H        THR  88  -2.347   0.579  -6.544
  658    HA   THR  88           HA       THR  88  -2.975   2.254  -4.386
  659    HB   THR  88           HB       THR  88  -0.562   0.897  -5.392
  660    HG1  THR  88           1HG      THR  88  -1.206  -0.075  -3.115
  661   1HG2  THR  88          1HG2      THR  88   0.486   1.529  -3.252
  662   2HG2  THR  88          2HG2      THR  88  -0.935   2.561  -2.916
  663   3HG2  THR  88          3HG2      THR  88   0.097   2.880  -4.327
  664    H    LYS  89           H        LYS  89  -0.564   2.527  -6.949
  665    HA   LYS  89           HA       LYS  89  -0.025   5.052  -6.108
  666   1HB   LYS  89          1HB       LYS  89   1.072   5.356  -8.452
  667   2HB   LYS  89          2HB       LYS  89   1.734   4.261  -7.258
  668   1HG   LYS  89          1HG       LYS  89   1.777   3.163  -9.407
  669   2HG   LYS  89          2HG       LYS  89   0.535   2.437  -8.365
  670   1HD   LYS  89          1HD       LYS  89  -1.037   3.057  -9.460
  671   2HD   LYS  89          2HD       LYS  89  -0.374   4.596 -10.064
  672   1HE   LYS  89          1HE       LYS  89   0.335   1.807 -11.041
  673   2HE   LYS  89          2HE       LYS  89  -0.719   2.925 -11.931
  674   1HZ   LYS  89          1HZ       LYS  89   2.170   3.184 -11.318
  675   2HZ   LYS  89          2HZ       LYS  89   1.267   4.367 -12.123
  676   3HZ   LYS  89          3HZ       LYS  89   1.477   2.848 -12.803
  677    H    GLU  90           H        GLU  90  -2.321   3.939  -8.504
  678    HA   GLU  90           HA       GLU  90  -3.077   6.562  -9.384
  679   1HB   GLU  90          1HB       GLU  90  -4.574   3.983  -9.512
  680   2HB   GLU  90          2HB       GLU  90  -5.169   5.470 -10.249
  681   1HG   GLU  90          1HG       GLU  90  -2.635   3.994 -10.944
  682   2HG   GLU  90          2HG       GLU  90  -4.078   4.138 -11.945
  683    H    TYR  91           H        TYR  91  -4.007   4.618  -6.681
  684    HA   TYR  91           HA       TYR  91  -6.358   6.092  -6.024
  685   1HB   TYR  91          1HB       TYR  91  -6.315   3.988  -4.984
  686   2HB   TYR  91          2HB       TYR  91  -4.611   4.120  -4.587
  687    HD1  TYR  91           1HD      TYR  91  -4.051   4.464  -2.431
  688    HD2  TYR  91           2HD      TYR  91  -7.866   5.775  -3.749
  689    HE1  TYR  91           1HE      TYR  91  -4.562   5.073  -0.171
  690    HE2  TYR  91           2HE      TYR  91  -8.451   6.404  -1.434
  691    HH   TYR  91           HH       TYR  91  -6.174   6.633   1.048
  692    H    ILE  92           H        ILE  92  -3.011   5.959  -4.981
  693    HA   ILE  92           HA       ILE  92  -2.876   8.102  -3.235
  694    HB   ILE  92           HB       ILE  92  -0.864   7.265  -5.325
  695   1HG1  ILE  92          1HG1      ILE  92  -1.741   5.687  -3.420
  696   2HG1  ILE  92          2HG1      ILE  92  -0.010   5.663  -3.828
  697   1HG2  ILE  92          1HG2      ILE  92  -0.423   8.944  -2.870
  698   2HG2  ILE  92          2HG2      ILE  92  -0.475   9.514  -4.524
  699   3HG2  ILE  92          3HG2      ILE  92   0.842   8.430  -4.012
  700   1HD1  ILE  92          1HD1      ILE  92  -0.409   5.582  -1.491
  701   2HD1  ILE  92          2HD1      ILE  92  -1.481   6.989  -1.613
  702   3HD1  ILE  92          3HD1      ILE  92   0.269   7.162  -1.914
  703    H    LYS  93           H        LYS  93  -2.465   8.216  -6.749
  704    HA   LYS  93           HA       LYS  93  -1.977  10.883  -7.087
  705   1HB   LYS  93          1HB       LYS  93  -3.923   9.312  -8.806
  706   2HB   LYS  93          2HB       LYS  93  -3.073  10.763  -9.283
  707   1HG   LYS  93          1HG       LYS  93  -1.783   8.120  -8.684
  708   2HG   LYS  93          2HG       LYS  93  -2.207   8.691 -10.292
  709   1HD   LYS  93          1HD       LYS  93  -0.658  10.562 -10.019
  710   2HD   LYS  93          2HD       LYS  93  -0.265   9.993  -8.394
  711   1HE   LYS  93          1HE       LYS  93   1.420   9.287 -10.051
  712   2HE   LYS  93          2HE       LYS  93   0.613   7.924  -9.281
  713   1HZ   LYS  93          1HZ       LYS  93  -0.069   8.993 -11.978
  714   2HZ   LYS  93          2HZ       LYS  93  -0.739   7.615 -11.257
  715   3HZ   LYS  93          3HZ       LYS  93   0.873   7.632 -11.676
  716    H    LYS  94           H        LYS  94  -5.058   9.209  -7.006
  717    HA   LYS  94           HA       LYS  94  -6.523  11.582  -7.483
  718   1HB   LYS  94          1HB       LYS  94  -7.482   8.888  -6.522
  719   2HB   LYS  94          2HB       LYS  94  -8.547  10.170  -7.088
  720   1HG   LYS  94          1HG       LYS  94  -7.585   9.986  -9.320
  721   2HG   LYS  94          2HG       LYS  94  -6.450   8.763  -8.741
  722   1HD   LYS  94          1HD       LYS  94  -8.383   7.342  -8.105
  723   2HD   LYS  94          2HD       LYS  94  -9.458   8.539  -8.823
  724   1HE   LYS  94          1HE       LYS  94  -7.310   6.983 -10.270
  725   2HE   LYS  94          2HE       LYS  94  -9.039   6.672 -10.345
  726   1HZ   LYS  94          1HZ       LYS  94  -7.672   9.132 -11.296
  727   2HZ   LYS  94          2HZ       LYS  94  -9.331   8.882 -11.347
  728   3HZ   LYS  94          3HZ       LYS  94  -8.297   7.911 -12.256
  729    H    TYR  95           H        TYR  95  -5.648   9.700  -4.697
  730    HA   TYR  95           HA       TYR  95  -7.324  10.919  -2.840
  731   1HB   TYR  95          1HB       TYR  95  -6.278   8.868  -2.377
  732   2HB   TYR  95          2HB       TYR  95  -4.685   9.578  -2.696
  733    HD1  TYR  95           1HD      TYR  95  -3.472  10.419  -0.818
  734    HD2  TYR  95           2HD      TYR  95  -7.682   9.917  -0.485
  735    HE1  TYR  95           1HE      TYR  95  -3.392  11.126   1.515
  736    HE2  TYR  95           2HE      TYR  95  -7.568  10.604   1.874
  737    HH   TYR  95           HH       TYR  95  -6.192  11.020   3.593
  738    H    MET  96           H        MET  96  -3.977  11.603  -3.681
  739    HA   MET  96           HA       MET  96  -3.871  13.730  -1.883
  740   1HB   MET  96          1HB       MET  96  -2.111  13.264  -4.237
  741   2HB   MET  96          2HB       MET  96  -1.781  14.295  -2.837
  742   1HG   MET  96          1HG       MET  96  -2.252  12.094  -1.486
  743   2HG   MET  96          2HG       MET  96  -1.842  11.334  -3.029
  744   1HE   MET  96          1HE       MET  96  -0.326  14.593  -1.658
  745   2HE   MET  96          2HE       MET  96   0.895  13.958  -0.530
  746   3HE   MET  96          3HE       MET  96  -0.843  13.649  -0.262
  747    H    GLN  97           H        GLN  97  -5.057  13.498  -5.012
  748    HA   GLN  97           HA       GLN  97  -4.969  16.261  -5.690
  749   1HB   GLN  97          1HB       GLN  97  -7.185  14.440  -6.618
  750   2HB   GLN  97          2HB       GLN  97  -6.642  15.920  -7.378
  751   1HG   GLN  97          1HG       GLN  97  -5.303  13.254  -7.292
  752   2HG   GLN  97          2HG       GLN  97  -5.834  14.151  -8.699
  753   1HE2  GLN  97          1HE2      GLN  97  -3.423  13.609  -6.390
  754   2HE2  GLN  97          2HE2      GLN  97  -2.180  14.587  -7.034
  755    H    LYS  98           H        LYS  98  -6.877  14.597  -3.431
  756    HA   LYS  98           HA       LYS  98  -9.011  16.502  -3.467
  757   1HB   LYS  98          1HB       LYS  98 -10.018  15.357  -1.632
  758   2HB   LYS  98          2HB       LYS  98  -9.282  14.160  -2.667
  759   1HG   LYS  98          1HG       LYS  98  -7.902  13.403  -1.087
  760   2HG   LYS  98          2HG       LYS  98  -7.489  15.020  -0.532
  761   1HD   LYS  98          1HD       LYS  98 -10.046  13.519   0.130
  762   2HD   LYS  98          2HD       LYS  98  -8.617  13.648   1.172
  763   1HE   LYS  98          1HE       LYS  98  -8.865  15.921   1.473
  764   2HE   LYS  98          2HE       LYS  98  -9.995  16.112   0.148
  765   1HZ   LYS  98          1HZ       LYS  98 -11.057  16.262   2.271
  766   2HZ   LYS  98          2HZ       LYS  98 -10.604  14.706   2.721
  767   3HZ   LYS  98          3HZ       LYS  98 -11.648  14.966   1.420
  768    H    PHE  99           H        PHE  99  -5.943  16.368  -1.975
  769    HA   PHE  99           HA       PHE  99  -6.556  18.093   0.236
  770   1HB   PHE  99          1HB       PHE  99  -3.916  17.246  -0.953
  771   2HB   PHE  99          2HB       PHE  99  -4.049  18.324   0.427
  772    HD1  PHE  99           1HD      PHE  99  -5.752  17.292   2.302
  773    HD2  PHE  99           2HD      PHE  99  -3.381  15.078  -0.452
  774    HE1  PHE  99           1HE      PHE  99  -5.720  15.384   3.860
  775    HE2  PHE  99           2HE      PHE  99  -3.381  13.149   1.137
  776    HZ   PHE  99           HZ       PHE  99  -4.607  13.333   3.250
  777    H    GLY 100           H        GLY 100  -5.183  18.529  -2.960
  778   1HA   GLY 100          1HA       GLY 100  -5.763  20.513  -4.133
  779   2HA   GLY 100          2HA       GLY 100  -5.563  21.387  -2.608
  780    H    ALA 101           H        ALA 101  -3.913  22.580  -2.852
  781    HA   ALA 101           HA       ALA 101  -1.607  21.881  -4.444
  782   1HB   ALA 101          1HB       ALA 101  -2.346  24.205  -4.204
  783   2HB   ALA 101          2HB       ALA 101  -0.679  23.988  -3.658
  784   3HB   ALA 101          3HB       ALA 101  -1.988  24.129  -2.479
  785    H    VAL 102           H        VAL 102  -2.324  22.009  -0.990
  786    HA   VAL 102           HA       VAL 102   0.276  20.695  -0.578
  787    HB   VAL 102           HB       VAL 102  -1.064  22.175   1.618
  788   1HG1  VAL 102          1HG1      VAL 102   1.829  21.777   1.029
  789   2HG1  VAL 102          2HG1      VAL 102   0.838  20.905   2.199
  790   3HG1  VAL 102          3HG1      VAL 102   1.179  22.622   2.437
  791   1HG2  VAL 102          1HG2      VAL 102   0.106  24.281   1.085
  792   2HG2  VAL 102          2HG2      VAL 102  -1.152  23.812  -0.066
  793   3HG2  VAL 102          3HG2      VAL 102   0.552  23.579  -0.483
  794    H    TYR 103           H        TYR 103   0.345  19.232   1.068
  795    HA   TYR 103           HA       TYR 103  -2.063  17.729   1.258
  796   1HB   TYR 103          1HB       TYR 103  -0.296  16.286   0.793
  797   2HB   TYR 103          2HB       TYR 103   0.822  17.201   1.785
  798    HD1  TYR 103           1HD      TYR 103  -2.435  15.618   2.650
  799    HD2  TYR 103           2HD      TYR 103   1.715  15.715   3.250
  800    HE1  TYR 103           1HE      TYR 103  -2.693  14.029   4.439
  801    HE2  TYR 103           2HE      TYR 103   1.499  14.061   5.076
  802    HH   TYR 103           HH       TYR 103  -0.142  13.340   6.650
  803    H    LYS 104           H        LYS 104  -3.351  18.491   2.582
  804    HA   LYS 104           HA       LYS 104  -2.558  19.203   5.324
  805   1HB   LYS 104          1HB       LYS 104  -5.051  19.872   3.792
  806   2HB   LYS 104          2HB       LYS 104  -4.651  20.458   5.390
  807   1HG   LYS 104          1HG       LYS 104  -2.872  21.813   4.544
  808   2HG   LYS 104          2HG       LYS 104  -2.998  21.076   2.944
  809   1HD   LYS 104          1HD       LYS 104  -5.181  22.684   4.269
  810   2HD   LYS 104          2HD       LYS 104  -4.037  23.342   3.099
  811   1HE   LYS 104          1HE       LYS 104  -4.856  21.838   1.385
  812   2HE   LYS 104          2HE       LYS 104  -5.901  21.017   2.530
  813   1HZ   LYS 104          1HZ       LYS 104  -7.219  22.949   2.762
  814   2HZ   LYS 104          2HZ       LYS 104  -7.045  22.616   1.107
  815   3HZ   LYS 104          3HZ       LYS 104  -6.164  23.870   1.808
  816    HA   PRO 105           HA       PRO 105  -4.730  15.109   5.690
  817   1HB   PRO 105          1HB       PRO 105  -3.711  14.582   8.190
  818   2HB   PRO 105          2HB       PRO 105  -2.919  14.122   6.683
  819   1HG   PRO 105          1HG       PRO 105  -2.455  16.461   8.435
  820   2HG   PRO 105          2HG       PRO 105  -1.258  15.426   7.580
  821   1HD   PRO 105          1HD       PRO 105  -1.943  17.900   6.762
  822   2HD   PRO 105          2HD       PRO 105  -1.548  16.631   5.597
  823    H    LYS 106           H        LYS 106  -4.469  17.737   7.966
  824    HA   LYS 106           HA       LYS 106  -6.703  17.364   9.522
  825   1HB   LYS 106          1HB       LYS 106  -6.841  19.843   9.678
  826   2HB   LYS 106          2HB       LYS 106  -5.230  19.199   9.961
  827   1HG   LYS 106          1HG       LYS 106  -4.623  19.793   7.627
  828   2HG   LYS 106          2HG       LYS 106  -6.213  20.519   7.429
  829   1HD   LYS 106          1HD       LYS 106  -4.328  21.307   9.605
  830   2HD   LYS 106          2HD       LYS 106  -4.308  22.104   8.023
  831   1HE   LYS 106          1HE       LYS 106  -6.726  21.919   9.830
  832   2HE   LYS 106          2HE       LYS 106  -5.630  23.294   9.801
  833   1HZ   LYS 106          1HZ       LYS 106  -6.252  23.818   7.624
  834   2HZ   LYS 106          2HZ       LYS 106  -7.700  23.504   8.396
  835   3HZ   LYS 106          3HZ       LYS 106  -7.044  22.384   7.334
  836    H    GLU 107           H        GLU 107  -6.642  17.781   6.218
  837    HA   GLU 107           HA       GLU 107  -9.532  18.189   6.125
  838   1HB   GLU 107          1HB       GLU 107  -7.365  19.337   4.371
  839   2HB   GLU 107          2HB       GLU 107  -9.069  19.350   3.919
  840   1HG   GLU 107          1HG       GLU 107  -9.645  20.777   5.678
  841   2HG   GLU 107          2HG       GLU 107  -8.136  20.486   6.528
  842    H    ASP 108           H        ASP 108  -7.929  15.734   6.252
  843    HA   ASP 108           HA       ASP 108  -7.958  14.491   3.687
  844   1HB   ASP 108          1HB       ASP 108  -6.297  13.570   5.029
  845   2HB   ASP 108          2HB       ASP 108  -7.197  13.735   6.507
  846    H    THR 109           H        THR 109  -9.179  12.205   3.789
  847    HA   THR 109           HA       THR 109 -11.924  12.906   3.613
  848    HB   THR 109           HB       THR 109 -11.003  11.250   2.068
  849    HG1  THR 109           1HG      THR 109 -13.201  10.844   3.462
  850   1HG2  THR 109          1HG2      THR 109  -9.291  10.358   3.541
  851   2HG2  THR 109          2HG2      THR 109 -10.223   9.038   2.804
  852   3HG2  THR 109          3HG2      THR 109 -10.509   9.522   4.489
  Start of MODEL   20
    1    H    THR  10           H        THR  10  -2.012 -23.761   2.218
    2    HA   THR  10           HA       THR  10  -1.633 -23.146   4.968
    3    HB   THR  10           HB       THR  10   0.482 -22.321   3.463
    4    HG1  THR  10           1HG      THR  10  -0.116 -24.909   2.536
    5   1HG2  THR  10          1HG2      THR  10   0.633 -23.519   5.538
    6   2HG2  THR  10          2HG2      THR  10   1.515 -24.427   4.308
    7   3HG2  THR  10          3HG2      THR  10  -0.091 -24.951   4.816
    8    H    SER  11           H        SER  11  -3.407 -21.408   3.217
    9    HA   SER  11           HA       SER  11  -2.052 -18.840   2.919
   10   1HB   SER  11          1HB       SER  11  -4.883 -19.541   2.713
   11   2HB   SER  11          2HB       SER  11  -4.022 -18.165   1.969
   12    HG   SER  11           HG       SER  11  -4.425 -19.870   0.425
   13    H    SER  12           H        SER  12  -3.304 -20.274   5.587
   14    HA   SER  12           HA       SER  12  -4.103 -17.677   6.504
   15   1HB   SER  12          1HB       SER  12  -5.238 -19.753   7.330
   16   2HB   SER  12          2HB       SER  12  -3.720 -20.234   8.087
   17    HG   SER  12           HG       SER  12  -4.979 -19.245   9.591
   18    H    GLU  13           H        GLU  13  -1.314 -20.068   6.961
   19    HA   GLU  13           HA       GLU  13  -0.070 -18.244   8.599
   20   1HB   GLU  13          1HB       GLU  13   1.756 -19.976   8.487
   21   2HB   GLU  13          2HB       GLU  13   0.196 -20.549   9.074
   22   1HG   GLU  13          1HG       GLU  13  -0.294 -21.570   6.968
   23   2HG   GLU  13          2HG       GLU  13   1.090 -20.833   6.218
   24    H    LEU  14           H        LEU  14   0.211 -19.248   5.235
   25    HA   LEU  14           HA       LEU  14   2.646 -18.120   4.443
   26   1HB   LEU  14          1HB       LEU  14   0.936 -19.587   3.207
   27   2HB   LEU  14          2HB       LEU  14   0.109 -18.108   2.837
   28    HG   LEU  14           HG       LEU  14   2.959 -18.646   1.952
   29   1HD1  LEU  14          1HD1      LEU  14   1.465 -20.307   0.989
   30   2HD1  LEU  14          2HD1      LEU  14   2.008 -19.163  -0.235
   31   3HD1  LEU  14          3HD1      LEU  14   0.385 -19.027   0.442
   32   1HD2  LEU  14          1HD2      LEU  14   2.541 -16.858   0.332
   33   2HD2  LEU  14          2HD2      LEU  14   2.305 -16.262   1.977
   34   3HD2  LEU  14          3HD2      LEU  14   0.910 -16.646   0.970
   35    H    ALA  15           H        ALA  15  -0.458 -16.955   4.971
   36    HA   ALA  15           HA       ALA  15  -0.111 -14.439   3.688
   37   1HB   ALA  15          1HB       ALA  15  -2.259 -15.388   3.582
   38   2HB   ALA  15          2HB       ALA  15  -2.282 -13.879   4.513
   39   3HB   ALA  15          3HB       ALA  15  -2.348 -15.433   5.350
   40    H    LYS  16           H        LYS  16   0.037 -15.672   6.959
   41    HA   LYS  16           HA       LYS  16  -0.039 -13.237   8.302
   42   1HB   LYS  16          1HB       LYS  16   1.564 -15.704   8.990
   43   2HB   LYS  16          2HB       LYS  16   1.384 -14.321  10.057
   44   1HG   LYS  16          1HG       LYS  16  -0.818 -16.130   9.086
   45   2HG   LYS  16          2HG       LYS  16  -0.129 -16.100  10.707
   46   1HD   LYS  16          1HD       LYS  16  -0.900 -13.725  10.900
   47   2HD   LYS  16          2HD       LYS  16  -1.715 -13.920   9.349
   48   1HE   LYS  16          1HE       LYS  16  -2.999 -15.819  10.325
   49   2HE   LYS  16          2HE       LYS  16  -2.251 -15.470  11.872
   50   1HZ   LYS  16          1HZ       LYS  16  -3.292 -13.263  11.847
   51   2HZ   LYS  16          2HZ       LYS  16  -4.458 -14.469  11.683
   52   3HZ   LYS  16          3HZ       LYS  16  -3.981 -13.599  10.351
   53    H    LYS  17           H        LYS  17   2.576 -14.809   6.623
   54    HA   LYS  17           HA       LYS  17   4.391 -12.648   7.184
   55   1HB   LYS  17          1HB       LYS  17   4.626 -14.800   5.060
   56   2HB   LYS  17          2HB       LYS  17   5.865 -13.635   5.454
   57   1HG   LYS  17          1HG       LYS  17   6.587 -15.590   6.469
   58   2HG   LYS  17          2HG       LYS  17   5.837 -14.708   7.796
   59   1HD   LYS  17          1HD       LYS  17   3.860 -16.057   7.648
   60   2HD   LYS  17          2HD       LYS  17   4.439 -16.831   6.175
   61   1HE   LYS  17          1HE       LYS  17   6.384 -17.713   7.475
   62   2HE   LYS  17          2HE       LYS  17   5.645 -17.070   8.933
   63   1HZ   LYS  17          1HZ       LYS  17   3.778 -18.546   8.634
   64   2HZ   LYS  17          2HZ       LYS  17   5.197 -19.455   8.535
   65   3HZ   LYS  17          3HZ       LYS  17   4.376 -19.064   7.143
   66    H    SER  18           H        SER  18   2.168 -13.593   4.567
   67    HA   SER  18           HA       SER  18   3.277 -11.889   2.680
   68   1HB   SER  18          1HB       SER  18   1.788 -13.850   2.116
   69   2HB   SER  18          2HB       SER  18   0.426 -12.890   2.698
   70    HG   SER  18           HG       SER  18   0.636 -11.504   0.986
   71    H    LYS  19           H        LYS  19   0.878 -11.269   5.177
   72    HA   LYS  19           HA       LYS  19   0.008  -8.746   4.043
   73   1HB   LYS  19          1HB       LYS  19  -0.156  -9.444   6.961
   74   2HB   LYS  19          2HB       LYS  19  -1.200  -8.388   6.031
   75   1HG   LYS  19          1HG       LYS  19  -1.848 -10.643   4.780
   76   2HG   LYS  19          2HG       LYS  19  -1.190 -11.367   6.209
   77   1HD   LYS  19          1HD       LYS  19  -3.477  -9.411   6.123
   78   2HD   LYS  19          2HD       LYS  19  -3.565 -11.133   6.483
   79   1HE   LYS  19          1HE       LYS  19  -2.067 -10.690   8.440
   80   2HE   LYS  19          2HE       LYS  19  -2.249  -8.972   8.037
   81   1HZ   LYS  19          1HZ       LYS  19  -4.483 -10.789   8.763
   82   2HZ   LYS  19          2HZ       LYS  19  -4.609  -9.133   8.433
   83   3HZ   LYS  19          3HZ       LYS  19  -3.769  -9.653   9.785
   84    H    GLU  20           H        GLU  20   2.562  -9.752   6.193
   85    HA   GLU  20           HA       GLU  20   3.231  -7.067   6.968
   86   1HB   GLU  20          1HB       GLU  20   5.040  -9.458   7.014
   87   2HB   GLU  20          2HB       GLU  20   5.149  -8.000   7.991
   88   1HG   GLU  20          1HG       GLU  20   2.992  -8.596   8.981
   89   2HG   GLU  20          2HG       GLU  20   3.098 -10.100   8.058
   90    H    VAL  21           H        VAL  21   4.461  -9.463   4.746
   91    HA   VAL  21           HA       VAL  21   6.515  -7.827   3.659
   92    HB   VAL  21           HB       VAL  21   5.022 -10.151   2.403
   93   1HG1  VAL  21          1HG1      VAL  21   7.671  -8.893   1.626
   94   2HG1  VAL  21          2HG1      VAL  21   6.166  -8.753   0.718
   95   3HG1  VAL  21          3HG1      VAL  21   6.960 -10.321   0.876
   96   1HG2  VAL  21          1HG2      VAL  21   7.005 -11.483   3.028
   97   2HG2  VAL  21          2HG2      VAL  21   6.158 -10.829   4.429
   98   3HG2  VAL  21          3HG2      VAL  21   7.651 -10.076   3.871
   99    H    PHE  22           H        PHE  22   3.122  -8.300   2.905
  100    HA   PHE  22           HA       PHE  22   3.103  -6.725   0.527
  101   1HB   PHE  22          1HB       PHE  22   1.176  -8.011   0.736
  102   2HB   PHE  22          2HB       PHE  22   1.023  -7.650   2.456
  103    HD1  PHE  22           1HD      PHE  22   0.897  -5.965  -0.843
  104    HD2  PHE  22           2HD      PHE  22  -0.586  -6.111   3.113
  105    HE1  PHE  22           1HE      PHE  22  -0.657  -4.101  -1.348
  106    HE2  PHE  22           2HE      PHE  22  -2.133  -4.291   2.622
  107    HZ   PHE  22           HZ       PHE  22  -2.195  -3.274   0.422
  108    H    ARG  23           H        ARG  23   2.159  -6.020   3.815
  109    HA   ARG  23           HA       ARG  23   1.590  -3.319   3.346
  110   1HB   ARG  23          1HB       ARG  23   1.541  -2.954   5.740
  111   2HB   ARG  23          2HB       ARG  23   0.870  -4.533   5.376
  112   1HG   ARG  23          1HG       ARG  23   2.163  -5.149   7.150
  113   2HG   ARG  23          2HG       ARG  23   3.385  -5.251   5.883
  114   1HD   ARG  23          1HD       ARG  23   4.286  -4.069   7.779
  115   2HD   ARG  23          2HD       ARG  23   4.109  -2.971   6.405
  116    HE   ARG  23           HE       ARG  23   2.052  -3.148   8.460
  117   1HH1  ARG  23          1HH1      ARG  23   4.564  -1.232   6.855
  118   2HH1  ARG  23          2HH1      ARG  23   3.966   0.263   7.350
  119   1HH2  ARG  23          1HH2      ARG  23   1.277  -1.105   9.264
  120   2HH2  ARG  23          2HH2      ARG  23   2.011   0.340   8.784
  121    H    LYS  24           H        LYS  24   4.633  -4.854   3.913
  122    HA   LYS  24           HA       LYS  24   6.059  -2.446   4.430
  123   1HB   LYS  24          1HB       LYS  24   6.737  -4.603   5.314
  124   2HB   LYS  24          2HB       LYS  24   7.002  -5.193   3.686
  125   1HG   LYS  24          1HG       LYS  24   8.896  -3.837   3.387
  126   2HG   LYS  24          2HG       LYS  24   8.486  -2.824   4.777
  127   1HD   LYS  24          1HD       LYS  24  10.327  -4.357   5.292
  128   2HD   LYS  24          2HD       LYS  24   8.911  -4.690   6.283
  129   1HE   LYS  24          1HE       LYS  24   8.320  -6.523   4.689
  130   2HE   LYS  24          2HE       LYS  24   9.848  -6.226   3.864
  131   1HZ   LYS  24          1HZ       LYS  24   9.501  -7.040   6.679
  132   2HZ   LYS  24          2HZ       LYS  24  10.990  -6.728   5.945
  133   3HZ   LYS  24          3HZ       LYS  24  10.044  -8.032   5.434
  134    H    GLU  25           H        GLU  25   5.557  -4.585   1.557
  135    HA   GLU  25           HA       GLU  25   7.296  -3.356  -0.231
  136   1HB   GLU  25          1HB       GLU  25   4.537  -4.333  -0.856
  137   2HB   GLU  25          2HB       GLU  25   5.879  -4.199  -1.963
  138   1HG   GLU  25          1HG       GLU  25   6.095  -5.896   0.380
  139   2HG   GLU  25          2HG       GLU  25   5.028  -6.335  -0.955
  140    H    MET  26           H        MET  26   3.906  -3.088   0.410
  141    HA   MET  26           HA       MET  26   3.327  -0.998  -1.359
  142   1HB   MET  26          1HB       MET  26   1.740  -2.542  -0.426
  143   2HB   MET  26          2HB       MET  26   1.949  -1.789   1.153
  144   1HG   MET  26          1HG       MET  26   0.159  -0.527   0.629
  145   2HG   MET  26          2HG       MET  26   1.286   0.361  -0.383
  146   1HE   MET  26          1HE       MET  26   1.485  -1.963  -2.993
  147   2HE   MET  26          2HE       MET  26   1.555  -0.184  -3.095
  148   3HE   MET  26          3HE       MET  26   0.344  -1.050  -3.987
  149    H    SER  27           H        SER  27   4.205  -0.901   1.999
  150    HA   SER  27           HA       SER  27   3.806   1.857   2.345
  151   1HB   SER  27          1HB       SER  27   5.852   0.107   3.754
  152   2HB   SER  27          2HB       SER  27   5.515   1.777   4.197
  153    HG   SER  27           HG       SER  27   3.639  -0.326   4.150
  154    H    GLN  28           H        GLN  28   6.546  -0.018   1.144
  155    HA   GLN  28           HA       GLN  28   8.197   2.301   1.004
  156   1HB   GLN  28          1HB       GLN  28   9.890   0.885   0.242
  157   2HB   GLN  28          2HB       GLN  28   8.804  -0.083   1.272
  158   1HG   GLN  28          1HG       GLN  28   7.850  -1.109  -0.608
  159   2HG   GLN  28          2HG       GLN  28   8.827  -0.122  -1.689
  160   1HE2  GLN  28          1HE2      GLN  28   8.730  -3.012  -1.488
  161   2HE2  GLN  28          2HE2      GLN  28  10.315  -3.540  -1.079
  162    H    PHE  29           H        PHE  29   6.447   0.425  -1.164
  163    HA   PHE  29           HA       PHE  29   6.908   1.744  -3.577
  164   1HB   PHE  29          1HB       PHE  29   5.714  -0.383  -3.555
  165   2HB   PHE  29          2HB       PHE  29   4.406   0.323  -2.626
  166    HD1  PHE  29           1HD      PHE  29   2.626   1.414  -3.682
  167    HD2  PHE  29           2HD      PHE  29   6.069   0.273  -5.906
  168    HE1  PHE  29           1HE      PHE  29   1.423   1.844  -5.779
  169    HE2  PHE  29           2HE      PHE  29   4.840   0.719  -7.991
  170    HZ   PHE  29           HZ       PHE  29   2.479   1.488  -7.858
  171    H    ILE  30           H        ILE  30   4.289   2.293  -1.253
  172    HA   ILE  30           HA       ILE  30   3.237   4.575  -2.482
  173    HB   ILE  30           HB       ILE  30   3.071   3.599   0.370
  174   1HG1  ILE  30          1HG1      ILE  30   1.010   3.760  -1.829
  175   2HG1  ILE  30          2HG1      ILE  30   1.972   2.333  -1.466
  176   1HG2  ILE  30          1HG2      ILE  30   2.888   6.046   0.378
  177   2HG2  ILE  30          2HG2      ILE  30   1.337   5.293   0.773
  178   3HG2  ILE  30          3HG2      ILE  30   1.624   5.961  -0.841
  179   1HD1  ILE  30          1HD1      ILE  30  -0.258   2.173  -0.498
  180   2HD1  ILE  30          2HD1      ILE  30   0.028   3.643   0.429
  181   3HD1  ILE  30          3HD1      ILE  30   0.988   2.212   0.727
  182    H    VAL  31           H        VAL  31   5.657   4.224   0.105
  183    HA   VAL  31           HA       VAL  31   6.243   6.864   0.509
  184    HB   VAL  31           HB       VAL  31   8.009   4.421   0.446
  185   1HG1  VAL  31          1HG1      VAL  31   9.886   5.696   1.346
  186   2HG1  VAL  31          2HG1      VAL  31   8.960   7.182   1.252
  187   3HG1  VAL  31          3HG1      VAL  31   9.451   6.356  -0.233
  188   1HG2  VAL  31          1HG2      VAL  31   8.121   4.840   2.872
  189   2HG2  VAL  31          2HG2      VAL  31   6.451   4.709   2.298
  190   3HG2  VAL  31          3HG2      VAL  31   7.132   6.285   2.650
  191    H    GLN  32           H        GLN  32   7.543   4.819  -2.135
  192    HA   GLN  32           HA       GLN  32   9.080   6.718  -3.277
  193   1HB   GLN  32          1HB       GLN  32   9.213   4.365  -3.764
  194   2HB   GLN  32          2HB       GLN  32   7.648   4.404  -4.549
  195   1HG   GLN  32          1HG       GLN  32   9.425   4.333  -6.156
  196   2HG   GLN  32          2HG       GLN  32   8.495   5.840  -6.249
  197   1HE2  GLN  32          1HE2      GLN  32  10.168   6.962  -7.253
  198   2HE2  GLN  32          2HE2      GLN  32  11.598   7.443  -6.429
  199    H    CYS  33           H        CYS  33   5.726   5.823  -3.758
  200    HA   CYS  33           HA       CYS  33   5.074   7.425  -5.937
  201   1HB   CYS  33          1HB       CYS  33   3.422   6.351  -3.697
  202   2HB   CYS  33          2HB       CYS  33   2.718   7.087  -5.142
  203    HG   CYS  33           HG       CYS  33   4.660   4.280  -5.026
  204    H    LEU  34           H        LEU  34   4.977   8.010  -2.508
  205    HA   LEU  34           HA       LEU  34   3.847  10.635  -2.726
  206   1HB   LEU  34          1HB       LEU  34   5.156   9.285  -0.396
  207   2HB   LEU  34          2HB       LEU  34   4.339  10.829  -0.328
  208    HG   LEU  34           HG       LEU  34   3.082   8.186  -0.970
  209   1HD1  LEU  34          1HD1      LEU  34   2.896   9.997   1.446
  210   2HD1  LEU  34          2HD1      LEU  34   3.748   8.461   1.369
  211   3HD1  LEU  34          3HD1      LEU  34   1.991   8.499   1.216
  212   1HD2  LEU  34          1HD2      LEU  34   0.963   9.411  -0.796
  213   2HD2  LEU  34          2HD2      LEU  34   1.951   9.959  -2.145
  214   3HD2  LEU  34          3HD2      LEU  34   1.864  10.921  -0.666
  215    H    ASN  35           H        ASN  35   7.069   9.369  -2.755
  216    HA   ASN  35           HA       ASN  35   8.617  11.372  -1.985
  217   1HB   ASN  35          1HB       ASN  35   8.990   9.394  -4.063
  218   2HB   ASN  35          2HB       ASN  35  10.092  10.798  -4.219
  219   1HD2  ASN  35          1HD2      ASN  35   8.602   9.523  -1.416
  220   2HD2  ASN  35          2HD2      ASN  35  10.011   8.917  -0.701
  221    HA   PRO  36           HA       PRO  36   8.185  14.115  -5.952
  222   1HB   PRO  36          1HB       PRO  36   5.848  13.830  -7.373
  223   2HB   PRO  36          2HB       PRO  36   7.366  13.069  -7.842
  224   1HG   PRO  36          1HG       PRO  36   5.029  11.907  -6.411
  225   2HG   PRO  36          2HG       PRO  36   6.078  11.176  -7.638
  226   1HD   PRO  36          1HD       PRO  36   6.265  10.652  -4.993
  227   2HD   PRO  36          2HD       PRO  36   7.668  10.565  -6.057
  228    H    TYR  37           H        TYR  37   5.677  13.212  -3.820
  229    HA   TYR  37           HA       TYR  37   4.260  15.722  -4.082
  230   1HB   TYR  37          1HB       TYR  37   3.826  13.373  -2.242
  231   2HB   TYR  37          2HB       TYR  37   2.819  14.815  -2.265
  232    HD1  TYR  37           1HD      TYR  37   3.881  11.894  -4.207
  233    HD2  TYR  37           2HD      TYR  37   1.123  15.083  -3.900
  234    HE1  TYR  37           1HE      TYR  37   2.549  10.855  -5.924
  235    HE2  TYR  37           2HE      TYR  37  -0.244  14.103  -5.639
  236    HH   TYR  37           HH       TYR  37   0.075  12.563  -7.535
  237    H    ARG  38           H        ARG  38   6.689  14.311  -2.094
  238    HA   ARG  38           HA       ARG  38   6.323  16.317  -0.018
  239   1HB   ARG  38          1HB       ARG  38   8.136  15.266   1.155
  240   2HB   ARG  38          2HB       ARG  38   7.052  14.021   0.556
  241   1HG   ARG  38          1HG       ARG  38   8.548  13.521  -1.232
  242   2HG   ARG  38          2HG       ARG  38   9.621  14.840  -0.766
  243   1HD   ARG  38          1HD       ARG  38   9.832  13.659   1.484
  244   2HD   ARG  38          2HD       ARG  38   8.932  12.333   0.745
  245    HE   ARG  38           HE       ARG  38  11.093  12.871  -0.891
  246   1HH1  ARG  38          1HH1      ARG  38  10.634  11.721   2.452
  247   2HH1  ARG  38          2HH1      ARG  38  12.057  10.792   2.441
  248   1HH2  ARG  38          1HH2      ARG  38  13.050  11.581  -0.838
  249   2HH2  ARG  38          2HH2      ARG  38  13.430  10.708   0.575
  250    H    LYS  39           H        LYS  39   7.610  16.338  -2.939
  251    HA   LYS  39           HA       LYS  39  10.029  17.827  -2.580
  252   1HB   LYS  39          1HB       LYS  39   8.173  17.749  -4.966
  253   2HB   LYS  39          2HB       LYS  39   9.845  18.270  -4.967
  254   1HG   LYS  39          1HG       LYS  39   8.876  15.478  -4.437
  255   2HG   LYS  39          2HG       LYS  39   9.526  16.065  -5.968
  256   1HD   LYS  39          1HD       LYS  39  11.657  16.521  -4.855
  257   2HD   LYS  39          2HD       LYS  39  10.963  15.920  -3.338
  258   1HE   LYS  39          1HE       LYS  39  10.605  13.743  -4.298
  259   2HE   LYS  39          2HE       LYS  39  11.160  14.297  -5.874
  260   1HZ   LYS  39          1HZ       LYS  39  13.371  14.596  -4.951
  261   2HZ   LYS  39          2HZ       LYS  39  12.842  13.015  -4.714
  262   3HZ   LYS  39          3HZ       LYS  39  12.851  14.086  -3.428
  263    HA   PRO  40           HA       PRO  40   7.954  21.716  -1.651
  264   1HB   PRO  40          1HB       PRO  40   9.924  23.426  -2.513
  265   2HB   PRO  40          2HB       PRO  40   9.928  22.617  -0.941
  266   1HG   PRO  40          1HG       PRO  40  11.340  21.852  -3.468
  267   2HG   PRO  40          2HG       PRO  40  11.947  21.834  -1.802
  268   1HD   PRO  40          1HD       PRO  40  11.133  19.580  -3.022
  269   2HD   PRO  40          2HD       PRO  40  10.830  19.850  -1.294
  270    H    ASP  41           H        ASP  41   8.925  20.701  -4.851
  271    HA   ASP  41           HA       ASP  41   7.840  22.977  -6.160
  272   1HB   ASP  41          1HB       ASP  41   8.531  21.788  -8.140
  273   2HB   ASP  41          2HB       ASP  41   9.879  21.954  -7.022
  274    H    CYS  42           H        CYS  42   6.614  20.416  -4.690
  275    HA   CYS  42           HA       CYS  42   4.943  19.146  -6.603
  276   1HB   CYS  42          1HB       CYS  42   5.399  18.086  -4.454
  277   2HB   CYS  42          2HB       CYS  42   4.490  19.349  -3.626
  278    HG   CYS  42           HG       CYS  42   2.767  17.270  -3.491
  279    H    LYS  43           H        LYS  43   3.020  19.499  -7.398
  280    HA   LYS  43           HA       LYS  43   1.991  22.215  -7.199
  281   1HB   LYS  43          1HB       LYS  43   1.100  19.958  -8.972
  282   2HB   LYS  43          2HB       LYS  43   0.734  21.664  -9.161
  283   1HG   LYS  43          1HG       LYS  43   3.035  22.142  -9.676
  284   2HG   LYS  43          2HG       LYS  43   3.487  20.461  -9.388
  285   1HD   LYS  43          1HD       LYS  43   1.815  19.849 -11.180
  286   2HD   LYS  43          2HD       LYS  43   1.712  21.573 -11.540
  287   1HE   LYS  43          1HE       LYS  43   3.273  20.550 -13.064
  288   2HE   LYS  43          2HE       LYS  43   4.150  21.595 -11.954
  289   1HZ   LYS  43          1HZ       LYS  43   5.303  19.510 -12.260
  290   2HZ   LYS  43          2HZ       LYS  43   3.951  18.633 -11.768
  291   3HZ   LYS  43          3HZ       LYS  43   4.771  19.584 -10.664
  292    H    VAL  44           H        VAL  44   1.033  18.892  -6.624
  293    HA   VAL  44           HA       VAL  44  -1.426  19.817  -5.355
  294    HB   VAL  44           HB       VAL  44  -1.304  17.545  -7.373
  295   1HG1  VAL  44          1HG1      VAL  44  -2.836  17.032  -5.565
  296   2HG1  VAL  44          2HG1      VAL  44  -3.724  17.382  -7.049
  297   3HG1  VAL  44          3HG1      VAL  44  -3.631  18.595  -5.771
  298   1HG2  VAL  44          1HG2      VAL  44  -2.731  20.197  -7.534
  299   2HG2  VAL  44          2HG2      VAL  44  -2.847  18.894  -8.717
  300   3HG2  VAL  44          3HG2      VAL  44  -1.310  19.727  -8.465
  301    H    GLY  45           H        GLY  45  -1.602  18.967  -3.471
  302   1HA   GLY  45          1HA       GLY  45  -1.419  17.543  -1.686
  303   2HA   GLY  45          2HA       GLY  45  -0.978  16.269  -2.821
  304    H    ARG  46           H        ARG  46   0.664  19.432  -1.931
  305    HA   ARG  46           HA       ARG  46   3.133  18.081  -1.936
  306   1HB   ARG  46          1HB       ARG  46   2.835  20.403  -2.726
  307   2HB   ARG  46          2HB       ARG  46   2.380  20.875  -1.099
  308   1HG   ARG  46          1HG       ARG  46   4.536  20.497  -0.262
  309   2HG   ARG  46          2HG       ARG  46   5.057  19.647  -1.713
  310   1HD   ARG  46          1HD       ARG  46   5.959  21.888  -1.708
  311   2HD   ARG  46          2HD       ARG  46   4.765  21.732  -2.995
  312    HE   ARG  46           HE       ARG  46   4.108  22.892  -0.402
  313   1HH1  ARG  46          1HH1      ARG  46   4.122  23.146  -3.943
  314   2HH1  ARG  46          2HH1      ARG  46   3.377  24.669  -3.970
  315   1HH2  ARG  46          1HH2      ARG  46   3.040  24.974  -0.468
  316   2HH2  ARG  46          2HH2      ARG  46   2.734  25.731  -1.957
  317    H    ILE  47           H        ILE  47   3.910  17.022  -0.379
  318    HA   ILE  47           HA       ILE  47   2.722  17.069   2.236
  319    HB   ILE  47           HB       ILE  47   5.171  15.470   1.354
  320   1HG1  ILE  47          1HG1      ILE  47   2.239  14.676   1.484
  321   2HG1  ILE  47          2HG1      ILE  47   3.135  15.006   0.010
  322   1HG2  ILE  47          1HG2      ILE  47   3.437  15.222   3.772
  323   2HG2  ILE  47          2HG2      ILE  47   5.115  15.738   3.694
  324   3HG2  ILE  47          3HG2      ILE  47   4.672  14.099   3.231
  325   1HD1  ILE  47          1HD1      ILE  47   2.878  12.627   0.431
  326   2HD1  ILE  47          2HD1      ILE  47   3.752  12.805   1.955
  327   3HD1  ILE  47          3HD1      ILE  47   4.568  13.123   0.419
  328    H    THR  48           H        THR  48   3.185  18.356   3.732
  329    HA   THR  48           HA       THR  48   5.051  20.375   3.699
  330    HB   THR  48           HB       THR  48   4.384  20.487   6.157
  331    HG1  THR  48           1HG      THR  48   2.543  19.127   6.589
  332   1HG2  THR  48          1HG2      THR  48   2.152  21.189   5.580
  333   2HG2  THR  48          2HG2      THR  48   2.317  20.261   4.074
  334   3HG2  THR  48          3HG2      THR  48   3.314  21.714   4.327
  335    H    THR  49           H        THR  49   4.989  17.463   5.660
  336    HA   THR  49           HA       THR  49   7.822  17.974   6.355
  337    HB   THR  49           HB       THR  49   5.841  16.952   8.375
  338    HG1  THR  49           1HG      THR  49   4.942  18.839   8.111
  339   1HG2  THR  49          1HG2      THR  49   7.444  17.935   9.966
  340   2HG2  THR  49          2HG2      THR  49   8.426  18.506   8.618
  341   3HG2  THR  49          3HG2      THR  49   8.231  16.774   8.895
  342    H    THR  50           H        THR  50   8.952  16.094   7.021
  343    HA   THR  50           HA       THR  50   8.514  13.690   5.709
  344    HB   THR  50           HB       THR  50  10.563  14.473   6.544
  345    HG1  THR  50           1HG      THR  50  11.187  12.367   7.670
  346   1HG2  THR  50          1HG2      THR  50   9.919  15.391   8.659
  347   2HG2  THR  50          2HG2      THR  50  11.255  14.254   8.920
  348   3HG2  THR  50          3HG2      THR  50   9.587  13.788   9.304
  349    H    GLU  51           H        GLU  51   7.683  14.704   8.979
  350    HA   GLU  51           HA       GLU  51   6.600  12.290   9.995
  351   1HB   GLU  51          1HB       GLU  51   5.654  15.111  10.573
  352   2HB   GLU  51          2HB       GLU  51   5.485  13.709  11.623
  353   1HG   GLU  51          1HG       GLU  51   7.867  13.646  11.992
  354   2HG   GLU  51          2HG       GLU  51   8.112  14.954  10.838
  355    H    ASP  52           H        ASP  52   5.122  14.800   7.946
  356    HA   ASP  52           HA       ASP  52   2.519  13.692   8.015
  357   1HB   ASP  52          1HB       ASP  52   4.041  15.704   6.408
  358   2HB   ASP  52          2HB       ASP  52   2.402  15.294   5.987
  359    H    PHE  53           H        PHE  53   5.306  13.572   5.954
  360    HA   PHE  53           HA       PHE  53   4.211  12.172   3.838
  361   1HB   PHE  53          1HB       PHE  53   6.417  13.261   3.697
  362   2HB   PHE  53          2HB       PHE  53   7.005  12.240   4.994
  363    HD1  PHE  53           1HD      PHE  53   6.196  12.441   1.480
  364    HD2  PHE  53           2HD      PHE  53   7.591   9.929   4.585
  365    HE1  PHE  53           1HE      PHE  53   6.979  10.831  -0.183
  366    HE2  PHE  53           2HE      PHE  53   8.363   8.307   2.946
  367    HZ   PHE  53           HZ       PHE  53   8.066   8.772   0.527
  368    H    LYS  54           H        LYS  54   5.906  11.078   6.654
  369    HA   LYS  54           HA       LYS  54   5.809   8.256   6.227
  370   1HB   LYS  54          1HB       LYS  54   6.090   9.870   8.749
  371   2HB   LYS  54          2HB       LYS  54   6.307   8.125   8.633
  372   1HG   LYS  54          1HG       LYS  54   8.182   8.380   7.166
  373   2HG   LYS  54          2HG       LYS  54   7.888  10.110   7.013
  374   1HD   LYS  54          1HD       LYS  54   9.746   9.740   8.501
  375   2HD   LYS  54          2HD       LYS  54   8.381  10.374   9.410
  376   1HE   LYS  54          1HE       LYS  54   7.850   8.115  10.192
  377   2HE   LYS  54          2HE       LYS  54   9.205   7.473   9.264
  378   1HZ   LYS  54          1HZ       LYS  54   9.819   7.777  11.562
  379   2HZ   LYS  54          2HZ       LYS  54   9.334   9.375  11.511
  380   3HZ   LYS  54          3HZ       LYS  54  10.681   8.893  10.620
  381    H    HIS  55           H        HIS  55   3.630  10.497   7.954
  382    HA   HIS  55           HA       HIS  55   1.938   8.464   9.049
  383   1HB   HIS  55          1HB       HIS  55   2.058  10.894   9.848
  384   2HB   HIS  55          2HB       HIS  55   1.345  11.336   8.332
  385    HD1  HIS  55           1HD      HIS  55   0.381   9.449  11.462
  386    HD2  HIS  55           2HD      HIS  55  -1.405  11.192   8.130
  387    HE1  HIS  55           1HE      HIS  55  -2.086   9.321  11.883
  388    H    LEU  56           H        LEU  56   1.742  10.423   6.168
  389    HA   LEU  56           HA       LEU  56  -0.745   9.200   5.307
  390   1HB   LEU  56          1HB       LEU  56   0.336  11.447   4.623
  391   2HB   LEU  56          2HB       LEU  56   1.155  10.463   3.458
  392    HG   LEU  56           HG       LEU  56  -0.949   9.497   2.710
  393   1HD1  LEU  56          1HD1      LEU  56  -2.204  11.652   4.383
  394   2HD1  LEU  56          2HD1      LEU  56  -2.401   9.913   4.586
  395   3HD1  LEU  56          3HD1      LEU  56  -3.052  10.704   3.170
  396   1HD2  LEU  56          1HD2      LEU  56  -1.548  11.413   1.357
  397   2HD2  LEU  56          2HD2      LEU  56   0.200  11.162   1.523
  398   3HD2  LEU  56          3HD2      LEU  56  -0.601  12.451   2.446
  399    H    ALA  57           H        ALA  57   2.658   8.584   4.542
  400    HA   ALA  57           HA       ALA  57   2.104   6.629   2.591
  401   1HB   ALA  57          1HB       ALA  57   4.423   7.474   3.083
  402   2HB   ALA  57          2HB       ALA  57   4.333   5.713   3.054
  403   3HB   ALA  57          3HB       ALA  57   4.383   6.568   4.595
  404    H    ARG  58           H        ARG  58   2.191   6.457   6.020
  405    HA   ARG  58           HA       ARG  58   1.730   3.633   6.241
  406   1HB   ARG  58          1HB       ARG  58   1.046   5.826   8.204
  407   2HB   ARG  58          2HB       ARG  58   0.975   4.108   8.548
  408   1HG   ARG  58          1HG       ARG  58   3.406   5.773   7.976
  409   2HG   ARG  58          2HG       ARG  58   2.978   4.929   9.472
  410   1HD   ARG  58          1HD       ARG  58   3.024   2.821   8.202
  411   2HD   ARG  58          2HD       ARG  58   3.562   3.782   6.830
  412    HE   ARG  58           HE       ARG  58   5.587   4.310   8.000
  413   1HH1  ARG  58          1HH1      ARG  58   3.728   1.730   9.556
  414   2HH1  ARG  58          2HH1      ARG  58   5.084   0.865  10.097
  415   1HH2  ARG  58          1HH2      ARG  58   7.476   3.156   8.798
  416   2HH2  ARG  58          2HH2      ARG  58   7.268   1.698   9.631
  417    H    LYS  59           H        LYS  59  -0.316   6.424   6.075
  418    HA   LYS  59           HA       LYS  59  -2.613   5.000   6.860
  419   1HB   LYS  59          1HB       LYS  59  -2.200   7.453   7.164
  420   2HB   LYS  59          2HB       LYS  59  -2.503   7.662   5.449
  421   1HG   LYS  59          1HG       LYS  59  -4.777   7.047   5.687
  422   2HG   LYS  59          2HG       LYS  59  -4.515   6.480   7.339
  423   1HD   LYS  59          1HD       LYS  59  -3.852   8.826   7.942
  424   2HD   LYS  59          2HD       LYS  59  -4.386   9.321   6.335
  425   1HE   LYS  59          1HE       LYS  59  -6.626   8.614   6.797
  426   2HE   LYS  59          2HE       LYS  59  -6.114   7.872   8.314
  427   1HZ   LYS  59          1HZ       LYS  59  -5.481  10.163   9.058
  428   2HZ   LYS  59          2HZ       LYS  59  -7.103   9.867   8.865
  429   3HZ   LYS  59          3HZ       LYS  59  -6.331  10.799   7.720
  430    H    LEU  60           H        LEU  60  -1.337   6.076   3.736
  431    HA   LEU  60           HA       LEU  60  -3.463   5.236   2.261
  432   1HB   LEU  60          1HB       LEU  60  -0.600   5.633   1.513
  433   2HB   LEU  60          2HB       LEU  60  -1.883   5.448   0.308
  434    HG   LEU  60           HG       LEU  60  -2.052   7.441   2.470
  435   1HD1  LEU  60          1HD1      LEU  60  -0.010   8.001   1.298
  436   2HD1  LEU  60          2HD1      LEU  60  -1.261   9.128   0.748
  437   3HD1  LEU  60          3HD1      LEU  60  -0.783   7.779  -0.261
  438   1HD2  LEU  60          1HD2      LEU  60  -3.315   7.166  -0.222
  439   2HD2  LEU  60          2HD2      LEU  60  -3.573   8.529   0.872
  440   3HD2  LEU  60          3HD2      LEU  60  -4.075   6.901   1.346
  441    H    THR  61           H        THR  61  -0.418   3.730   3.100
  442    HA   THR  61           HA       THR  61  -0.587   1.279   1.744
  443    HB   THR  61           HB       THR  61   0.503   1.800   4.520
  444    HG1  THR  61           1HG      THR  61   1.689   2.977   3.138
  445   1HG2  THR  61          1HG2      THR  61   0.092  -0.607   4.123
  446   2HG2  THR  61          2HG2      THR  61   1.814  -0.249   4.203
  447   3HG2  THR  61          3HG2      THR  61   1.044  -0.516   2.640
  448    H    HIS  62           H        HIS  62  -1.921   2.358   4.730
  449    HA   HIS  62           HA       HIS  62  -3.003  -0.183   5.422
  450   1HB   HIS  62          1HB       HIS  62  -2.324   1.712   7.009
  451   2HB   HIS  62          2HB       HIS  62  -3.810   2.512   6.538
  452    HD1  HIS  62           1HD      HIS  62  -2.425   0.006   8.795
  453    HD2  HIS  62           2HD      HIS  62  -6.172   1.193   7.513
  454    HE1  HIS  62           1HE      HIS  62  -4.029  -1.004  10.441
  455    H    GLY  63           H        GLY  63  -4.331   2.661   3.753
  456   1HA   GLY  63          1HA       GLY  63  -6.986   1.694   3.807
  457   2HA   GLY  63          2HA       GLY  63  -6.411   2.985   2.784
  458    H    VAL  64           H        VAL  64  -4.381   1.370   1.409
  459    HA   VAL  64           HA       VAL  64  -6.015   0.122  -0.647
  460    HB   VAL  64           HB       VAL  64  -3.025  -0.177  -0.097
  461   1HG1  VAL  64          1HG1      VAL  64  -4.604  -0.933  -2.566
  462   2HG1  VAL  64          2HG1      VAL  64  -3.865  -2.069  -1.456
  463   3HG1  VAL  64          3HG1      VAL  64  -2.857  -1.033  -2.441
  464   1HG2  VAL  64          1HG2      VAL  64  -3.629   2.128  -0.627
  465   2HG2  VAL  64          2HG2      VAL  64  -4.474   1.579  -2.076
  466   3HG2  VAL  64          3HG2      VAL  64  -2.727   1.398  -1.959
  467    H    MET  65           H        MET  65  -4.309  -0.826   2.000
  468    HA   MET  65           HA       MET  65  -4.323  -3.648   1.727
  469   1HB   MET  65          1HB       MET  65  -2.791  -2.511   3.258
  470   2HB   MET  65          2HB       MET  65  -4.128  -1.930   4.199
  471   1HG   MET  65          1HG       MET  65  -4.662  -4.080   4.942
  472   2HG   MET  65          2HG       MET  65  -3.391  -4.810   3.966
  473   1HE   MET  65          1HE       MET  65  -3.752  -4.995   7.032
  474   2HE   MET  65          2HE       MET  65  -2.089  -4.899   7.654
  475   3HE   MET  65          3HE       MET  65  -2.451  -5.876   6.198
  476    H    ASN  66           H        ASN  66  -6.397  -1.437   3.634
  477    HA   ASN  66           HA       ASN  66  -8.273  -3.341   4.523
  478   1HB   ASN  66          1HB       ASN  66  -8.165  -0.395   4.174
  479   2HB   ASN  66          2HB       ASN  66  -9.679  -1.123   4.636
  480   1HD2  ASN  66          1HD2      ASN  66  -7.991   0.734   6.017
  481   2HD2  ASN  66          2HD2      ASN  66  -7.549  -0.074   7.479
  482    H    LYS  67           H        LYS  67  -8.227  -1.331   1.654
  483    HA   LYS  67           HA       LYS  67 -10.799  -2.063   0.876
  484   1HB   LYS  67          1HB       LYS  67  -8.542  -0.723  -0.464
  485   2HB   LYS  67          2HB       LYS  67  -9.709  -1.531  -1.497
  486   1HG   LYS  67          1HG       LYS  67 -10.259   0.808  -1.257
  487   2HG   LYS  67          2HG       LYS  67 -11.507  -0.204  -0.551
  488   1HD   LYS  67          1HD       LYS  67 -10.672   0.275   1.673
  489   2HD   LYS  67          2HD       LYS  67  -9.334   1.206   1.000
  490   1HE   LYS  67          1HE       LYS  67 -12.268   1.848   0.716
  491   2HE   LYS  67          2HE       LYS  67 -11.127   2.685   1.763
  492   1HZ   LYS  67          1HZ       LYS  67 -11.031   2.603  -1.216
  493   2HZ   LYS  67          2HZ       LYS  67  -9.883   3.339  -0.244
  494   3HZ   LYS  67          3HZ       LYS  67 -11.460   3.926  -0.268
  495    H    GLU  68           H        GLU  68  -7.626  -3.498   0.021
  496    HA   GLU  68           HA       GLU  68  -9.105  -5.291  -1.516
  497   1HB   GLU  68          1HB       GLU  68  -7.003  -6.430  -1.951
  498   2HB   GLU  68          2HB       GLU  68  -7.060  -4.689  -2.292
  499   1HG   GLU  68          1HG       GLU  68  -5.783  -4.232  -0.333
  500   2HG   GLU  68          2HG       GLU  68  -5.638  -5.951   0.030
  501    H    LEU  69           H        LEU  69  -7.704  -5.473   1.726
  502    HA   LEU  69           HA       LEU  69  -8.394  -8.077   2.205
  503   1HB   LEU  69          1HB       LEU  69  -8.238  -5.629   3.865
  504   2HB   LEU  69          2HB       LEU  69  -9.145  -6.954   4.550
  505    HG   LEU  69           HG       LEU  69  -6.791  -6.736   5.286
  506   1HD1  LEU  69          1HD1      LEU  69  -6.297  -9.169   5.114
  507   2HD1  LEU  69          2HD1      LEU  69  -7.510  -9.310   3.840
  508   3HD1  LEU  69          3HD1      LEU  69  -7.998  -8.882   5.480
  509   1HD2  LEU  69          1HD2      LEU  69  -5.024  -7.537   3.842
  510   2HD2  LEU  69          2HD2      LEU  69  -5.810  -6.101   3.175
  511   3HD2  LEU  69          3HD2      LEU  69  -6.183  -7.701   2.525
  512    H    LYS  70           H        LYS  70 -10.616  -5.301   1.850
  513    HA   LYS  70           HA       LYS  70 -12.757  -6.935   2.832
  514   1HB   LYS  70          1HB       LYS  70 -14.124  -4.965   2.725
  515   2HB   LYS  70          2HB       LYS  70 -12.548  -4.537   3.377
  516   1HG   LYS  70          1HG       LYS  70 -11.853  -3.604   1.370
  517   2HG   LYS  70          2HG       LYS  70 -13.297  -4.145   0.538
  518   1HD   LYS  70          1HD       LYS  70 -13.534  -1.827   0.963
  519   2HD   LYS  70          2HD       LYS  70 -14.643  -2.687   2.017
  520   1HE   LYS  70          1HE       LYS  70 -11.928  -1.782   2.949
  521   2HE   LYS  70          2HE       LYS  70 -13.315  -0.704   2.996
  522   1HZ   LYS  70          1HZ       LYS  70 -13.052  -1.676   5.094
  523   2HZ   LYS  70          2HZ       LYS  70 -12.918  -3.234   4.518
  524   3HZ   LYS  70          3HZ       LYS  70 -14.407  -2.424   4.439
  525    H    TYR  71           H        TYR  71 -11.382  -6.152  -0.255
  526    HA   TYR  71           HA       TYR  71 -13.762  -7.266  -1.639
  527   1HB   TYR  71          1HB       TYR  71 -11.239  -6.127  -2.876
  528   2HB   TYR  71          2HB       TYR  71 -12.744  -6.508  -3.708
  529    HD1  TYR  71           1HD      TYR  71 -11.265  -3.808  -3.676
  530    HD2  TYR  71           2HD      TYR  71 -14.456  -5.338  -1.320
  531    HE1  TYR  71           1HE      TYR  71 -12.012  -1.514  -3.170
  532    HE2  TYR  71           2HE      TYR  71 -15.187  -3.154  -0.806
  533    HH   TYR  71           HH       TYR  71 -14.016  -0.365  -2.470
  534    H    CYS  72           H        CYS  72 -10.536  -8.103  -0.851
  535    HA   CYS  72           HA       CYS  72 -10.388 -10.408  -2.591
  536   1HB   CYS  72          1HB       CYS  72  -8.616  -9.276  -0.461
  537   2HB   CYS  72          2HB       CYS  72  -8.159 -10.724  -1.304
  538    HG   CYS  72           HG       CYS  72  -7.156  -9.534  -3.383
  539    H    LYS  73           H        LYS  73 -10.504  -9.584   0.834
  540    HA   LYS  73           HA       LYS  73 -11.385 -10.540   2.617
  541   1HB   LYS  73          1HB       LYS  73 -12.577 -12.451   0.622
  542   2HB   LYS  73          2HB       LYS  73 -12.995 -12.434   2.330
  543   1HG   LYS  73          1HG       LYS  73 -14.106 -10.406   2.184
  544   2HG   LYS  73          2HG       LYS  73 -13.229  -9.917   0.728
  545   1HD   LYS  73          1HD       LYS  73 -14.366 -11.390  -0.586
  546   2HD   LYS  73          2HD       LYS  73 -15.129 -12.243   0.772
  547   1HE   LYS  73          1HE       LYS  73 -16.818 -10.846  -0.205
  548   2HE   LYS  73          2HE       LYS  73 -16.284 -10.022   1.254
  549   1HZ   LYS  73          1HZ       LYS  73 -16.548  -8.551  -0.634
  550   2HZ   LYS  73          2HZ       LYS  73 -15.386  -9.375  -1.506
  551   3HZ   LYS  73          3HZ       LYS  73 -14.958  -8.531  -0.085
  552    H    ASN  74           H        ASN  74  -9.928 -12.845   0.424
  553    HA   ASN  74           HA       ASN  74  -8.638 -14.125   2.703
  554   1HB   ASN  74          1HB       ASN  74  -7.981 -15.930   1.149
  555   2HB   ASN  74          2HB       ASN  74  -9.717 -15.675   1.090
  556   1HD2  ASN  74          1HD2      ASN  74 -10.642 -14.941  -0.825
  557   2HD2  ASN  74          2HD2      ASN  74  -9.771 -14.822  -2.301
  558    HA   PRO  75           HA       PRO  75  -5.023 -11.704   1.662
  559   1HB   PRO  75          1HB       PRO  75  -3.295 -12.979   3.096
  560   2HB   PRO  75          2HB       PRO  75  -4.400 -11.689   3.669
  561   1HG   PRO  75          1HG       PRO  75  -4.523 -14.717   3.991
  562   2HG   PRO  75          2HG       PRO  75  -5.031 -13.519   5.194
  563   1HD   PRO  75          1HD       PRO  75  -6.761 -14.866   3.559
  564   2HD   PRO  75          2HD       PRO  75  -7.097 -13.240   4.196
  565    H    GLU  76           H        GLU  76  -5.519 -14.774   0.991
  566    HA   GLU  76           HA       GLU  76  -3.070 -15.672   0.096
  567   1HB   GLU  76          1HB       GLU  76  -5.006 -17.103   0.531
  568   2HB   GLU  76          2HB       GLU  76  -5.890 -16.321  -0.749
  569   1HG   GLU  76          1HG       GLU  76  -4.275 -17.309  -2.359
  570   2HG   GLU  76          2HG       GLU  76  -3.602 -18.233  -1.004
  571    H    ASP  77           H        ASP  77  -4.975 -13.263  -0.820
  572    HA   ASP  77           HA       ASP  77  -4.108 -13.080  -3.679
  573   1HB   ASP  77          1HB       ASP  77  -6.593 -13.382  -3.250
  574   2HB   ASP  77          2HB       ASP  77  -6.554 -11.827  -2.432
  575    H    LEU  78           H        LEU  78  -3.594 -11.901  -0.575
  576    HA   LEU  78           HA       LEU  78  -3.471  -9.121  -1.201
  577   1HB   LEU  78          1HB       LEU  78  -4.445  -9.905   0.867
  578   2HB   LEU  78          2HB       LEU  78  -2.967 -10.806   1.178
  579    HG   LEU  78           HG       LEU  78  -1.760  -8.744   1.266
  580   1HD1  LEU  78          1HD1      LEU  78  -2.981  -6.676   1.776
  581   2HD1  LEU  78          2HD1      LEU  78  -4.485  -7.496   1.404
  582   3HD1  LEU  78          3HD1      LEU  78  -3.288  -7.220   0.117
  583   1HD2  LEU  78          1HD2      LEU  78  -2.264  -9.830   3.194
  584   2HD2  LEU  78          2HD2      LEU  78  -3.906  -9.170   3.275
  585   3HD2  LEU  78          3HD2      LEU  78  -2.494  -8.110   3.513
  586    H    GLU  79           H        GLU  79  -1.778  -8.889  -2.463
  587    HA   GLU  79           HA       GLU  79   0.930  -9.260  -1.446
  588   1HB   GLU  79          1HB       GLU  79   0.393 -11.143  -2.985
  589   2HB   GLU  79          2HB       GLU  79  -0.224  -9.920  -4.104
  590   1HG   GLU  79          1HG       GLU  79   1.834 -10.712  -4.772
  591   2HG   GLU  79          2HG       GLU  79   1.900  -9.002  -4.426
  592    H    CYS  80           H        CYS  80   2.186  -7.636  -2.213
  593    HA   CYS  80           HA       CYS  80   0.749  -5.370  -3.364
  594   1HB   CYS  80          1HB       CYS  80   2.223  -4.730  -1.576
  595   2HB   CYS  80          2HB       CYS  80   3.588  -5.589  -2.260
  596    HG   CYS  80           HG       CYS  80   4.491  -3.615  -3.649
  597    H    ASN  81           H        ASN  81   0.360  -6.651  -5.147
  598    HA   ASN  81           HA       ASN  81   2.666  -7.236  -6.728
  599   1HB   ASN  81          1HB       ASN  81   1.151  -8.551  -8.212
  600   2HB   ASN  81          2HB       ASN  81   0.960  -9.016  -6.522
  601   1HD2  ASN  81          1HD2      ASN  81  -0.914  -8.532  -5.578
  602   2HD2  ASN  81          2HD2      ASN  81  -2.314  -7.992  -6.420
  603    H    GLU  82           H        GLU  82   1.534  -7.063  -9.317
  604    HA   GLU  82           HA       GLU  82   1.863  -4.486 -10.012
  605   1HB   GLU  82          1HB       GLU  82   0.642  -6.823 -11.033
  606   2HB   GLU  82          2HB       GLU  82   0.785  -5.433 -12.154
  607   1HG   GLU  82          1HG       GLU  82   2.906  -7.074 -10.788
  608   2HG   GLU  82          2HG       GLU  82   2.747  -6.820 -12.541
  609    H    ASN  83           H        ASN  83  -1.116  -6.423  -9.818
  610    HA   ASN  83           HA       ASN  83  -3.196  -4.720 -10.563
  611   1HB   ASN  83          1HB       ASN  83  -3.067  -6.693  -8.243
  612   2HB   ASN  83          2HB       ASN  83  -4.565  -5.947  -8.795
  613   1HD2  ASN  83          1HD2      ASN  83  -3.777  -8.696  -8.495
  614   2HD2  ASN  83          2HD2      ASN  83  -3.936  -9.457 -10.026
  615    H    VAL  84           H        VAL  84  -1.659  -5.339  -7.415
  616    HA   VAL  84           HA       VAL  84  -3.205  -3.435  -6.200
  617    HB   VAL  84           HB       VAL  84  -0.666  -4.743  -5.280
  618   1HG1  VAL  84          1HG1      VAL  84  -2.588  -2.996  -3.724
  619   2HG1  VAL  84          2HG1      VAL  84  -0.873  -2.653  -4.027
  620   3HG1  VAL  84          3HG1      VAL  84  -1.352  -4.023  -3.025
  621   1HG2  VAL  84          1HG2      VAL  84  -2.167  -5.982  -3.897
  622   2HG2  VAL  84          2HG2      VAL  84  -2.559  -6.164  -5.619
  623   3HG2  VAL  84          3HG2      VAL  84  -3.535  -5.107  -4.576
  624    H    LYS  85           H        LYS  85   0.136  -3.359  -7.318
  625    HA   LYS  85           HA       LYS  85   0.893  -0.775  -6.499
  626   1HB   LYS  85          1HB       LYS  85   1.648  -2.225  -9.016
  627   2HB   LYS  85          2HB       LYS  85   2.433  -0.765  -8.430
  628   1HG   LYS  85          1HG       LYS  85   3.182  -1.885  -6.478
  629   2HG   LYS  85          2HG       LYS  85   2.261  -3.328  -6.913
  630   1HD   LYS  85          1HD       LYS  85   3.607  -3.377  -9.036
  631   2HD   LYS  85          2HD       LYS  85   4.646  -2.156  -8.288
  632   1HE   LYS  85          1HE       LYS  85   5.054  -3.590  -6.435
  633   2HE   LYS  85          2HE       LYS  85   3.902  -4.752  -7.104
  634   1HZ   LYS  85          1HZ       LYS  85   5.348  -5.011  -9.032
  635   2HZ   LYS  85          2HZ       LYS  85   6.223  -5.420  -7.625
  636   3HZ   LYS  85          3HZ       LYS  85   6.461  -3.926  -8.382
  637    H    HIS  86           H        HIS  86  -0.517  -1.736  -9.491
  638    HA   HIS  86           HA       HIS  86  -0.767   0.738 -10.775
  639   1HB   HIS  86          1HB       HIS  86  -1.366  -1.238 -12.031
  640   2HB   HIS  86          2HB       HIS  86  -2.626  -1.662 -10.881
  641    HD1  HIS  86           1HD      HIS  86  -1.998   0.380 -13.940
  642    HD2  HIS  86           2HD      HIS  86  -5.054  -0.166 -11.181
  643    HE1  HIS  86           1HE      HIS  86  -4.000   1.431 -14.965
  644    H    LYS  87           H        LYS  87  -3.056  -0.895  -8.727
  645    HA   LYS  87           HA       LYS  87  -5.062   1.142  -8.611
  646   1HB   LYS  87          1HB       LYS  87  -5.377  -1.272  -8.164
  647   2HB   LYS  87          2HB       LYS  87  -4.317  -1.097  -6.779
  648   1HG   LYS  87          1HG       LYS  87  -5.925   0.450  -5.784
  649   2HG   LYS  87          2HG       LYS  87  -7.003   0.167  -7.160
  650   1HD   LYS  87          1HD       LYS  87  -7.669  -1.249  -5.366
  651   2HD   LYS  87          2HD       LYS  87  -6.952  -2.207  -6.672
  652   1HE   LYS  87          1HE       LYS  87  -4.847  -2.411  -5.447
  653   2HE   LYS  87          2HE       LYS  87  -5.464  -1.339  -4.192
  654   1HZ   LYS  87          1HZ       LYS  87  -5.487  -3.661  -3.523
  655   2HZ   LYS  87          2HZ       LYS  87  -6.480  -4.074  -4.809
  656   3HZ   LYS  87          3HZ       LYS  87  -7.058  -3.051  -3.590
  657    H    THR  88           H        THR  88  -2.276   0.554  -6.766
  658    HA   THR  88           HA       THR  88  -3.052   2.230  -4.639
  659    HB   THR  88           HB       THR  88  -0.592   0.818  -5.451
  660    HG1  THR  88           1HG      THR  88  -1.337  -0.080  -3.199
  661   1HG2  THR  88          1HG2      THR  88   0.364   1.510  -3.287
  662   2HG2  THR  88          2HG2      THR  88  -1.046   2.585  -3.055
  663   3HG2  THR  88          3HG2      THR  88   0.057   2.830  -4.428
  664    H    LYS  89           H        LYS  89  -0.465   2.523  -7.025
  665    HA   LYS  89           HA       LYS  89   0.025   5.047  -6.140
  666   1HB   LYS  89          1HB       LYS  89   1.212   5.373  -8.438
  667   2HB   LYS  89          2HB       LYS  89   1.838   4.307  -7.202
  668   1HG   LYS  89          1HG       LYS  89   2.032   3.177  -9.292
  669   2HG   LYS  89          2HG       LYS  89   0.713   2.453  -8.351
  670   1HD   LYS  89          1HD       LYS  89  -0.756   3.002  -9.624
  671   2HD   LYS  89          2HD       LYS  89  -0.100   4.581 -10.121
  672   1HE   LYS  89          1HE       LYS  89   0.809   1.839 -11.100
  673   2HE   LYS  89          2HE       LYS  89  -0.151   2.981 -12.051
  674   1HZ   LYS  89          1HZ       LYS  89   2.611   3.441 -11.049
  675   2HZ   LYS  89          2HZ       LYS  89   1.761   4.513 -11.982
  676   3HZ   LYS  89          3HZ       LYS  89   2.233   3.021 -12.622
  677    H    GLU  90           H        GLU  90  -2.090   3.942  -8.712
  678    HA   GLU  90           HA       GLU  90  -2.845   6.532  -9.628
  679   1HB   GLU  90          1HB       GLU  90  -4.236   3.900  -9.791
  680   2HB   GLU  90          2HB       GLU  90  -4.932   5.358 -10.494
  681   1HG   GLU  90          1HG       GLU  90  -2.261   4.148 -11.215
  682   2HG   GLU  90          2HG       GLU  90  -3.726   4.092 -12.200
  683    H    TYR  91           H        TYR  91  -3.878   4.600  -6.940
  684    HA   TYR  91           HA       TYR  91  -6.240   6.076  -6.342
  685   1HB   TYR  91          1HB       TYR  91  -6.231   3.983  -5.270
  686   2HB   TYR  91          2HB       TYR  91  -4.523   4.088  -4.887
  687    HD1  TYR  91           1HD      TYR  91  -3.980   4.345  -2.698
  688    HD2  TYR  91           2HD      TYR  91  -7.694   5.891  -4.042
  689    HE1  TYR  91           1HE      TYR  91  -4.486   5.015  -0.427
  690    HE2  TYR  91           2HE      TYR  91  -8.252   6.562  -1.731
  691    HH   TYR  91           HH       TYR  91  -5.913   6.593   0.743
  692    H    ILE  92           H        ILE  92  -2.924   5.946  -5.175
  693    HA   ILE  92           HA       ILE  92  -2.844   8.094  -3.441
  694    HB   ILE  92           HB       ILE  92  -0.759   7.279  -5.467
  695   1HG1  ILE  92          1HG1      ILE  92  -1.721   5.685  -3.665
  696   2HG1  ILE  92          2HG1      ILE  92   0.039   5.673  -3.922
  697   1HG2  ILE  92          1HG2      ILE  92  -0.419   8.930  -2.976
  698   2HG2  ILE  92          2HG2      ILE  92  -0.388   9.516  -4.627
  699   3HG2  ILE  92          3HG2      ILE  92   0.891   8.420  -4.063
  700   1HD1  ILE  92          1HD1      ILE  92  -0.551   5.549  -1.636
  701   2HD1  ILE  92          2HD1      ILE  92  -1.632   6.941  -1.823
  702   3HD1  ILE  92          3HD1      ILE  92   0.137   7.140  -1.981
  703    H    LYS  93           H        LYS  93  -2.317   8.227  -6.939
  704    HA   LYS  93           HA       LYS  93  -1.824  10.911  -7.240
  705   1HB   LYS  93          1HB       LYS  93  -3.693   9.377  -9.078
  706   2HB   LYS  93          2HB       LYS  93  -2.746  10.786  -9.488
  707   1HG   LYS  93          1HG       LYS  93  -1.612   8.084  -8.822
  708   2HG   LYS  93          2HG       LYS  93  -1.909   8.674 -10.452
  709   1HD   LYS  93          1HD       LYS  93  -0.280  10.454 -10.098
  710   2HD   LYS  93          2HD       LYS  93  -0.030   9.903  -8.438
  711   1HE   LYS  93          1HE       LYS  93   1.735   9.085  -9.963
  712   2HE   LYS  93          2HE       LYS  93   0.821   7.770  -9.231
  713   1HZ   LYS  93          1HZ       LYS  93  -0.423   7.522 -11.327
  714   2HZ   LYS  93          2HZ       LYS  93   1.223   7.416 -11.620
  715   3HZ   LYS  93          3HZ       LYS  93   0.398   8.842 -11.971
  716    H    LYS  94           H        LYS  94  -4.911   9.220  -7.275
  717    HA   LYS  94           HA       LYS  94  -6.363  11.619  -7.752
  718   1HB   LYS  94          1HB       LYS  94  -7.354   8.907  -6.899
  719   2HB   LYS  94          2HB       LYS  94  -8.404  10.215  -7.439
  720   1HG   LYS  94          1HG       LYS  94  -7.290  10.132  -9.637
  721   2HG   LYS  94          2HG       LYS  94  -6.322   8.769  -9.066
  722   1HD   LYS  94          1HD       LYS  94  -8.418   7.527  -8.619
  723   2HD   LYS  94          2HD       LYS  94  -9.327   8.866  -9.318
  724   1HE   LYS  94          1HE       LYS  94  -8.075   8.537 -11.434
  725   2HE   LYS  94          2HE       LYS  94  -7.301   7.127 -10.714
  726   1HZ   LYS  94          1HZ       LYS  94  -9.167   6.484 -12.068
  727   2HZ   LYS  94          2HZ       LYS  94 -10.198   7.482 -11.217
  728   3HZ   LYS  94          3HZ       LYS  94  -9.532   6.133 -10.456
  729    H    TYR  95           H        TYR  95  -5.546   9.681  -5.001
  730    HA   TYR  95           HA       TYR  95  -7.258  10.786  -3.130
  731   1HB   TYR  95          1HB       TYR  95  -6.095   8.755  -2.779
  732   2HB   TYR  95          2HB       TYR  95  -4.549   9.590  -2.981
  733    HD1  TYR  95           1HD      TYR  95  -3.513  10.493  -1.056
  734    HD2  TYR  95           2HD      TYR  95  -7.621   9.484  -0.917
  735    HE1  TYR  95           1HE      TYR  95  -3.584  11.098   1.335
  736    HE2  TYR  95           2HE      TYR  95  -7.700  10.050   1.458
  737    HH   TYR  95           HH       TYR  95  -6.073  10.149   3.358
  738    H    MET  96           H        MET  96  -3.919  11.590  -3.882
  739    HA   MET  96           HA       MET  96  -3.910  13.690  -2.054
  740   1HB   MET  96          1HB       MET  96  -2.076  13.308  -4.364
  741   2HB   MET  96          2HB       MET  96  -1.826  14.327  -2.938
  742   1HG   MET  96          1HG       MET  96  -2.285  12.069  -1.653
  743   2HG   MET  96          2HG       MET  96  -1.725  11.379  -3.184
  744   1HE   MET  96          1HE       MET  96   0.703  14.150  -0.511
  745   2HE   MET  96          2HE       MET  96  -1.037  13.773  -0.341
  746   3HE   MET  96          3HE       MET  96  -0.446  14.700  -1.730
  747    H    GLN  97           H        GLN  97  -5.022  13.465  -5.220
  748    HA   GLN  97           HA       GLN  97  -4.993  16.224  -5.883
  749   1HB   GLN  97          1HB       GLN  97  -7.144  14.315  -6.799
  750   2HB   GLN  97          2HB       GLN  97  -6.709  15.836  -7.547
  751   1HG   GLN  97          1HG       GLN  97  -5.200  13.260  -7.503
  752   2HG   GLN  97          2HG       GLN  97  -5.788  14.145  -8.900
  753   1HE2  GLN  97          1HE2      GLN  97  -3.360  13.721  -6.583
  754   2HE2  GLN  97          2HE2      GLN  97  -2.179  14.803  -7.168
  755    H    LYS  98           H        LYS  98  -6.900  14.516  -3.658
  756    HA   LYS  98           HA       LYS  98  -9.068  16.383  -3.669
  757   1HB   LYS  98          1HB       LYS  98 -10.098  15.165  -1.898
  758   2HB   LYS  98          2HB       LYS  98  -9.304  14.003  -2.937
  759   1HG   LYS  98          1HG       LYS  98  -8.048  13.186  -1.252
  760   2HG   LYS  98          2HG       LYS  98  -7.565  14.808  -0.757
  761   1HD   LYS  98          1HD       LYS  98 -10.207  13.471  -0.065
  762   2HD   LYS  98          2HD       LYS  98  -8.766  13.552   0.968
  763   1HE   LYS  98          1HE       LYS  98  -8.879  15.775   1.254
  764   2HE   LYS  98          2HE       LYS  98  -9.965  16.085  -0.105
  765   1HZ   LYS  98          1HZ       LYS  98 -11.734  14.982   1.199
  766   2HZ   LYS  98          2HZ       LYS  98 -11.109  16.308   2.013
  767   3HZ   LYS  98          3HZ       LYS  98 -10.685  14.779   2.511
  768    H    PHE  99           H        PHE  99  -6.031  16.215  -2.073
  769    HA   PHE  99           HA       PHE  99  -6.689  17.904   0.136
  770   1HB   PHE  99          1HB       PHE  99  -3.993  17.204  -1.047
  771   2HB   PHE  99          2HB       PHE  99  -4.210  18.223   0.369
  772    HD1  PHE  99           1HD      PHE  99  -5.811  17.081   2.209
  773    HD2  PHE  99           2HD      PHE  99  -3.412  15.025  -0.641
  774    HE1  PHE  99           1HE      PHE  99  -5.684  15.139   3.715
  775    HE2  PHE  99           2HE      PHE  99  -3.330  13.052   0.893
  776    HZ   PHE  99           HZ       PHE  99  -4.535  13.149   3.029
  777    H    GLY 100           H        GLY 100  -5.149  18.450  -2.984
  778   1HA   GLY 100          1HA       GLY 100  -5.795  20.482  -4.144
  779   2HA   GLY 100          2HA       GLY 100  -5.680  21.304  -2.585
  780    H    ALA 101           H        ALA 101  -3.980  22.496  -2.537
  781    HA   ALA 101           HA       ALA 101  -1.647  21.941  -4.173
  782   1HB   ALA 101          1HB       ALA 101  -2.444  24.253  -3.826
  783   2HB   ALA 101          2HB       ALA 101  -0.775  24.020  -3.297
  784   3HB   ALA 101          3HB       ALA 101  -2.075  24.090  -2.109
  785    H    VAL 102           H        VAL 102  -2.430  21.953  -0.730
  786    HA   VAL 102           HA       VAL 102   0.174  20.656  -0.314
  787    HB   VAL 102           HB       VAL 102  -1.278  22.053   1.888
  788   1HG1  VAL 102          1HG1      VAL 102   1.625  21.583   1.444
  789   2HG1  VAL 102          2HG1      VAL 102   0.552  20.746   2.571
  790   3HG1  VAL 102          3HG1      VAL 102   0.939  22.452   2.817
  791   1HG2  VAL 102          1HG2      VAL 102  -0.058  24.148   1.495
  792   2HG2  VAL 102          2HG2      VAL 102  -1.230  23.740   0.234
  793   3HG2  VAL 102          3HG2      VAL 102   0.499  23.493  -0.056
  794    H    TYR 103           H        TYR 103   0.243  19.182   1.359
  795    HA   TYR 103           HA       TYR 103  -2.102  17.576   1.412
  796   1HB   TYR 103          1HB       TYR 103  -0.261  16.222   0.953
  797   2HB   TYR 103          2HB       TYR 103   0.789  17.134   2.027
  798    HD1  TYR 103           1HD      TYR 103  -2.442  15.410   2.650
  799    HD2  TYR 103           2HD      TYR 103   1.655  15.664   3.523
  800    HE1  TYR 103           1HE      TYR 103  -2.752  13.785   4.383
  801    HE2  TYR 103           2HE      TYR 103   1.378  13.952   5.306
  802    HH   TYR 103           HH       TYR 103  -0.342  13.177   6.757
  803    H    LYS 104           H        LYS 104  -3.466  18.313   2.722
  804    HA   LYS 104           HA       LYS 104  -2.771  18.931   5.507
  805   1HB   LYS 104          1HB       LYS 104  -5.198  19.595   3.859
  806   2HB   LYS 104          2HB       LYS 104  -4.968  20.076   5.522
  807   1HG   LYS 104          1HG       LYS 104  -3.123  21.521   4.891
  808   2HG   LYS 104          2HG       LYS 104  -3.214  20.943   3.226
  809   1HD   LYS 104          1HD       LYS 104  -5.483  22.329   4.642
  810   2HD   LYS 104          2HD       LYS 104  -4.305  23.174   3.635
  811   1HE   LYS 104          1HE       LYS 104  -4.994  21.901   1.699
  812   2HE   LYS 104          2HE       LYS 104  -6.058  20.902   2.670
  813   1HZ   LYS 104          1HZ       LYS 104  -7.466  22.727   3.102
  814   2HZ   LYS 104          2HZ       LYS 104  -7.226  22.692   1.436
  815   3HZ   LYS 104          3HZ       LYS 104  -6.413  23.836   2.370
  816    HA   PRO 105           HA       PRO 105  -4.806  14.755   5.617
  817   1HB   PRO 105          1HB       PRO 105  -3.889  14.131   8.129
  818   2HB   PRO 105          2HB       PRO 105  -3.006  13.786   6.637
  819   1HG   PRO 105          1HG       PRO 105  -2.730  16.033   8.533
  820   2HG   PRO 105          2HG       PRO 105  -1.454  15.097   7.673
  821   1HD   PRO 105          1HD       PRO 105  -2.211  17.587   6.955
  822   2HD   PRO 105          2HD       PRO 105  -1.704  16.387   5.749
  823    H    LYS 106           H        LYS 106  -4.857  17.269   8.046
  824    HA   LYS 106           HA       LYS 106  -7.164  16.614   9.433
  825   1HB   LYS 106          1HB       LYS 106  -7.590  19.018   9.701
  826   2HB   LYS 106          2HB       LYS 106  -5.901  18.623   9.973
  827   1HG   LYS 106          1HG       LYS 106  -5.354  19.401   7.723
  828   2HG   LYS 106          2HG       LYS 106  -7.047  19.783   7.441
  829   1HD   LYS 106          1HD       LYS 106  -5.387  20.908   9.624
  830   2HD   LYS 106          2HD       LYS 106  -5.613  21.732   8.069
  831   1HE   LYS 106          1HE       LYS 106  -7.697  21.077  10.172
  832   2HE   LYS 106          2HE       LYS 106  -7.131  22.682   9.732
  833   1HZ   LYS 106          1HZ       LYS 106  -8.100  22.093   7.409
  834   2HZ   LYS 106          2HZ       LYS 106  -9.163  22.465   8.654
  835   3HZ   LYS 106          3HZ       LYS 106  -8.945  20.880   8.234
  836    H    GLU 107           H        GLU 107  -6.869  17.258   6.153
  837    HA   GLU 107           HA       GLU 107  -9.749  17.412   5.757
  838   1HB   GLU 107          1HB       GLU 107  -7.484  18.906   4.422
  839   2HB   GLU 107          2HB       GLU 107  -9.079  18.777   3.697
  840   1HG   GLU 107          1HG       GLU 107 -10.077  20.045   5.376
  841   2HG   GLU 107          2HG       GLU 107  -8.738  19.832   6.482
  842    H    ASP 108           H        ASP 108  -8.017  15.078   5.954
  843    HA   ASP 108           HA       ASP 108  -7.569  14.194   3.254
  844   1HB   ASP 108          1HB       ASP 108  -6.816  12.064   4.090
  845   2HB   ASP 108          2HB       ASP 108  -6.169  13.279   5.159
  846    H    THR 109           H        THR 109  -8.524  11.590   3.203
  847    HA   THR 109           HA       THR 109 -11.059  12.049   2.105
  848    HB   THR 109           HB       THR 109  -9.740  10.192   1.292
  849    HG1  THR 109           1HG      THR 109 -12.277   9.760   2.309
  850   1HG2  THR 109          1HG2      THR 109  -8.621   9.595   3.403
  851   2HG2  THR 109          2HG2      THR 109  -9.331   8.171   2.635
  852   3HG2  THR 109          3HG2      THR 109 -10.134   8.930   4.014