*HEADER    STRUCTURAL GENOMICS, UNKNOWN FUNCTION   28-DEC-06   2JN6              
*TITLE     SOLUTION NMR STRUCTURE OF PROTEIN CGL2762 FROM                        
*TITLE    2 CORYNEBACTERIUM GLUTAMICUM: NORTHEAST STRUCTURAL GENOMICS            
*TITLE    3 CONSORTIUM TARGET CGR3                                               
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PROTEIN CGL2762;                                           
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: TRANSPOSASE;                                                
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: CORYNEBACTERIUM GLUTAMICUM;                     
*SOURCE   3 ORGANISM_COMMON: BACTERIA;                                           
*SOURCE   4 STRAIN: XL10;                                                        
*SOURCE   5 GENE: TNP8A ISCG8A;                                                  
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3)+MAGIC;                           
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE  10 EXPRESSION_SYSTEM_VECTOR: PET21                                      
*KEYWDS    GFT NMR, PSI-2, PROTEIN STRUCTURE, STRUCTURAL GENOMICS,               
*KEYWDS   2 PROTEIN STRUCTURE INITIATIVE, NORTHEAST STRUCTURAL GENOMICS          
*KEYWDS   3 CONSORTIUM, NESG                                                     
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    K.K.SINGARAPU, D.SUKUMARAN, D.PARISH, C.X.CHEN,                       
*AUTHOR   2 K.CUNNINGHAM, R.XIAO, G.V.T.SWAPNA, G.T.MONTELIONE,                  
*AUTHOR   3 T.SZYPERSKI, NORTHEAST STRUCTURAL GENOMICS CONSORTIUM (NESG)         
*REVDAT   1   22-MAY-07 2JN6    0                                    
  2 PRO  HA      3 THR  H       3.33 
  2 PRO  HG2     3 THR  H       5.50 
  2 PRO  HG3     3 THR  H       5.50 
  3 THR  H       3 THR  HB      3.64 
  3 THR  H       4 LYS  H       4.38 
  3 THR  HA      3 THR  HB      2.77 
  3 THR  HA      4 LYS  H       3.02 
  3 THR  HA      4 LYS  QB      5.26 
  3 THR  HB      4 LYS  H       3.64 
  3 THR  QG2     4 LYS  H       6.53 
  4 LYS  H       4 LYS  HB2     3.61 
  4 LYS  H       4 LYS  HB3     3.61 
  4 LYS  H       4 LYS  QB      3.33 
  4 LYS  H       4 LYS  HG2     5.38 
  4 LYS  H       4 LYS  HG3     5.38 
  4 LYS  H       4 LYS  QG      4.80 
  4 LYS  H       4 LYS  HD2     5.50 
  4 LYS  H       4 LYS  HD3     5.50 
  4 LYS  H       5 THR  H       3.89 
  4 LYS  HA      4 LYS  HD2     5.50 
  4 LYS  HA      4 LYS  HD3     5.50 
  4 LYS  HA      5 THR  H       3.14 
  4 LYS  HB2     5 THR  H       4.60 
  4 LYS  HB3     5 THR  H       4.60 
  4 LYS  HG2     5 THR  H       5.50 
  4 LYS  HG3     5 THR  H       5.50 
  4 LYS  QG      6 TYR  QE      8.51 
  4 LYS  HD2     5 THR  H       5.50 
  4 LYS  HD2     6 TYR  QE      7.63 
  4 LYS  HD3     5 THR  H       5.50 
  4 LYS  HD3     6 TYR  QE      7.63 
  4 LYS  QD      5 THR  H       5.26 
  4 LYS  QE      6 TYR  QE      8.51 
  5 THR  H       5 THR  HB      3.36 
  5 THR  H       6 TYR  H       4.69 
  5 THR  HA      6 TYR  H       3.08 
  5 THR  HA      6 TYR  QD      7.64 
  5 THR  HB      6 TYR  H       3.30 
  5 THR  QG2     6 TYR  H       6.47 
  6 TYR  H       6 TYR  HB2     3.67 
  6 TYR  H       6 TYR  HB3     3.67 
  6 TYR  H       6 TYR  QB      3.30 
  6 TYR  H       6 TYR  QE      7.63 
  6 TYR  H       7 SER  H       4.85 
  6 TYR  HA      7 SER  H       2.87 
  6 TYR  HB2     7 SER  H       4.82 
  6 TYR  HB2    10 PHE  HB2     7.25 
  6 TYR  HB2    10 PHE  HB3     7.25 
  6 TYR  HB2    10 PHE  QD      7.62 
  6 TYR  HB2    11 LYS  HG2     7.25 
  6 TYR  HB2    11 LYS  HG3     7.25 
  6 TYR  HB2    43 TRP  HZ2     5.50 
  6 TYR  HB3     7 SER  H       4.82 
  6 TYR  HB3    10 PHE  HB2     7.25 
  6 TYR  HB3    10 PHE  HB3     7.25 
  6 TYR  HB3    10 PHE  QD      7.62 
  6 TYR  HB3    11 LYS  HG2     7.25 
  6 TYR  HB3    11 LYS  HG3     7.25 
  6 TYR  HB3    43 TRP  HZ2     5.50 
  6 TYR  QB      7 SER  H       4.25 
  6 TYR  QB     10 PHE  QB      6.24 
  6 TYR  QB     11 LYS  QG      6.32 
  6 TYR  QD      7 SER  H       7.64 
  6 TYR  QD     10 PHE  QB      8.52 
  6 TYR  QD     10 PHE  QD      9.76 
  6 TYR  QD     35 ILE  QG2     8.67 
  6 TYR  QD     43 TRP  HZ2     7.36 
  6 TYR  QD     43 TRP  HH2     7.64 
  6 TYR  QE     11 LYS  HB3     7.63 
  6 TYR  QE     11 LYS  QD      8.51 
  6 TYR  QE     35 ILE  QG2     8.66 
  7 SER  H       7 SER  HB2     3.89 
  7 SER  H       7 SER  HB3     3.89 
  7 SER  H       7 SER  QB      3.60 
  7 SER  H      10 PHE  H       5.00 
  7 SER  H      10 PHE  HB2     4.97 
  7 SER  H      10 PHE  HB3     4.97 
  7 SER  H      10 PHE  QB      4.23 
  7 SER  HA      8 GLU  H       3.17 
  7 SER  HB2     8 GLU  H       3.98 
  7 SER  HB2     9 GLU  H       4.60 
  7 SER  HB3     8 GLU  H       3.98 
  7 SER  HB3     9 GLU  H       4.60 
  7 SER  QB      8 GLU  H       3.45 
  7 SER  QB      9 GLU  H       4.00 
  7 SER  QB      9 GLU  QB      7.25 
  7 SER  QB     10 PHE  H       5.70 
  8 GLU  H       8 GLU  HG2     4.63 
  8 GLU  H       8 GLU  HG3     4.63 
  8 GLU  H       8 GLU  QG      4.24 
  8 GLU  H       9 GLU  H       3.33 
  8 GLU  HA     11 LYS  H       4.14 
  8 GLU  HA     11 LYS  HB2     3.92 
  8 GLU  HA     11 LYS  HB3     4.94 
  8 GLU  HA     11 LYS  QG      6.38 
  8 GLU  HA     11 LYS  HD2     5.50 
  8 GLU  HA     11 LYS  HD3     5.50 
  8 GLU  HA     11 LYS  QD      5.02 
  8 GLU  HA     11 LYS  HE2     5.50 
  8 GLU  HA     11 LYS  HE3     5.50 
  8 GLU  HA     12 ARG  H       5.16 
  8 GLU  HG2     9 GLU  H       5.50 
  8 GLU  HG3     9 GLU  H       5.50 
  9 GLU  H       9 GLU  HB2     3.30 
  9 GLU  H       9 GLU  HB3     3.30 
  9 GLU  H       9 GLU  HG2     5.50 
  9 GLU  H       9 GLU  HG3     5.50 
  9 GLU  H      10 PHE  H       3.58 
  9 GLU  H      11 LYS  H       4.66 
  9 GLU  HA     12 ARG  H       4.23 
  9 GLU  HA     12 ARG  HB2     4.29 
  9 GLU  HA     12 ARG  HB3     4.29 
  9 GLU  HA     12 ARG  QB      3.82 
  9 GLU  HA     12 ARG  QG      6.38 
  9 GLU  HA     12 ARG  HD2     5.50 
  9 GLU  HA     12 ARG  HD3     5.50 
  9 GLU  HA     13 ASP  H       4.63 
  9 GLU  HB2    10 PHE  H       3.80 
  9 GLU  HB3    10 PHE  H       3.80 
  9 GLU  QG     10 PHE  H       6.38 
 10 PHE  H      10 PHE  HB2     3.86 
 10 PHE  H      10 PHE  HB3     3.86 
 10 PHE  H      10 PHE  QB      3.42 
 10 PHE  H      11 LYS  H       3.42 
 10 PHE  HA     13 ASP  H       4.07 
 10 PHE  HA     13 ASP  HB2     4.23 
 10 PHE  HA     13 ASP  HB3     4.23 
 10 PHE  HA     13 ASP  QB      3.79 
 10 PHE  HA     14 ALA  H       5.00 
 10 PHE  HA     33 LEU  QQD     8.10 
 10 PHE  HB2    11 LYS  H       5.16 
 10 PHE  HB3    11 LYS  H       5.16 
 10 PHE  QD     11 LYS  H       7.62 
 10 PHE  QD     11 LYS  HA      7.62 
 10 PHE  QD     14 ALA  QB      8.65 
 10 PHE  QD     33 LEU  QQD    10.22 
 10 PHE  QD     43 TRP  HZ3     7.62 
 10 PHE  QD     43 TRP  HH2     7.62 
 10 PHE  QE     14 ALA  QB      8.65 
 10 PHE  QE     33 LEU  QD1     8.65 
 10 PHE  QE     33 LEU  QD2     8.65 
 10 PHE  QE     35 ILE  QG2     8.65 
 10 PHE  QE     35 ILE  QD1     8.65 
 10 PHE  QE     43 TRP  HZ3     7.53 
 10 PHE  QE     43 TRP  HH2     7.62 
 10 PHE  HZ     33 LEU  QB      6.38 
 10 PHE  HZ     33 LEU  QQD     8.10 
 10 PHE  HZ     35 ILE  QG2     6.53 
 10 PHE  HZ     35 ILE  QD1     6.53 
 11 LYS  H      11 LYS  HB2     3.36 
 11 LYS  H      11 LYS  HB3     3.73 
 11 LYS  H      11 LYS  HG2     4.11 
 11 LYS  H      11 LYS  HG3     4.11 
 11 LYS  H      11 LYS  QG      3.90 
 11 LYS  H      11 LYS  HD2     5.50 
 11 LYS  H      11 LYS  HD3     5.50 
 11 LYS  H      11 LYS  QD      5.12 
 11 LYS  H      11 LYS  HE2     5.50 
 11 LYS  H      11 LYS  HE3     5.50 
 11 LYS  H      12 ARG  H       3.52 
 11 LYS  H      13 ASP  H       5.07 
 11 LYS  H      43 TRP  HE3     5.50 
 11 LYS  HA     11 LYS  HD2     5.50 
 11 LYS  HA     11 LYS  HD3     5.50 
 11 LYS  HA     11 LYS  HE2     5.50 
 11 LYS  HA     11 LYS  HE3     5.50 
 11 LYS  HA     13 ASP  H       4.97 
 11 LYS  HA     14 ALA  H       4.45 
 11 LYS  HA     14 ALA  QB      6.37 
 11 LYS  HA     15 VAL  H       4.54 
 11 LYS  HA     43 TRP  HE3     4.91 
 11 LYS  HA     43 TRP  HZ3     5.50 
 11 LYS  HB2    11 LYS  HE2     5.50 
 11 LYS  HB2    11 LYS  HE3     5.50 
 11 LYS  HB2    12 ARG  H       3.83 
 11 LYS  HB2    47 TYR  QD      7.64 
 11 LYS  HB2    47 TYR  QE      7.63 
 11 LYS  HB3    11 LYS  HE2     5.50 
 11 LYS  HB3    11 LYS  HE3     5.50 
 11 LYS  HB3    12 ARG  H       4.32 
 11 LYS  HB3    43 TRP  QB      6.38 
 11 LYS  HB3    43 TRP  HE3     5.50 
 11 LYS  HB3    47 TYR  QD      7.64 
 11 LYS  HB3    47 TYR  QE      7.63 
 11 LYS  HG2    12 ARG  H       5.50 
 11 LYS  HG3    12 ARG  H       5.50 
 11 LYS  QG     43 TRP  HE1     6.38 
 11 LYS  HD2    43 TRP  HD1     5.50 
 11 LYS  HD2    43 TRP  HE1     5.50 
 11 LYS  HD2    47 TYR  QE      7.63 
 11 LYS  HD3    43 TRP  HD1     5.50 
 11 LYS  HD3    43 TRP  HE1     5.50 
 11 LYS  HD3    47 TYR  QE      7.63 
 11 LYS  QD     12 ARG  H       6.38 
 11 LYS  QD     47 TYR  QE      7.47 
 11 LYS  HE2    43 TRP  HE1     5.31 
 11 LYS  HE2    43 TRP  HZ2     5.50 
 11 LYS  HE3    43 TRP  HE1     5.31 
 11 LYS  HE3    43 TRP  HZ2     5.50 
 11 LYS  QE     43 TRP  HE1     5.05 
 12 ARG  H      12 ARG  HB2     3.70 
 12 ARG  H      12 ARG  HB3     3.70 
 12 ARG  H      12 ARG  QB      3.41 
 12 ARG  H      12 ARG  HG2     5.19 
 12 ARG  H      12 ARG  HG3     5.19 
 12 ARG  H      12 ARG  QG      4.60 
 12 ARG  H      12 ARG  HD2     5.50 
 12 ARG  H      12 ARG  HD3     5.50 
 12 ARG  H      13 ASP  H       3.52 
 12 ARG  HA     12 ARG  HD2     5.50 
 12 ARG  HA     12 ARG  HD3     5.50 
 12 ARG  HA     15 VAL  H       3.98 
 12 ARG  HA     15 VAL  HB      3.64 
 12 ARG  HA     15 VAL  QQG     8.09 
 12 ARG  HA     16 ALA  H       4.76 
 12 ARG  HA     47 TYR  QB      6.38 
 12 ARG  HB2    13 ASP  H       4.11 
 12 ARG  HB3    13 ASP  H       4.11 
 12 ARG  QB     13 ASP  H       3.78 
 12 ARG  HG2    13 ASP  H       5.50 
 12 ARG  HG2    47 TYR  QD      7.64 
 12 ARG  HG3    13 ASP  H       5.50 
 12 ARG  HG3    47 TYR  QD      7.64 
 13 ASP  H      13 ASP  HB2     3.73 
 13 ASP  H      13 ASP  HB3     3.73 
 13 ASP  H      13 ASP  QB      3.35 
 13 ASP  HA     16 ALA  H       3.36 
 13 ASP  HA     16 ALA  QB      5.04 
 13 ASP  HA     17 LEU  H       4.51 
 13 ASP  HA     17 LEU  QQD     8.10 
 13 ASP  HB2    14 ALA  H       4.41 
 13 ASP  HB2    16 ALA  QB      6.53 
 13 ASP  HB2    33 LEU  QD1     9.67 
 13 ASP  HB2    33 LEU  QD2     9.67 
 13 ASP  HB3    14 ALA  H       4.41 
 13 ASP  HB3    16 ALA  QB      6.53 
 13 ASP  HB3    33 LEU  QD1     9.67 
 13 ASP  HB3    33 LEU  QD2     9.67 
 13 ASP  QB     14 ALA  H       4.11 
 13 ASP  QB     33 LEU  QQD     8.05 
 14 ALA  H      15 VAL  H       3.17 
 14 ALA  H      15 VAL  QQG     8.09 
 14 ALA  H      17 LEU  QQD     8.10 
 14 ALA  H      43 TRP  HZ3     5.50 
 14 ALA  HA     16 ALA  H       5.50 
 14 ALA  HA     17 LEU  H       4.35 
 14 ALA  HA     17 LEU  HB2     3.92 
 14 ALA  HA     17 LEU  HB3     3.92 
 14 ALA  HA     17 LEU  QB      3.74 
 14 ALA  HA     17 LEU  HG      5.50 
 14 ALA  HA     17 LEU  QD1     6.53 
 14 ALA  HA     17 LEU  QD2     6.53 
 14 ALA  HA     17 LEU  QQD     5.64 
 14 ALA  HA     33 LEU  QD1     6.53 
 14 ALA  HA     33 LEU  QD2     6.53 
 14 ALA  HA     40 LEU  QD1     6.53 
 14 ALA  QB     15 VAL  HA      6.53 
 14 ALA  QB     33 LEU  QQD     9.13 
 14 ALA  QB     40 LEU  QD1     7.56 
 14 ALA  QB     40 LEU  QD2     7.56 
 14 ALA  QB     43 TRP  HE3     5.44 
 14 ALA  QB     43 TRP  HZ3     5.94 
 15 VAL  H      15 VAL  HB      2.93 
 15 VAL  H      16 ALA  H       3.02 
 15 VAL  H      16 ALA  QB      6.53 
 15 VAL  H      44 ILE  HA      5.19 
 15 VAL  HA     18 TYR  H       3.89 
 15 VAL  HA     18 TYR  HB2     4.38 
 15 VAL  HA     18 TYR  HB3     4.38 
 15 VAL  HA     18 TYR  QB      3.96 
 15 VAL  HA     18 TYR  QD      7.64 
 15 VAL  HA     19 GLU  H       5.34 
 15 VAL  HA     40 LEU  QD1     6.00 
 15 VAL  HA     44 ILE  HG12    5.50 
 15 VAL  HA     44 ILE  HG13    5.50 
 15 VAL  HA     44 ILE  QG1     4.89 
 15 VAL  HA     44 ILE  QD1     6.53 
 15 VAL  HB     16 ALA  H       2.77 
 15 VAL  HB     47 TYR  QB      6.38 
 15 VAL  HB     48 GLY  H       5.50 
 15 VAL  QG1    16 ALA  H       6.53 
 15 VAL  QG1    19 GLU  HG2     9.65 
 15 VAL  QG1    19 GLU  HG3     9.65 
 15 VAL  QG1    43 TRP  HB2     9.65 
 15 VAL  QG1    43 TRP  HB3     9.65 
 15 VAL  QG1    44 ILE  H       6.53 
 15 VAL  QG1    44 ILE  HA      5.57 
 15 VAL  QG1    44 ILE  HG12    8.28 
 15 VAL  QG1    44 ILE  HG13    8.28 
 15 VAL  QG1    44 ILE  QD1     7.56 
 15 VAL  QG1    47 TYR  H       6.53 
 15 VAL  QG1    47 TYR  HB2     6.53 
 15 VAL  QG1    47 TYR  HB3     6.53 
 15 VAL  QG1    47 TYR  QD      8.67 
 15 VAL  QG1    48 GLY  H       6.53 
 15 VAL  QG1    48 GLY  HA2     6.53 
 15 VAL  QG1    48 GLY  HA3     6.53 
 15 VAL  QG2    16 ALA  H       6.53 
 15 VAL  QG2    19 GLU  HG2     9.65 
 15 VAL  QG2    19 GLU  HG3     9.65 
 15 VAL  QG2    43 TRP  HB2     9.65 
 15 VAL  QG2    43 TRP  HB3     9.65 
 15 VAL  QG2    44 ILE  H       6.53 
 15 VAL  QG2    44 ILE  HA      5.57 
 15 VAL  QG2    44 ILE  HG12    8.28 
 15 VAL  QG2    44 ILE  HG13    8.28 
 15 VAL  QG2    44 ILE  QD1     7.56 
 15 VAL  QG2    47 TYR  H       6.53 
 15 VAL  QG2    47 TYR  HB2     6.53 
 15 VAL  QG2    47 TYR  HB3     6.53 
 15 VAL  QG2    47 TYR  QD      8.67 
 15 VAL  QG2    48 GLY  H       6.53 
 15 VAL  QG2    48 GLY  HA2     6.53 
 15 VAL  QG2    48 GLY  HA3     6.53 
 15 VAL  QQG    16 ALA  HA      8.09 
 15 VAL  QQG    18 TYR  QD     10.23 
 15 VAL  QQG    19 GLU  H       8.09 
 15 VAL  QQG    19 GLU  QG      8.01 
 15 VAL  QQG    40 LEU  QD1     9.12 
 15 VAL  QQG    43 TRP  HA      8.09 
 15 VAL  QQG    43 TRP  QB      7.44 
 15 VAL  QQG    43 TRP  HE3     8.09 
 15 VAL  QQG    44 ILE  HA      5.14 
 15 VAL  QQG    44 ILE  QG1     6.74 
 15 VAL  QQG    47 TYR  QB      5.89 
 15 VAL  QQG    47 TYR  QE     10.22 
 15 VAL  QQG    48 GLY  QA      5.96 
 15 VAL  QQG    49 SER  H       8.09 
 16 ALA  H      16 ALA  HA      2.90 
 16 ALA  H      17 LEU  H       3.76 
 16 ALA  HA     19 GLU  H       3.98 
 16 ALA  HA     19 GLU  QB      4.24 
 16 ALA  HA     19 GLU  HG2     5.50 
 16 ALA  HA     19 GLU  HG3     5.50 
 16 ALA  HA     20 ASN  HD21    5.50 
 16 ALA  HA     20 ASN  HD22    5.50 
 16 ALA  QB     17 LEU  HA      6.53 
 16 ALA  QB     19 GLU  H       6.53 
 16 ALA  QB     19 GLU  QB      7.41 
 16 ALA  QB     19 GLU  QG      7.41 
 16 ALA  QB     20 ASN  QB      7.41 
 16 ALA  QB     20 ASN  HD21    6.53 
 16 ALA  QB     20 ASN  HD22    6.53 
 17 LEU  H      17 LEU  HB2     3.67 
 17 LEU  H      17 LEU  HB3     3.67 
 17 LEU  H      17 LEU  QB      3.39 
 17 LEU  H      17 LEU  HG      4.91 
 17 LEU  H      17 LEU  QD1     6.53 
 17 LEU  H      17 LEU  QD2     6.53 
 17 LEU  HA     17 LEU  QD1     6.53 
 17 LEU  HA     17 LEU  QD2     6.53 
 17 LEU  HA     20 ASN  H       4.11 
 17 LEU  HA     20 ASN  HB2     4.66 
 17 LEU  HA     20 ASN  HB3     4.66 
 17 LEU  HA     20 ASN  QB      4.19 
 17 LEU  HB2    18 TYR  H       3.76 
 17 LEU  HB3    18 TYR  H       3.76 
 17 LEU  QB     18 TYR  H       3.47 
 17 LEU  QB     29 ILE  QD1     7.41 
 17 LEU  HG     18 TYR  H       5.22 
 17 LEU  QD1    18 TYR  H       6.53 
 17 LEU  QD1    32 ASP  HB2     6.53 
 17 LEU  QD1    32 ASP  HB3     6.53 
 17 LEU  QD2    18 TYR  H       6.53 
 17 LEU  QD2    32 ASP  HB2     6.53 
 17 LEU  QD2    32 ASP  HB3     6.53 
 18 TYR  H      18 TYR  HB2     3.36 
 18 TYR  H      18 TYR  HB3     3.36 
 18 TYR  H      18 TYR  QE      7.63 
 18 TYR  H      19 GLU  H       3.21 
 18 TYR  H      19 GLU  QG      6.26 
 18 TYR  HA     29 ILE  QG2     6.53 
 18 TYR  HA     29 ILE  HG12    5.50 
 18 TYR  HA     29 ILE  HG13    5.50 
 18 TYR  HA     29 ILE  QG1     4.99 
 18 TYR  HA     29 ILE  QD1     6.50 
 18 TYR  HB2    19 GLU  H       4.04 
 18 TYR  HB2    29 ILE  QG2     6.53 
 18 TYR  HB2    29 ILE  QD1     6.53 
 18 TYR  HB2    44 ILE  QD1     6.53 
 18 TYR  HB3    19 GLU  H       4.04 
 18 TYR  HB3    29 ILE  QG2     6.53 
 18 TYR  HB3    29 ILE  QD1     6.53 
 18 TYR  HB3    44 ILE  QD1     6.53 
 18 TYR  QB     19 GLU  H       3.62 
 18 TYR  QB     40 LEU  QD1     7.41 
 18 TYR  QB     40 LEU  QD2     7.41 
 18 TYR  QB     41 LYS  QG      6.78 
 18 TYR  QD     19 GLU  H       7.64 
 18 TYR  QD     19 GLU  HA      7.64 
 18 TYR  QD     19 GLU  HG2     7.64 
 18 TYR  QD     19 GLU  HG3     7.64 
 18 TYR  QD     24 ALA  QB      8.67 
 18 TYR  QD     26 LEU  HA      7.64 
 18 TYR  QD     26 LEU  QB      8.52 
 18 TYR  QD     26 LEU  HG      7.64 
 18 TYR  QD     26 LEU  QD1     8.67 
 18 TYR  QD     26 LEU  QD2     8.67 
 18 TYR  QD     29 ILE  HB      7.64 
 18 TYR  QD     29 ILE  QG2     8.67 
 18 TYR  QD     29 ILE  HG12    7.64 
 18 TYR  QD     29 ILE  HG13    7.64 
 18 TYR  QD     29 ILE  QD1     8.67 
 18 TYR  QD     44 ILE  QG2     8.67 
 18 TYR  QD     44 ILE  QD1     8.67 
 18 TYR  QE     19 GLU  H       7.63 
 18 TYR  QE     26 LEU  H       7.63 
 18 TYR  QE     26 LEU  HA      7.63 
 18 TYR  QE     26 LEU  HB2     7.63 
 18 TYR  QE     26 LEU  HB3     7.63 
 18 TYR  QE     26 LEU  HG      7.63 
 18 TYR  QE     26 LEU  QD1     8.66 
 18 TYR  QE     26 LEU  QD2     8.66 
 18 TYR  QE     29 ILE  QG2     8.66 
 18 TYR  QE     29 ILE  QD1     8.66 
 18 TYR  QE     44 ILE  QG2     8.66 
 18 TYR  QE     44 ILE  QD1     8.66 
 19 GLU  H      19 GLU  HB2     3.73 
 19 GLU  H      19 GLU  HB3     3.73 
 19 GLU  H      19 GLU  QB      3.50 
 19 GLU  H      19 GLU  HG2     4.04 
 19 GLU  H      19 GLU  HG3     4.04 
 19 GLU  H      19 GLU  QG      3.80 
 19 GLU  H      20 ASN  H       3.33 
 19 GLU  H      21 SER  H       5.28 
 19 GLU  H      29 ILE  QG2     6.53 
 19 GLU  HA     21 SER  H       4.54 
 19 GLU  HB2    20 ASN  H       4.11 
 19 GLU  HB2    20 ASN  HD21    7.25 
 19 GLU  HB2    20 ASN  HD22    7.25 
 19 GLU  HB3    20 ASN  H       4.11 
 19 GLU  HB3    20 ASN  HD21    7.25 
 19 GLU  HB3    20 ASN  HD22    7.25 
 19 GLU  QB     20 ASN  H       3.93 
 19 GLU  QB     20 ASN  QD2     6.32 
 19 GLU  QG     20 ASN  H       6.38 
 20 ASN  H      20 ASN  HB2     3.58 
 20 ASN  H      20 ASN  HB3     3.58 
 20 ASN  H      20 ASN  QB      3.34 
 20 ASN  H      20 ASN  HD21    5.50 
 20 ASN  H      20 ASN  HD22    5.50 
 20 ASN  H      20 ASN  QD2     5.14 
 20 ASN  H      21 SER  H       3.52 
 20 ASN  H      21 SER  HA      5.31 
 20 ASN  HA     20 ASN  HD21    5.50 
 20 ASN  HA     20 ASN  HD22    5.50 
 20 ASN  HA     21 SER  H       3.58 
 20 ASN  HA     22 ASP  H       4.14 
 20 ASN  HB2    21 SER  H       4.60 
 20 ASN  HB3    21 SER  H       4.60 
 20 ASN  QB     21 SER  H       4.38 
 21 SER  H      21 SER  HB2     3.95 
 21 SER  H      21 SER  HB3     3.45 
 21 SER  H      22 ASP  H       3.98 
 21 SER  HA     22 ASP  H       3.45 
 21 SER  HA     29 ILE  QD1     6.53 
 21 SER  HB2    22 ASP  H       4.48 
 21 SER  HB2    24 ALA  H       4.23 
 21 SER  HB2    29 ILE  QG1     6.38 
 21 SER  HB2    29 ILE  QD1     6.12 
 21 SER  HB3    22 ASP  H       4.17 
 21 SER  HB3    24 ALA  QB      6.31 
 22 ASP  H      22 ASP  HB2     3.61 
 22 ASP  H      22 ASP  HB3     3.61 
 22 ASP  H      22 ASP  QB      3.42 
 22 ASP  H      23 GLY  H       4.07 
 22 ASP  H      24 ALA  QB      6.53 
 22 ASP  HA     23 GLY  H       3.42 
 22 ASP  HA     23 GLY  QA      5.29 
 22 ASP  HB2    23 GLY  H       4.48 
 22 ASP  HB3    23 GLY  H       4.48 
 22 ASP  QB     24 ALA  H       6.13 
 23 GLY  H      24 ALA  H       3.08 
 23 GLY  H      24 ALA  QB      6.53 
 24 ALA  H      25 SER  H       4.07 
 24 ALA  HA     25 SER  H       3.02 
 24 ALA  HA     28 GLN  HB2     5.00 
 24 ALA  QB     28 GLN  HB2     6.53 
 24 ALA  QB     28 GLN  HB3     6.53 
 24 ALA  QB     28 GLN  QG      7.41 
 24 ALA  QB     29 ILE  H       6.53 
 24 ALA  QB     29 ILE  HA      6.53 
 24 ALA  QB     29 ILE  QG2     7.56 
 24 ALA  QB     29 ILE  QG1     7.41 
 24 ALA  QB     29 ILE  QD1     7.56 
 24 ALA  QB     30 ALA  H       6.53 
 25 SER  H      25 SER  HB2     3.58 
 25 SER  H      25 SER  HB3     3.58 
 25 SER  H      25 SER  QB      3.30 
 25 SER  H      26 LEU  H       5.25 
 25 SER  H      28 GLN  HB2     3.95 
 25 SER  HA     26 LEU  H       3.02 
 25 SER  HA     26 LEU  QB      5.95 
 25 SER  HA     28 GLN  H       5.44 
 25 SER  HB2    26 LEU  H       4.14 
 25 SER  HB2    28 GLN  HB2     5.50 
 25 SER  HB2    28 GLN  HB3     5.50 
 25 SER  HB3    26 LEU  H       4.14 
 25 SER  HB3    28 GLN  HB2     5.50 
 25 SER  HB3    28 GLN  HB3     5.50 
 25 SER  QB     26 LEU  H       3.69 
 25 SER  QB     26 LEU  QB      7.25 
 25 SER  QB     27 GLN  QB      7.25 
 26 LEU  H      26 LEU  HB2     3.30 
 26 LEU  H      26 LEU  HB3     3.30 
 26 LEU  H      26 LEU  QB      3.10 
 26 LEU  H      26 LEU  HG      4.57 
 26 LEU  H      26 LEU  QD1     6.53 
 26 LEU  H      26 LEU  QD2     6.53 
 26 LEU  H      27 GLN  H       3.49 
 26 LEU  HA     26 LEU  QD1     6.09 
 26 LEU  HA     26 LEU  QD2     6.00 
 26 LEU  HA     30 ALA  QB      6.53 
 26 LEU  HA     40 LEU  QB      6.38 
 26 LEU  HA     40 LEU  QD2     6.53 
 26 LEU  HB2    27 GLN  H       3.76 
 26 LEU  HB3    27 GLN  H       3.76 
 26 LEU  QB     27 GLN  H       3.55 
 26 LEU  QB     27 GLN  HA      5.26 
 26 LEU  HG     27 GLN  H       5.50 
 26 LEU  HG     40 LEU  QD2     6.53 
 26 LEU  HG     44 ILE  QD1     6.53 
 26 LEU  QD1    27 GLN  H       6.53 
 26 LEU  QD1    41 LYS  H       6.53 
 26 LEU  QD1    41 LYS  HA      6.53 
 26 LEU  QD1    41 LYS  HB2     6.53 
 26 LEU  QD1    41 LYS  HB3     6.53 
 26 LEU  QD1    41 LYS  QG      7.38 
 26 LEU  QD1    44 ILE  QD1     7.56 
 26 LEU  QD2    27 GLN  H       6.53 
 26 LEU  QD2    37 ARG  HA      6.53 
 26 LEU  QD2    37 ARG  QD      7.41 
 26 LEU  QD2    41 LYS  H       6.53 
 26 LEU  QD2    41 LYS  HA      6.53 
 26 LEU  QD2    41 LYS  HB2     6.53 
 26 LEU  QD2    41 LYS  HB3     6.53 
 26 LEU  QD2    41 LYS  QG      7.04 
 27 GLN  H      27 GLN  HB2     3.24 
 27 GLN  H      27 GLN  HB3     3.24 
 27 GLN  H      27 GLN  QB      2.98 
 27 GLN  H      27 GLN  HG2     4.94 
 27 GLN  H      27 GLN  HG3     4.94 
 27 GLN  H      27 GLN  QG      4.62 
 27 GLN  H      28 GLN  H       3.30 
 27 GLN  H      37 ARG  QD      6.38 
 27 GLN  HA     27 GLN  HE21    5.50 
 27 GLN  HA     27 GLN  HE22    5.50 
 27 GLN  HA     27 GLN  QE2     5.04 
 27 GLN  HA     30 ALA  QB      5.60 
 27 GLN  HA     31 ASN  H       4.17 
 27 GLN  HA     37 ARG  HB2     5.50 
 27 GLN  HA     37 ARG  HB3     5.50 
 27 GLN  HA     37 ARG  QB      5.11 
 27 GLN  HA     37 ARG  QG      6.38 
 27 GLN  HA     37 ARG  QD      5.85 
 27 GLN  HB2    27 GLN  HE21    7.23 
 27 GLN  HB2    27 GLN  HE22    7.23 
 27 GLN  HB2    28 GLN  H       3.95 
 27 GLN  HB3    27 GLN  HE21    7.23 
 27 GLN  HB3    27 GLN  HE22    7.23 
 27 GLN  HB3    28 GLN  H       3.95 
 27 GLN  HG2    28 GLN  H       5.50 
 27 GLN  HG2    31 ASN  HD21    5.50 
 27 GLN  HG2    31 ASN  HD22    5.50 
 27 GLN  HG3    28 GLN  H       5.50 
 27 GLN  HG3    31 ASN  HD21    5.50 
 27 GLN  HG3    31 ASN  HD22    5.50 
 27 GLN  QG     28 GLN  H       4.98 
 27 GLN  QG     31 ASN  H       6.38 
 27 GLN  QG     31 ASN  QD2     5.10 
 27 GLN  HE21   30 ALA  QB      6.53 
 27 GLN  HE22   30 ALA  QB      6.53 
 27 GLN  QE2    31 ASN  H       6.37 
 28 GLN  H      28 GLN  HB2     3.55 
 28 GLN  H      28 GLN  HB3     3.98 
 28 GLN  H      28 GLN  HG2     5.50 
 28 GLN  H      28 GLN  HG3     5.50 
 28 GLN  H      28 GLN  QG      5.23 
 28 GLN  HA     28 GLN  QE2     6.37 
 28 GLN  HA     31 ASN  H       4.01 
 28 GLN  HA     31 ASN  HB2     3.52 
 28 GLN  HA     31 ASN  HB3     3.83 
 28 GLN  HA     31 ASN  HD21    5.50 
 28 GLN  HA     31 ASN  HD22    5.50 
 28 GLN  HA     31 ASN  QD2     5.14 
 28 GLN  HA     32 ASP  H       4.76 
 28 GLN  HB2    28 GLN  HE21    5.50 
 28 GLN  HB2    28 GLN  HE22    5.50 
 28 GLN  HB2    29 ILE  H       3.92 
 28 GLN  HB3    29 ILE  H       3.61 
 28 GLN  HG2    29 ILE  H       5.50 
 28 GLN  HG3    29 ILE  H       5.50 
 28 GLN  QE2    32 ASP  QB      7.24 
 29 ILE  H      29 ILE  HB      3.14 
 29 ILE  H      29 ILE  HG12    4.38 
 29 ILE  H      29 ILE  HG13    4.38 
 29 ILE  H      29 ILE  QG1     4.19 
 29 ILE  H      29 ILE  QD1     6.53 
 29 ILE  H      30 ALA  H       3.17 
 29 ILE  H      31 ASN  H       4.17 
 29 ILE  H      40 LEU  QD1     6.53 
 29 ILE  H      40 LEU  QD2     6.53 
 29 ILE  HA     32 ASP  H       4.07 
 29 ILE  HA     32 ASP  HB2     4.20 
 29 ILE  HA     32 ASP  HB3     4.20 
 29 ILE  HA     32 ASP  QB      3.85 
 29 ILE  HA     33 LEU  H       5.28 
 29 ILE  HB     30 ALA  H       3.30 
 29 ILE  HB     40 LEU  QD2     6.43 
 29 ILE  QG2    30 ALA  H       6.53 
 29 ILE  QG2    32 ASP  H       6.53 
 29 ILE  HG12   30 ALA  H       5.50 
 29 ILE  HG13   30 ALA  H       5.50 
 29 ILE  QD1    30 ALA  H       6.53 
 29 ILE  QD1    32 ASP  H       6.53 
 30 ALA  H      40 LEU  QD2     6.53 
 30 ALA  HA     31 ASN  H       3.64 
 30 ALA  HA     32 ASP  H       5.03 
 30 ALA  HA     33 LEU  H       3.89 
 30 ALA  HA     33 LEU  HB2     4.63 
 30 ALA  HA     33 LEU  HB3     4.63 
 30 ALA  HA     33 LEU  QB      4.30 
 30 ALA  HA     33 LEU  QQD     8.10 
 30 ALA  HA     35 ILE  H       3.92 
 30 ALA  HA     35 ILE  HB      5.50 
 30 ALA  HA     35 ILE  QG2     6.53 
 30 ALA  HA     35 ILE  HG12    4.69 
 30 ALA  HA     35 ILE  HG13    4.69 
 30 ALA  HA     35 ILE  QD1     6.53 
 30 ALA  HA     40 LEU  QD1     6.53 
 30 ALA  HA     40 LEU  QD2     6.53 
 30 ALA  QB     31 ASN  HA      6.53 
 30 ALA  QB     32 ASP  H       6.53 
 30 ALA  QB     35 ILE  H       6.53 
 30 ALA  QB     35 ILE  QG1     7.38 
 30 ALA  QB     35 ILE  QD1     7.56 
 30 ALA  QB     36 ASN  HA      6.53 
 30 ALA  QB     37 ARG  H       6.53 
 30 ALA  QB     37 ARG  HA      5.04 
 30 ALA  QB     40 LEU  H       6.53 
 30 ALA  QB     40 LEU  HB2     6.53 
 30 ALA  QB     40 LEU  HB3     6.53 
 30 ALA  QB     40 LEU  QD1     7.56 
 30 ALA  QB     40 LEU  QD2     7.56 
 31 ASN  H      31 ASN  HB2     3.08 
 31 ASN  H      31 ASN  HB3     3.36 
 31 ASN  H      31 ASN  QD2     6.37 
 31 ASN  H      32 ASP  H       3.55 
 31 ASN  HA     31 ASN  HD21    5.50 
 31 ASN  HA     31 ASN  HD22    5.50 
 31 ASN  HA     34 GLY  H       4.26 
 31 ASN  HA     35 ILE  H       4.41 
 31 ASN  HB2    32 ASP  H       4.07 
 31 ASN  HB3    32 ASP  H       3.80 
 32 ASP  H      32 ASP  HB2     3.89 
 32 ASP  H      32 ASP  HB3     3.89 
 32 ASP  H      32 ASP  QB      3.62 
 32 ASP  H      33 LEU  H       3.21 
 32 ASP  HB2    33 LEU  H       4.04 
 32 ASP  HB3    33 LEU  H       4.04 
 32 ASP  QB     33 LEU  H       3.71 
 33 LEU  H      33 LEU  HB2     3.49 
 33 LEU  H      33 LEU  HB3     3.49 
 33 LEU  H      33 LEU  QB      3.30 
 33 LEU  H      33 LEU  HG      4.32 
 33 LEU  H      33 LEU  QD1     6.53 
 33 LEU  H      33 LEU  QD2     6.53 
 33 LEU  H      33 LEU  QQD     6.15 
 33 LEU  H      34 GLY  H       3.21 
 33 LEU  H      34 GLY  QA      6.13 
 33 LEU  HA     33 LEU  QD1     6.28 
 33 LEU  HA     33 LEU  QD2     6.28 
 33 LEU  HA     34 GLY  H       3.45 
 33 LEU  HB2    34 GLY  H       4.85 
 33 LEU  HB2    35 ILE  HG12    6.72 
 33 LEU  HB2    35 ILE  HG13    6.72 
 33 LEU  HB2    35 ILE  QD1     6.53 
 33 LEU  HB3    34 GLY  H       4.85 
 33 LEU  HB3    35 ILE  HG12    6.72 
 33 LEU  HB3    35 ILE  HG13    6.72 
 33 LEU  HB3    35 ILE  QD1     6.53 
 33 LEU  QB     34 GLY  H       4.60 
 33 LEU  QB     35 ILE  H       4.86 
 33 LEU  QB     35 ILE  QG2     7.41 
 33 LEU  QB     35 ILE  QG1     5.26 
 33 LEU  HG     34 GLY  H       5.50 
 33 LEU  QD1    34 GLY  H       6.53 
 33 LEU  QD1    35 ILE  QD1     7.56 
 33 LEU  QD2    34 GLY  H       6.53 
 33 LEU  QD2    35 ILE  QD1     7.56 
 34 GLY  H      35 ILE  H       3.24 
 34 GLY  H      35 ILE  QG2     6.53 
 34 GLY  H      35 ILE  QG1     6.19 
 34 GLY  H      35 ILE  QD1     6.53 
 35 ILE  H      35 ILE  HB      3.73 
 35 ILE  H      35 ILE  HG12    4.04 
 35 ILE  H      35 ILE  HG13    4.04 
 35 ILE  H      35 ILE  QG1     3.85 
 35 ILE  H      35 ILE  QD1     6.53 
 35 ILE  H      36 ASN  H       4.82 
 35 ILE  HA     36 ASN  H       3.08 
 35 ILE  HA     36 ASN  HB2     5.44 
 35 ILE  HA     36 ASN  HB3     5.44 
 35 ILE  HB     36 ASN  H       3.14 
 35 ILE  HB     39 THR  HB      4.85 
 35 ILE  HB     39 THR  QG2     6.53 
 35 ILE  QG2    36 ASN  H       6.50 
 35 ILE  QG2    39 THR  HB      6.53 
 35 ILE  QG2    39 THR  QG2     7.56 
 35 ILE  QG2    40 LEU  H       6.53 
 35 ILE  QG2    43 TRP  HZ3     6.53 
 35 ILE  QG2    43 TRP  HH2     6.53 
 35 ILE  HG12   36 ASN  H       5.50 
 35 ILE  HG13   36 ASN  H       5.50 
 35 ILE  QD1    36 ASN  H       6.53 
 35 ILE  QD1    39 THR  HB      6.53 
 35 ILE  QD1    40 LEU  H       6.53 
 35 ILE  QD1    40 LEU  HA      6.37 
 35 ILE  QD1    40 LEU  HB2     6.53 
 35 ILE  QD1    40 LEU  HB3     6.53 
 35 ILE  QD1    40 LEU  QD1     7.56 
 35 ILE  QD1    40 LEU  QD2     7.56 
 35 ILE  QD1    43 TRP  HZ3     6.16 
 35 ILE  QD1    43 TRP  HZ2     6.53 
 35 ILE  QD1    43 TRP  HH2     6.53 
 36 ASN  H      36 ASN  HB2     3.33 
 36 ASN  H      36 ASN  HB3     3.33 
 36 ASN  H      36 ASN  QB      3.12 
 36 ASN  H      36 ASN  HD21    5.50 
 36 ASN  H      36 ASN  HD22    5.50 
 36 ASN  H      37 ARG  H       4.72 
 36 ASN  H      39 THR  H       5.10 
 36 ASN  H      39 THR  HB      3.67 
 36 ASN  H      39 THR  QG2     6.53 
 36 ASN  HA     37 ARG  H       2.80 
 36 ASN  HA     38 VAL  H       4.04 
 36 ASN  HB2    37 ARG  H       4.07 
 36 ASN  HB2    38 VAL  H       4.60 
 36 ASN  HB2    39 THR  H       3.95 
 36 ASN  HB2    39 THR  HB      5.50 
 36 ASN  HB3    37 ARG  H       4.07 
 36 ASN  HB3    38 VAL  H       4.60 
 36 ASN  HB3    39 THR  H       3.95 
 36 ASN  HB3    39 THR  HB      5.50 
 36 ASN  QB     37 ARG  H       3.75 
 36 ASN  QB     38 VAL  H       4.38 
 36 ASN  QB     39 THR  H       3.73 
 36 ASN  HD21   37 ARG  H       5.50 
 36 ASN  HD21   37 ARG  HB2     7.23 
 36 ASN  HD21   37 ARG  HB3     7.23 
 36 ASN  HD22   37 ARG  H       5.50 
 36 ASN  HD22   37 ARG  HB2     7.23 
 36 ASN  HD22   37 ARG  HB3     7.23 
 36 ASN  QD2    37 ARG  QB      6.18 
 36 ASN  QD2    38 VAL  HB      6.37 
 37 ARG  H      37 ARG  HB2     3.39 
 37 ARG  H      37 ARG  HB3     3.39 
 37 ARG  H      37 ARG  HG2     5.50 
 37 ARG  H      37 ARG  HG3     5.50 
 37 ARG  H      37 ARG  QG      5.20 
 37 ARG  H      38 VAL  H       3.39 
 37 ARG  HA     40 LEU  H       4.01 
 37 ARG  HA     40 LEU  HB2     4.32 
 37 ARG  HA     40 LEU  HB3     4.32 
 37 ARG  HA     40 LEU  QB      4.02 
 37 ARG  HA     40 LEU  QD2     6.53 
 37 ARG  HA     41 LYS  H       4.97 
 37 ARG  HB2    38 VAL  H       3.98 
 37 ARG  HB3    38 VAL  H       3.98 
 37 ARG  QB     38 VAL  H       3.81 
 37 ARG  HG2    38 VAL  H       5.50 
 37 ARG  HG3    38 VAL  H       5.50 
 38 VAL  H      38 VAL  HB      2.99 
 38 VAL  H      39 THR  H       3.08 
 38 VAL  H      40 LEU  H       4.76 
 38 VAL  HA     39 THR  H       3.61 
 38 VAL  HA     41 LYS  H       3.67 
 38 VAL  HA     41 LYS  HB2     3.55 
 38 VAL  HA     41 LYS  HB3     3.55 
 38 VAL  HA     41 LYS  QG      6.16 
 38 VAL  HA     41 LYS  HD2     5.50 
 38 VAL  HA     41 LYS  HD3     5.50 
 38 VAL  HA     42 ASN  H       4.54 
 38 VAL  HB     39 THR  H       3.55 
 38 VAL  QG1    39 THR  H       6.53 
 38 VAL  QG2    39 THR  H       6.53 
 38 VAL  QQG    42 ASN  QD2     8.96 
 39 THR  H      39 THR  HB      3.08 
 39 THR  H      40 LEU  H       3.02 
 39 THR  HA     42 ASN  H       4.54 
 39 THR  HA     42 ASN  HB2     3.92 
 39 THR  HA     42 ASN  HB3     4.20 
 39 THR  HA     42 ASN  HD21    5.50 
 39 THR  HA     42 ASN  HD22    5.50 
 39 THR  HA     42 ASN  QD2     5.17 
 39 THR  HA     43 TRP  H       4.57 
 39 THR  HB     40 LEU  H       3.11 
 39 THR  QG2    40 LEU  H       6.53 
 39 THR  QG2    40 LEU  HA      6.53 
 39 THR  QG2    43 TRP  H       6.53 
 39 THR  QG2    43 TRP  HE1     5.10 
 39 THR  QG2    43 TRP  HZ3     6.53 
 39 THR  QG2    43 TRP  HZ2     6.53 
 39 THR  QG2    43 TRP  HH2     6.53 
 40 LEU  H      40 LEU  HB2     3.14 
 40 LEU  H      40 LEU  HB3     3.14 
 40 LEU  H      40 LEU  HG      5.50 
 40 LEU  H      40 LEU  QD1     6.53 
 40 LEU  H      40 LEU  QD2     6.53 
 40 LEU  H      41 LYS  H       3.17 
 40 LEU  H      41 LYS  QB      5.45 
 40 LEU  H      42 ASN  H       4.91 
 40 LEU  HA     40 LEU  QD1     5.10 
 40 LEU  HA     40 LEU  QD2     6.53 
 40 LEU  HA     42 ASN  H       4.97 
 40 LEU  HA     43 TRP  H       4.04 
 40 LEU  HA     43 TRP  HE3     5.50 
 40 LEU  HA     44 ILE  H       4.94 
 40 LEU  HB2    41 LYS  H       3.98 
 40 LEU  HB3    41 LYS  H       3.98 
 40 LEU  QB     41 LYS  H       3.81 
 40 LEU  HG     41 LYS  H       5.50 
 40 LEU  HG     44 ILE  H       5.50 
 40 LEU  HG     44 ILE  QD1     5.41 
 40 LEU  QD1    41 LYS  H       6.53 
 40 LEU  QD1    43 TRP  H       6.53 
 40 LEU  QD1    43 TRP  HB2     6.53 
 40 LEU  QD1    43 TRP  HB3     6.53 
 40 LEU  QD1    43 TRP  HE3     6.25 
 40 LEU  QD1    43 TRP  HZ3     6.53 
 40 LEU  QD1    44 ILE  H       6.53 
 40 LEU  QD1    44 ILE  QG1     7.41 
 40 LEU  QD1    44 ILE  QD1     7.56 
 40 LEU  QD2    41 LYS  H       6.53 
 40 LEU  QD2    44 ILE  QD1     7.56 
 41 LYS  H      41 LYS  HB2     3.11 
 41 LYS  H      41 LYS  HB3     3.11 
 41 LYS  H      41 LYS  HG2     5.50 
 41 LYS  H      41 LYS  HG3     5.50 
 41 LYS  H      41 LYS  QG      4.89 
 41 LYS  H      41 LYS  HD2     5.50 
 41 LYS  H      41 LYS  HD3     5.50 
 41 LYS  H      42 ASN  H       3.17 
 41 LYS  H      44 ILE  QD1     6.53 
 41 LYS  HA     41 LYS  HD2     5.50 
 41 LYS  HA     41 LYS  HD3     5.50 
 41 LYS  HA     42 ASN  H       3.52 
 41 LYS  HA     44 ILE  H       4.45 
 41 LYS  HA     44 ILE  HB      3.58 
 41 LYS  HA     44 ILE  QG1     5.60 
 41 LYS  HA     44 ILE  QD1     5.66 
 41 LYS  HB2    42 ASN  H       3.61 
 41 LYS  HB3    42 ASN  H       3.61 
 41 LYS  QB     42 ASN  H       3.36 
 41 LYS  QB     45 ILE  QD1     7.41 
 41 LYS  HG2    42 ASN  H       5.50 
 41 LYS  HG3    42 ASN  H       5.50 
 41 LYS  QG     44 ILE  QD1     7.41 
 41 LYS  QG     45 ILE  QD1     7.41 
 41 LYS  HD2    42 ASN  H       5.50 
 41 LYS  HD3    42 ASN  H       5.50 
 42 ASN  H      42 ASN  HB2     2.99 
 42 ASN  H      42 ASN  HB3     3.58 
 42 ASN  H      42 ASN  QD2     6.21 
 42 ASN  H      43 TRP  H       3.05 
 42 ASN  H      43 TRP  QB      5.79 
 42 ASN  H      44 ILE  H       4.72 
 42 ASN  H      45 ILE  QD1     6.53 
 42 ASN  HA     44 ILE  H       4.66 
 42 ASN  HA     45 ILE  H       3.89 
 42 ASN  HA     45 ILE  HB      3.42 
 42 ASN  HA     45 ILE  QG2     6.53 
 42 ASN  HA     45 ILE  HG12    5.50 
 42 ASN  HA     45 ILE  HG13    5.50 
 42 ASN  HA     45 ILE  QD1     5.60 
 42 ASN  HA     46 LYS  H       5.10 
 42 ASN  HB2    43 TRP  H       3.14 
 42 ASN  HB2    43 TRP  HD1     5.50 
 42 ASN  HB3    43 TRP  H       3.70 
 42 ASN  HB3    43 TRP  HD1     5.50 
 42 ASN  QD2    43 TRP  H       6.37 
 43 TRP  H      43 TRP  QB      3.71 
 43 TRP  H      43 TRP  HD1     4.91 
 43 TRP  H      44 ILE  H       3.21 
 43 TRP  HA     43 TRP  HD1     4.48 
 43 TRP  HA     46 LYS  H       3.95 
 43 TRP  HA     46 LYS  HB2     4.32 
 43 TRP  HA     46 LYS  HB3     4.32 
 43 TRP  HA     46 LYS  QB      4.06 
 43 TRP  HA     46 LYS  HD2     5.50 
 43 TRP  HA     46 LYS  HD3     5.50 
 43 TRP  HB2    44 ILE  H       4.23 
 43 TRP  HB2    47 TYR  QD      7.64 
 43 TRP  HB3    44 ILE  H       4.23 
 43 TRP  HB3    47 TYR  QD      7.64 
 43 TRP  QB     44 ILE  H       3.83 
 43 TRP  QB     47 TYR  QE      8.51 
 44 ILE  H      44 ILE  HB      3.02 
 44 ILE  H      44 ILE  HG12    4.63 
 44 ILE  H      44 ILE  HG13    4.63 
 44 ILE  H      44 ILE  QG1     3.97 
 44 ILE  H      44 ILE  QD1     6.53 
 44 ILE  H      45 ILE  H       3.14 
 44 ILE  H      46 LYS  H       4.41 
 44 ILE  HA     44 ILE  QD1     4.95 
 44 ILE  HA     47 TYR  H       4.17 
 44 ILE  HA     47 TYR  QB      5.82 
 44 ILE  HA     48 GLY  H       3.73 
 44 ILE  HA     48 GLY  QA      4.95 
 44 ILE  HB     45 ILE  H       3.58 
 44 ILE  QG2    45 ILE  H       6.53 
 44 ILE  QG2    48 GLY  H       6.53 
 44 ILE  QG2    48 GLY  HA2     6.53 
 44 ILE  QG2    48 GLY  HA3     6.53 
 44 ILE  HG12   45 ILE  H       5.50 
 44 ILE  HG13   45 ILE  H       5.50 
 44 ILE  QG1    45 ILE  H       5.37 
 44 ILE  QD1    45 ILE  H       6.53 
 45 ILE  H      45 ILE  HB      3.33 
 45 ILE  H      45 ILE  HG12    3.92 
 45 ILE  H      45 ILE  HG13    3.92 
 45 ILE  H      45 ILE  QG1     3.66 
 45 ILE  H      45 ILE  QD1     6.53 
 45 ILE  H      46 LYS  H       3.08 
 45 ILE  H      47 TYR  H       5.10 
 45 ILE  H      48 GLY  H       4.76 
 45 ILE  HB     46 LYS  H       3.30 
 45 ILE  QG2    46 LYS  H       6.53 
 45 ILE  QG2    46 LYS  HA      6.53 
 45 ILE  HG12   46 LYS  H       5.50 
 45 ILE  HG13   46 LYS  H       5.50 
 45 ILE  QD1    46 LYS  H       6.53 
 46 LYS  H      46 LYS  HB2     3.39 
 46 LYS  H      46 LYS  HB3     3.39 
 46 LYS  H      46 LYS  QB      3.13 
 46 LYS  H      46 LYS  HG2     5.50 
 46 LYS  H      46 LYS  HG3     5.50 
 46 LYS  H      46 LYS  HD2     5.50 
 46 LYS  H      46 LYS  HD3     5.50 
 46 LYS  H      46 LYS  QD      4.80 
 46 LYS  H      47 TYR  H       3.17 
 46 LYS  H      48 GLY  H       4.07 
 46 LYS  HA     46 LYS  QG      3.97 
 46 LYS  HA     46 LYS  HD2     5.50 
 46 LYS  HA     46 LYS  HD3     5.50 
 46 LYS  HB2    47 TYR  H       3.95 
 46 LYS  HB2    47 TYR  QD      7.64 
 46 LYS  HB2    47 TYR  QE      7.63 
 46 LYS  HB3    47 TYR  H       3.95 
 46 LYS  HB3    47 TYR  QD      7.64 
 46 LYS  HB3    47 TYR  QE      7.63 
 46 LYS  QB     47 TYR  H       3.70 
 46 LYS  HG2    47 TYR  H       5.50 
 46 LYS  HG3    47 TYR  H       5.50 
 46 LYS  QG     47 TYR  QD      8.52 
 46 LYS  QG     47 TYR  QE      8.51 
 46 LYS  HD2    47 TYR  H       5.50 
 46 LYS  HD2    47 TYR  QE      7.63 
 46 LYS  HD3    47 TYR  H       5.50 
 46 LYS  HD3    47 TYR  QE      7.63 
 46 LYS  QD     47 TYR  H       5.32 
 46 LYS  QD     47 TYR  QD      8.52 
 46 LYS  HE2    47 TYR  QE      7.63 
 46 LYS  HE3    47 TYR  QE      7.63 
 47 TYR  H      47 TYR  HB2     3.61 
 47 TYR  H      47 TYR  HB3     3.61 
 47 TYR  H      47 TYR  QB      3.28 
 47 TYR  H      47 TYR  QE      7.63 
 47 TYR  H      48 GLY  H       2.87 
 47 TYR  H      48 GLY  HA2     5.50 
 47 TYR  H      48 GLY  HA3     5.50 
 47 TYR  H      48 GLY  QA      5.32 
 47 TYR  HA     49 SER  H       4.85 
 47 TYR  HB2    48 GLY  H       4.48 
 47 TYR  HB3    48 GLY  H       4.48 
 47 TYR  QB     48 GLY  H       4.28 
 47 TYR  QD     48 GLY  H       7.64 
 48 GLY  H      49 SER  H       3.95 
 48 GLY  HA2    49 SER  H       3.55 
 48 GLY  HA3    49 SER  H       3.55 
 49 SER  H      49 SER  HB2     3.95 
 49 SER  H      49 SER  HB3     3.95 
 49 SER  H      49 SER  QB      3.70 
 49 SER  H      50 ASN  H       3.61 
 49 SER  HA     50 ASN  H       3.55 
 49 SER  HA     51 HIS  H       5.50 
 49 SER  HB2    50 ASN  H       4.11 
 49 SER  HB3    50 ASN  H       4.11 
 49 SER  QB     50 ASN  H       3.92 
 50 ASN  H      50 ASN  HB2     3.55 
 50 ASN  H      50 ASN  HB3     3.67 
 50 ASN  HB2    51 HIS  H       4.01 
 50 ASN  HB3    51 HIS  H       3.49 
 51 HIS  H      51 HIS  HB2     3.95 
 51 HIS  H      51 HIS  HB3     3.95 
 51 HIS  H      51 HIS  QB      3.65 
 51 HIS  HA     52 ASN  H       3.55 
 51 HIS  HB2    52 ASN  H       4.38 
 51 HIS  HB3    52 ASN  H       4.38 
 51 HIS  QB     52 ASN  H       4.11 
 52 ASN  H      52 ASN  HB2     3.42 
 52 ASN  H      52 ASN  HB3     3.42 
 52 ASN  H      52 ASN  QD2     6.37 
 52 ASN  H      53 VAL  H       3.70 
 52 ASN  HA     53 VAL  H       3.08 
 52 ASN  HB2    53 VAL  H       4.85 
 52 ASN  HB3    53 VAL  H       4.85 
 52 ASN  QB     53 VAL  H       4.42 
 53 VAL  H      53 VAL  HB      3.73 
 53 VAL  H      54 GLN  H       3.55 
 53 VAL  HA     54 GLN  H       3.58 
 53 VAL  HB     54 GLN  H       3.70 
 53 VAL  QG1    54 GLN  H       6.53 
 53 VAL  QG2    54 GLN  H       6.53 
 54 GLN  H      54 GLN  HB2     3.89 
 54 GLN  H      54 GLN  HB3     3.89 
 54 GLN  H      54 GLN  QB      3.47 
 54 GLN  H      54 GLN  HG2     5.50 
 54 GLN  H      54 GLN  HG3     5.50 
 54 GLN  H      54 GLN  QG      5.25 
 54 GLN  H      54 GLN  HE21    5.50 
 54 GLN  H      54 GLN  HE22    5.50 
 54 GLN  HA     55 GLY  H       3.02 
 54 GLN  HB2    55 GLY  H       4.66 
 54 GLN  HB3    55 GLY  H       4.66 
 54 GLN  QB     55 GLY  H       4.45 
 55 GLY  H      56 THR  H       4.04 
 55 GLY  HA2    56 THR  H       3.36 
 55 GLY  HA3    56 THR  H       3.36 
 56 THR  H      56 THR  HB      3.92 
 56 THR  H      57 THR  H       3.58 
 56 THR  HA     56 THR  HB      2.83 
 56 THR  HA     57 THR  H       2.99 
 56 THR  HB     57 THR  H       3.92 
 56 THR  QG2    57 THR  H       6.53 
 57 THR  H      57 THR  HB      3.98 
 57 THR  HA     58 PRO  HD2     3.64 
 57 THR  HA     58 PRO  HD3     3.64 
 57 THR  HA     58 PRO  QD      3.47 
 57 THR  HB     58 PRO  QD      5.42 
 57 THR  QG2    58 PRO  QD      7.41 
 58 PRO  HA     59 SER  H       3.39 
 58 PRO  QD     59 SER  H       5.59 
 58 PRO  QD     61 ALA  H       6.38 
 59 SER  HA     60 ALA  H       3.58 
 60 ALA  HA     61 ALA  H       3.39 
 61 ALA  H      62 VAL  H       3.67 
 61 ALA  HA     62 VAL  H       3.17 
 61 ALA  HA     64 GLU  H       5.44 
 61 ALA  HA     64 GLU  QB      4.86 
 61 ALA  HA     64 GLU  QG      6.38 
 62 VAL  H      62 VAL  HB      3.21 
 62 VAL  H      63 SER  H       3.80 
 62 VAL  HA     63 SER  H       3.42 
 62 VAL  HB     63 SER  H       3.61 
 62 VAL  QG1    63 SER  H       6.53 
 62 VAL  QG2    63 SER  H       6.53 
 63 SER  H      63 SER  HB2     3.64 
 63 SER  H      63 SER  HB3     3.64 
 63 SER  H      63 SER  QB      3.42 
 63 SER  H      64 GLU  H       4.04 
 63 SER  H      64 GLU  QG      6.38 
 63 SER  HA     64 GLU  H       3.55 
 63 SER  HA     65 ALA  H       5.44 
 63 SER  HB2    64 GLU  H       3.86 
 63 SER  HB3    64 GLU  H       3.86 
 63 SER  QB     64 GLU  H       3.66 
 63 SER  QB     65 ALA  H       4.92 
 63 SER  QB     66 GLU  H       5.08 
 64 GLU  H      64 GLU  HB2     3.02 
 64 GLU  H      64 GLU  HB3     3.02 
 64 GLU  H      64 GLU  QB      2.81 
 64 GLU  H      64 GLU  HG2     5.50 
 64 GLU  H      64 GLU  HG3     5.50 
 64 GLU  H      65 ALA  H       3.17 
 64 GLU  HA     65 ALA  H       3.36 
 64 GLU  HA     67 GLN  HE21    5.50 
 64 GLU  HA     67 GLN  HE22    5.50 
 64 GLU  HA     67 GLN  QE2     4.91 
 64 GLU  HG2    65 ALA  H       5.50 
 64 GLU  HG2    68 ILE  QG2     6.53 
 64 GLU  HG2    68 ILE  QD1     6.53 
 64 GLU  HG3    65 ALA  H       5.50 
 64 GLU  HG3    68 ILE  QG2     6.53 
 64 GLU  HG3    68 ILE  QD1     6.53 
 65 ALA  H      66 GLU  H       3.27 
 65 ALA  H      68 ILE  HB      4.66 
 65 ALA  HA     68 ILE  HB      3.58 
 65 ALA  HA     68 ILE  QG2     6.53 
 65 ALA  HA     68 ILE  QG1     6.38 
 65 ALA  HA     68 ILE  QD1     6.53 
 66 GLU  H      66 GLU  HB2     3.08 
 66 GLU  H      66 GLU  HB3     3.08 
 66 GLU  H      66 GLU  QB      2.88 
 66 GLU  H      67 GLN  H       3.33 
 66 GLU  HA     66 GLU  HG2     4.23 
 66 GLU  HA     66 GLU  HG3     4.23 
 66 GLU  HA     66 GLU  QG      3.86 
 66 GLU  HA     67 GLN  H       3.64 
 66 GLU  HB2    67 GLN  H       3.76 
 66 GLU  HB2    67 GLN  HE21    7.13 
 66 GLU  HB2    67 GLN  HE22    7.13 
 66 GLU  HB3    67 GLN  H       3.76 
 66 GLU  HB3    67 GLN  HE21    7.13 
 66 GLU  HB3    67 GLN  HE22    7.13 
 66 GLU  QB     67 GLN  QE2     5.95 
 67 GLN  H      67 GLN  HG2     4.76 
 67 GLN  H      67 GLN  HG3     4.76 
 67 GLN  H      67 GLN  QG      4.43 
 67 GLN  H      67 GLN  QE2     6.37 
 67 GLN  H      68 ILE  H       3.08 
 67 GLN  H      68 ILE  HB      4.66 
 67 GLN  H      68 ILE  QD1     6.53 
 67 GLN  HA     68 ILE  H       3.52 
 67 GLN  HG2    68 ILE  H       5.50 
 67 GLN  HG3    68 ILE  H       5.50 
 67 GLN  QG     68 ILE  QD1     7.41 
 68 ILE  H      68 ILE  HB      2.96 
 68 ILE  H      68 ILE  HG12    4.41 
 68 ILE  H      68 ILE  HG13    4.41 
 68 ILE  H      68 ILE  QG1     3.92 
 68 ILE  H      68 ILE  QD1     6.53 
 68 ILE  HA     68 ILE  HG12    4.23 
 68 ILE  HA     68 ILE  HG13    4.23 
 68 ILE  HA     69 ARG  H       3.61 
 68 ILE  HA     71 LEU  H       3.89 
 68 ILE  HA     71 LEU  QB      4.40 
 68 ILE  HA     72 LYS  H       4.01 
 68 ILE  HB     69 ARG  H       3.21 
 68 ILE  QG2    69 ARG  H       6.53 
 68 ILE  QG2    69 ARG  HA      6.53 
 68 ILE  QG2    70 GLN  H       6.53 
 68 ILE  QG1    69 ARG  H       6.38 
 68 ILE  QD1    69 ARG  H       6.53 
 69 ARG  H      69 ARG  HG2     5.50 
 69 ARG  H      69 ARG  HG3     5.50 
 69 ARG  H      69 ARG  QG      4.79 
 69 ARG  H      70 GLN  H       3.11 
 69 ARG  HA     69 ARG  HG2     4.26 
 69 ARG  HA     69 ARG  HG3     4.26 
 69 ARG  HA     70 GLN  H       3.49 
 69 ARG  HG2    70 GLN  H       5.19 
 69 ARG  HG3    70 GLN  H       5.19 
 69 ARG  QG     70 GLN  H       4.41 
 70 GLN  H      70 GLN  HB2     2.93 
 70 GLN  H      70 GLN  HB3     2.93 
 70 GLN  H      70 GLN  HG2     4.32 
 70 GLN  H      70 GLN  HG3     4.32 
 70 GLN  H      70 GLN  QG      4.03 
 70 GLN  HA     70 GLN  HB2     2.96 
 70 GLN  HA     70 GLN  HB3     2.96 
 70 GLN  HA     70 GLN  QB      2.70 
 70 GLN  HA     70 GLN  HG2     4.11 
 70 GLN  HA     70 GLN  HG3     4.11 
 70 GLN  HA     70 GLN  QG      3.87 
 70 GLN  HB2    71 LEU  H       3.45 
 70 GLN  HB3    71 LEU  H       3.45 
 70 GLN  QB     71 LEU  H       3.12 
 70 GLN  HG2    71 LEU  H       5.50 
 70 GLN  HG3    71 LEU  H       5.50 
 71 LEU  H      71 LEU  HB2     3.30 
 71 LEU  H      71 LEU  HB3     3.30 
 71 LEU  H      71 LEU  QB      2.97 
 71 LEU  H      71 LEU  QQD     8.10 
 71 LEU  HA     71 LEU  HG      4.01 
 71 LEU  HA     71 LEU  QD1     6.53 
 71 LEU  HA     71 LEU  QD2     6.53 
 71 LEU  HB2    72 LYS  H       3.95 
 71 LEU  HB3    72 LYS  H       3.95 
 71 LEU  QB     72 LYS  H       3.64 
 72 LYS  HA     73 LYS  H       3.49 
 74 GLU  HB2    75 ASN  H       4.45 
 74 GLU  HB3    75 ASN  H       4.45 
 74 GLU  QB     75 ASN  H       3.86 
 75 ASN  H      75 ASN  HB2     3.80 
 75 ASN  H      75 ASN  HB3     3.80 
 75 ASN  H      75 ASN  QB      3.48 
 75 ASN  H      76 ALA  H       4.63 
 75 ASN  HA     76 ALA  H       3.42 
 75 ASN  HB2    76 ALA  H       3.83 
 75 ASN  HB3    76 ALA  H       3.83 
 75 ASN  QB     76 ALA  H       3.63 
 76 ALA  H      76 ALA  HA      2.74 
 76 ALA  HA     77 LEU  H       3.42 
 77 LEU  H      77 LEU  HB2     3.45 
 77 LEU  H      77 LEU  HB3     3.45 
 77 LEU  H      77 LEU  QB      3.19 
 77 LEU  H      77 LEU  HG      3.49 
 77 LEU  H      77 LEU  QD1     6.53 
 77 LEU  H      77 LEU  QD2     6.53 
 77 LEU  HA     77 LEU  QD1     5.69 
 77 LEU  HA     77 LEU  QD2     5.69 
 79 ARG  HA     80 ALA  H       3.33 
 79 ARG  HB2    80 ALA  H       3.98 
 79 ARG  HB3    80 ALA  H       3.98 
 79 ARG  QB     80 ALA  H       3.79 
 80 ALA  HA     81 ARG  H       3.39 
 81 ARG  H      81 ARG  HB2     3.61 
 81 ARG  H      81 ARG  HB3     3.61 
 81 ARG  H      81 ARG  QB      3.22 
 81 ARG  H      81 ARG  HG2     3.95 
 81 ARG  H      81 ARG  HG3     3.95 
 81 ARG  H      81 ARG  QG      3.78 
 81 ARG  H      82 THR  H       3.76 
 81 ARG  HA     82 THR  H       3.33 
 81 ARG  HB2    82 THR  H       3.76 
 81 ARG  HB3    82 THR  H       3.76 
 81 ARG  HG2    82 THR  H       5.50 
 81 ARG  HG3    82 THR  H       5.50 
 82 THR  H      82 THR  HB      3.27 
 82 THR  H      83 ARG  H       3.36 
 82 THR  HA     83 ARG  H       3.36 
 82 THR  HB     83 ARG  H       3.89 
 82 THR  QG2    83 ARG  H       6.53 
 83 ARG  H      83 ARG  HB2     3.55 
 83 ARG  H      83 ARG  HB3     3.55 
 83 ARG  H      83 ARG  QB      3.33 
 83 ARG  H      83 ARG  HG2     4.63 
 83 ARG  H      83 ARG  HG3     4.63 
 83 ARG  H      83 ARG  QG      4.36 
 83 ARG  H      84 HIS  H       4.97 
 83 ARG  HA     83 ARG  QG      3.93 
 83 ARG  HA     84 HIS  H       2.90 
 83 ARG  HB2    84 HIS  H       4.17 
 83 ARG  HB3    84 HIS  H       4.17 
 83 ARG  QB     84 HIS  H       3.87 
 83 ARG  HG2    84 HIS  H       5.50 
 83 ARG  HG3    84 HIS  H       5.50 
 84 HIS  H      84 HIS  HB2     4.04 
 84 HIS  H      84 HIS  HB3     4.04 
 84 HIS  H      84 HIS  QB      3.69 
 84 HIS  H      85 PRO  HD2     5.50 
 84 HIS  H      85 PRO  HD3     5.50 
 84 HIS  HA     85 PRO  HD2     3.21 
 84 HIS  HA     85 PRO  HD3     3.21 
 85 PRO  HA     86 ALA  H       2.83 
 85 PRO  HB2    86 ALA  H       4.60 
 85 PRO  HB3    86 ALA  H       4.60 
 85 PRO  QB     86 ALA  H       4.36 
 85 PRO  QB     86 ALA  HA      5.70 
 85 PRO  HG2    86 ALA  H       5.50 
 85 PRO  HG3    86 ALA  H       5.50 
 85 PRO  HD2    86 ALA  H       5.50 
 85 PRO  HD3    86 ALA  H       5.50 
 86 ALA  HA     87 GLU  H       2.87 
 87 GLU  H      87 GLU  HB2     4.01 
 87 GLU  H      87 GLU  HB3     4.01 
 87 GLU  H      87 GLU  QB      3.55 
 87 GLU  HA     88 SER  H       3.55 
 87 GLU  HB2    88 SER  H       4.69 
 87 GLU  HB3    88 SER  H       4.69 
 88 SER  H      88 SER  HB2     3.80 
 88 SER  H      88 SER  HB3     3.80 
 88 SER  H      88 SER  QB      3.52 
 88 SER  HA     89 CYS  H       3.55 
 88 SER  HB2    89 CYS  H       4.29 
 88 SER  HB3    89 CYS  H       4.29 
 88 SER  QB     89 CYS  H       4.12 
 88 SER  QB     90 LEU  H       5.76 
 89 CYS  H      89 CYS  HB2     3.86 
 89 CYS  H      89 CYS  HB3     3.86 
 89 CYS  H      89 CYS  QB      3.65 
 89 CYS  H      90 LEU  H       3.73 
 89 CYS  HA     90 LEU  H       3.36 
 89 CYS  HB2    90 LEU  H       5.00 
 89 CYS  HB3    90 LEU  H       5.00 
 89 CYS  QB     90 LEU  H       4.69 
 90 LEU  H      90 LEU  HB2     4.17 
 90 LEU  H      90 LEU  HB3     4.17 
 90 LEU  H      90 LEU  QB      3.50 
 90 LEU  H      90 LEU  HG      5.50 
 90 LEU  H      90 LEU  QD1     6.53 
 90 LEU  H      90 LEU  QD2     6.53 
 90 LEU  HA     90 LEU  HG      4.04 
 90 LEU  QB     91 GLU  H       4.40 
 90 LEU  HG     91 GLU  H       3.83 
 92 HIS  HA     93 HIS  H       2.96 
 96 HIS  HA     97 HIS  H       3.39 
 97 HIS  H      97 HIS  HA      2.93 
 
  2 PRO   PSI	 -315.0    15.0
  2 PRO   PSI	 -235.0    65.0
  2 PRO   PSI	  -95.0   205.0
  3 THR   PHI	 -305.0   -25.0
  3 THR   PHI	 -195.0    65.0
  3 THR   CHI1     15.0   225.0
  3 THR   CHI1   -235.0   105.0
  3 THR   CHI21  -345.0   -15.0
  3 THR   CHI21  -105.0   225.0
  3 THR   PSI	  105.0   225.0
  4 LYS   PHI	   25.0   305.0
  4 LYS   PHI	 -195.0    85.0
  4 LYS   CHI1   -225.0   125.0
  4 LYS   CHI2   -335.0   -15.0
  4 LYS   PSI	 -145.0   135.0
  4 LYS   PSI	   -5.0   235.0
  5 THR   PHI	   25.0   325.0
  5 THR   PHI	 -175.0    55.0
  5 THR   CHI1   -355.0    -5.0
  5 THR   CHI1   -225.0    95.0
  5 THR   CHI1   -185.0   155.0
  5 THR   CHI1    -65.0   205.0
  5 THR   CHI21  -345.0   -15.0
  5 THR   CHI21  -105.0   225.0
  5 THR   PSI	 -235.0  -125.0
  6 TYR   PHI	 -325.0   -25.0
  6 TYR   PHI	 -205.0    75.0
  6 TYR   CHI1   -335.0     5.0
  6 TYR   PSI	   95.0   215.0
  7 SER   PHI	 -325.0   -25.0
  7 SER   PHI	 -205.0    95.0
  7 SER   CHI1   -195.0   145.0
  7 SER   PSI	 -225.0  -135.0
  8 GLU   PHI	  -69.0   -45.0
  8 GLU   CHI1   -335.0   -25.0
  8 GLU   CHI1   -225.0   115.0
  8 GLU   CHI1   -165.0   165.0
  8 GLU   CHI2   -345.0   -15.0
  8 GLU   PSI	  -51.0   -27.0
  9 GLU   PHI	  -75.0   -53.0
  9 GLU   CHI1   -195.0   -75.0
  9 GLU   CHI2   -345.0   -15.0
  9 GLU   PSI	  -53.0   -31.0
 10 PHE   PHI	  -75.0   -53.0
 10 PHE   CHI1   -325.0   -25.0
 10 PHE   PSI	  -55.0   -33.0
 11 LYS   PHI	  -75.0   -53.0
 11 LYS   CHI1   -325.0   -25.0
 11 LYS   CHI1   -145.0    95.0
 11 LYS   CHI2   -345.0   -15.0
 11 LYS   PSI	  -53.0   -31.0
 12 ARG   PHI	  -75.0   -53.0
 12 ARG   CHI1   -325.0   -25.0
 12 ARG   CHI1   -305.0    45.0
 12 ARG   CHI1   -215.0    95.0
 12 ARG   CHI1   -175.0   175.0
 12 ARG   CHI2   -345.0   -15.0
 12 ARG   PSI	  -59.0   -21.0
 13 ASP   PHI	  -77.0   -55.0
 13 ASP   CHI1   -345.0   -15.0
 13 ASP   PSI	  -49.0   -25.0
 14 ALA   PHI	  -83.0   -53.0
 14 ALA   PSI	  -51.0   -27.0
 15 VAL   PHI	  -75.0   -53.0
 15 VAL   CHI1    125.0   215.0
 15 VAL   PSI	  -57.0   -31.0
 16 ALA   PHI	  -73.0   -51.0
 16 ALA   PSI	  -53.0   -27.0
 17 LEU   PHI	  -75.0   -53.0
 17 LEU   CHI1   -185.0   -35.0
 17 LEU   PSI	  -53.0   -29.0
 18 TYR   PHI	  -73.0   -51.0
 18 TYR   CHI1   -325.0   -35.0
 18 TYR   CHI1   -275.0    65.0
 18 TYR   CHI1   -225.0   115.0
 18 TYR   PSI	  -69.0   -21.0
 19 GLU   PHI	  -79.0   -51.0
 19 GLU   CHI1   -335.0   -15.0
 19 GLU   CHI1   -135.0   105.0
 19 GLU   CHI2   -345.0   -15.0
 19 GLU   PSI	  -63.0   -19.0
 20 ASN   PHI	 -325.0   -25.0
 20 ASN   PHI	 -295.0    55.0
 20 ASN   PHI	 -195.0    75.0
 20 ASN   CHI1   -215.0    95.0
 20 ASN   CHI2   -165.0   155.0
 20 ASN   PSI	 -105.0   105.0
 21 SER   PHI	  -95.0   -41.0
 21 SER   PSI	  -65.0   -15.0
 22 ASP   PHI	  -87.0   -45.0
 22 ASP   CHI1   -345.0    -5.0
 22 ASP   PSI	  -81.0    15.0
 22 ASP   PSI	  -45.0   285.0
 23 GLY   PHI	 -335.0   -25.0
 23 GLY   PSI	 -105.0   105.0
 24 ALA   PHI	   25.0   315.0
 24 ALA   PHI	 -205.0    95.0
 24 ALA   PSI	    5.0   225.0
 24 ALA   PSI	 -165.0   165.0
 25 SER   PHI	 -103.0   -63.0
 25 SER   PSI	  137.0   187.0
 26 LEU   PHI	  -71.0   -49.0
 26 LEU   CHI1   -185.0   -75.0
 26 LEU   PSI	  -51.0   -23.0
 27 GLN   PHI	  -73.0   -51.0
 27 GLN   CHI1   -215.0  -125.0
 27 GLN   CHI2     15.0   325.0
 27 GLN   CHI2    -55.0   295.0
 27 GLN   PSI	  -53.0   -29.0
 28 GLN   PHI	  -79.0   -53.0
 28 GLN   CHI1   -295.0   -25.0
 28 GLN   CHI1   -225.0    95.0
 28 GLN   CHI2   -345.0   -15.0
 28 GLN   PSI	  -61.0   -23.0
 29 ILE   PHI	  -87.0   -45.0
 29 ILE   CHI1   -145.0    -5.0
 29 ILE   CHI21  -345.0   -15.0
 29 ILE   PSI	  -61.0   -31.0
 30 ALA   PHI	  -71.0   -51.0
 30 ALA   PSI	  -51.0   -29.0
 31 ASN   PHI	  -75.0   -53.0
 31 ASN   CHI1   -215.0   -25.0
 31 ASN   CHI2   -155.0   155.0
 31 ASN   PSI	  -51.0   -29.0
 32 ASP   PHI	  -85.0   -51.0
 32 ASP   CHI1   -345.0    -5.0
 32 ASP   PSI	  -51.0   -23.0
 33 LEU   PHI	 -107.0   -71.0
 33 LEU   PSI	  -39.0    33.0
 34 GLY   PHI	 -335.0   -25.0
 34 GLY   PSI	 -115.0   115.0
 35 ILE   PHI	 -163.0   -85.0
 35 ILE   CHI1    -45.0   115.0
 35 ILE   CHI21    25.0   325.0
 35 ILE   PSI	  135.0   175.0
 36 ASN   PHI	 -131.0   -35.0
 36 ASN   CHI1     25.0   325.0
 36 ASN   CHI1   -295.0    55.0
 36 ASN   CHI1   -215.0    85.0
 36 ASN   CHI1    -55.0   295.0
 36 ASN   CHI2   -155.0   145.0
 36 ASN   PSI	  145.0   195.0
 37 ARG   PHI	  -71.0   -49.0
 37 ARG   CHI1   -335.0   -25.0
 37 ARG   CHI1   -215.0    85.0
 37 ARG   CHI2   -345.0   -15.0
 37 ARG   PSI	  -61.0    -9.0
 38 VAL   PHI	  -89.0   -49.0
 38 VAL   CHI1     75.0   225.0
 38 VAL   PSI	  -75.0     5.0
 39 THR   PHI	  -75.0   -53.0
 39 THR   CHI1   -135.0    -5.0
 39 THR   CHI21  -345.0   -15.0
 39 THR   CHI21  -105.0   225.0
 39 THR   PSI	  -55.0   -33.0
 40 LEU   PHI	  -71.0   -47.0
 40 LEU   CHI1   -245.0   -95.0
 40 LEU   PSI	  -57.0   -33.0
 41 LYS   PHI	  -75.0   -53.0
 41 LYS   CHI1   -165.0  -105.0
 41 LYS   CHI2   -315.0   -25.0
 41 LYS   PSI	  -51.0   -29.0
 42 ASN   PHI	  -77.0   -55.0
 42 ASN   CHI1   -155.0   -25.0
 42 ASN   CHI2   -165.0   155.0
 42 ASN   PSI	  -57.0   -17.0
 43 TRP   PHI	  -77.0   -55.0
 43 TRP   CHI1   -335.0    -5.0
 43 TRP   CHI2   -125.0   145.0
 43 TRP   PSI	  -53.0   -31.0
 44 ILE   PHI	  -81.0   -49.0
 44 ILE   CHI1   -125.0   -15.0
 44 ILE   CHI21  -345.0   -15.0
 44 ILE   CHI21  -305.0    45.0
 44 ILE   PSI	  -55.0   -33.0
 45 ILE   PHI	  -75.0   -53.0
 45 ILE   CHI1   -125.0   -25.0
 45 ILE   CHI21  -345.0   -15.0
 45 ILE   PSI	  -57.0   -33.0
 46 LYS   PHI	  -87.0   -45.0
 46 LYS   CHI1   -325.0   -25.0
 46 LYS   CHI1   -235.0    75.0
 46 LYS   CHI2   -345.0   -15.0
 46 LYS   PSI	  -65.0   -23.0
 47 TYR   PHI	 -147.0   -57.0
 47 TYR   CHI1   -335.0    15.0
 47 TYR   PSI	  -37.0    23.0
 48 GLY   PHI	 -335.0   -25.0
 48 GLY   PSI	 -155.0   155.0
 49 SER   PHI	  -87.0   -45.0
 49 SER   PSI	  -57.0   -25.0
 50 ASN   PHI	 -325.0   -25.0
 50 ASN   PHI	 -205.0    85.0
 50 ASN   CHI1   -215.0    85.0
 50 ASN   CHI2   -165.0   155.0
 50 ASN   PSI	 -245.0     5.0
 50 ASN   PSI	 -105.0   215.0
 51 HIS   PHI	 -335.0   -25.0
 51 HIS   PHI	 -205.0    95.0
 51 HIS   PSI	 -275.0    25.0
 52 ASN   PHI	   35.0   285.0
 52 ASN   PHI	 -195.0    65.0
 52 ASN   CHI1   -205.0    45.0
 52 ASN   CHI2   -155.0   155.0
 52 ASN   PSI	    5.0   125.0
 52 ASN   PSI	 -295.0    55.0
 53 VAL   PHI	  -81.0   -49.0
 53 VAL   CHI1   -325.0   -35.0
 53 VAL   CHI1    -95.0   215.0
 53 VAL   PSI	  -65.0   -23.0
 54 GLN   PHI	 -335.0   -25.0
 54 GLN   PHI	 -205.0    95.0
 54 GLN   CHI1   -225.0   115.0
 54 GLN   CHI2   -345.0   -15.0
 54 GLN   PSI	    5.0   225.0
 55 GLY   PHI	 -325.0   -35.0
 55 GLY   PSI	 -275.0    35.0
 55 GLY   PSI	 -165.0   165.0
 55 GLY   PSI	  -35.0   275.0
 56 THR   PHI	   45.0   215.0
 56 THR   PHI	 -165.0    75.0
 56 THR   CHI1     25.0    95.0
 56 THR   CHI21  -335.0   -25.0
 56 THR   CHI21   -95.0   215.0
 56 THR   PSI	   95.0   115.0
 57 THR   PHI	 -161.0   -41.0
 57 THR   CHI1   -355.0    -5.0
 57 THR   CHI1   -235.0   105.0
 57 THR   CHI21  -345.0   -15.0
 57 THR   CHI21  -105.0   225.0
 57 THR   PSI	   83.0   185.0
 58 PRO   PSI	 -315.0    15.0
 58 PRO   PSI	  -95.0   205.0
 59 SER   PHI	  -89.0   -47.0
 59 SER   PSI	  -51.0   -21.0
 60 ALA   PHI	  -89.0   -47.0
 60 ALA   PSI	  -45.0   -21.0
 61 ALA   PHI	  -93.0   -75.0
 61 ALA   PSI	   -5.0    11.0
 62 VAL   PHI	  -83.0   -49.0
 62 VAL   CHI1     75.0   215.0
 62 VAL   PSI	  -55.0   -25.0
 63 SER   PHI	 -315.0   -25.0
 63 SER   PHI	 -205.0    85.0
 63 SER   PSI	 -165.0     5.0
 63 SER   PSI	 -115.0   235.0
 64 GLU   PHI	  -79.0   -47.0
 64 GLU   CHI1   -215.0  -115.0
 64 GLU   CHI2   -335.0   -25.0
 64 GLU   PSI	  -35.0   -19.0
 65 ALA   PHI	  -79.0   -49.0
 65 ALA   PSI	  -57.0   -25.0
 66 GLU   PHI	  -81.0   -59.0
 66 GLU   CHI1   -195.0  -105.0
 66 GLU   CHI2   -345.0   -15.0
 66 GLU   PSI	  -53.0   -31.0
 67 GLN   PHI	  -79.0   -57.0
 67 GLN   CHI1   -325.0   -15.0
 67 GLN   CHI1   -225.0   115.0
 67 GLN   CHI2   -345.0   -15.0
 67 GLN   PSI	  -51.0   -25.0
 68 ILE   PHI	  -87.0   -43.0
 68 ILE   CHI1   -135.0   -15.0
 68 ILE   CHI21  -345.0   -15.0
 68 ILE   PSI	  -53.0   -31.0
 69 ARG   PHI	  -81.0   -51.0
 69 ARG   CHI1   -335.0   -15.0
 69 ARG   CHI1   -205.0    95.0
 69 ARG   CHI1    -45.0   165.0
 69 ARG   CHI2   -285.0   -25.0
 69 ARG   PSI	  -51.0   -29.0
 70 GLN   PHI	  -78.9   -58.9
 70 GLN   PSI	  -50.1   -25.8
 71 LEU   PHI	  -81.0   -45.0
 71 LEU   CHI1     25.0   285.0
 71 LEU   CHI1   -225.0    35.0
 71 LEU   PSI	  -59.0   -27.0
 72 LYS   PHI	  -95.0   -43.0
 72 LYS   CHI1   -335.0    -5.0
 72 LYS   CHI2   -345.0   -15.0
 72 LYS   PSI	  -65.0     3.0
 73 LYS   PHI	 -335.0   -25.0
 73 LYS   PHI	 -205.0    95.0
 73 LYS   CHI2   -345.0   -15.0
 74 GLU   PHI	 -335.0   -25.0
 74 GLU   PHI	 -215.0    95.0
 74 GLU   CHI1   -225.0   115.0
 74 GLU   CHI2   -345.0   -15.0
 74 GLU   PSI	 -245.0    -5.0
 75 ASN   PHI	 -325.0   -35.0
 75 ASN   PHI	 -205.0    95.0
 75 ASN   CHI1   -205.0    95.0
 75 ASN   CHI2   -165.0   155.0
 75 ASN   PSI	 -245.0     5.0
 75 ASN   PSI	  -95.0   215.0
 75 ASN   PSI	  -45.0   285.0
 76 ALA   PHI	  -83.0   -51.0
 76 ALA   PSI	  -55.0   -15.0
 77 LEU   PHI	  -83.0   -45.0
 77 LEU   CHI1   -335.0    -5.0
 77 LEU   CHI1   -135.0   135.0
 77 LEU   CHI2   -325.0    -5.0
 77 LEU   PSI	  -53.0   -27.0
 78 GLN   PHI	  -81.0   -45.0
 78 GLN   CHI1   -335.0   -15.0
 78 GLN   CHI1   -225.0   115.0
 78 GLN   CHI2   -345.0   -15.0
 78 GLN   PSI	  -61.0   -25.0
 79 ARG   PHI	  -89.0   -45.0
 79 ARG   CHI1   -175.0   -55.0
 79 ARG   CHI2   -335.0   -25.0
 79 ARG   PSI	  -25.0   -15.0
 80 ALA   PHI	  -79.0   -47.0
 80 ALA   PSI	  -45.0   -21.0
 81 ARG   PHI	  -85.0   -51.0
 81 ARG   CHI1   -135.0   -75.0
 81 ARG   CHI2     35.0   315.0
 81 ARG   CHI2   -225.0    85.0
 81 ARG   PSI	  -25.0     5.0
 82 THR   PHI	 -315.0   -35.0
 82 THR   PHI	 -195.0    85.0
 82 THR   PHI	 -175.0   175.0
 82 THR   CHI1   -345.0    -5.0
 82 THR   CHI1   -165.0    35.0
 82 THR   CHI21  -345.0   -15.0
 82 THR   CHI21  -105.0   225.0
 82 THR   PSI	 -115.0    25.0
 82 THR   PSI	  -35.0   275.0
 83 ARG   PHI	 -305.0   -25.0
 83 ARG   PHI	 -175.0    65.0
 83 ARG   CHI1   -215.0   105.0
 83 ARG   CHI2   -345.0   -15.0
 83 ARG   PSI	  105.0   215.0
 84 HIS   PHI	 -335.0   -25.0
 84 HIS   PHI	 -205.0    95.0
 84 HIS   PSI	   55.0   185.0
 85 PRO   PSI	 -185.0  -155.0
 86 ALA   PHI	 -335.0   -25.0
 86 ALA   PHI	 -205.0    95.0
 86 ALA   PSI	   25.0   215.0
 87 GLU   PHI	  -77.0   -53.0
 87 GLU   CHI1   -335.0   -25.0
 87 GLU   CHI1   -225.0   115.0
 87 GLU   CHI2   -345.0   -15.0
 87 GLU   PSI	  -59.0   -23.0
 88 SER   PHI	  -87.0   -47.0
 88 SER   PSI	  -57.0   -25.0
 89 CYS   PHI	  -91.0   -45.0
 89 CYS   CHI1   -315.0   -25.0
 89 CYS   CHI1   -205.0    85.0
 89 CYS   PSI	  -35.0   -25.0
 90 LEU   PHI	  -95.0   -43.0
 90 LEU   CHI1   -275.0    -5.0
 90 LEU   CHI1    -55.0   205.0
 90 LEU   CHI2    -15.0   225.0
 90 LEU   PSI	  -59.0    -9.0
 91 GLU   PHI	  -83.0   -49.0
 91 GLU   CHI1   -335.0   -15.0
 91 GLU   CHI1   -225.0   115.0
 91 GLU   CHI2   -345.0   -15.0
 91 GLU   PSI	  -53.0   -31.0
 92 HIS   PHI	 -335.0   -25.0
 92 HIS   PHI	 -205.0    95.0
 92 HIS   PSI	   15.0   225.0
 93 HIS   PHI	 -335.0   -25.0
 93 HIS   PHI	 -205.0    95.0
 94 HIS   PHI	 -335.0   -25.0
 94 HIS   PHI	 -205.0    95.0
 95 HIS   PHI	 -335.0   -25.0
 95 HIS   PHI	 -205.0    95.0
 96 HIS   PHI	 -335.0   -25.0
 96 HIS   PHI	 -205.0    95.0
 96 HIS   PSI	  -45.0   275.0
 97 HIS   PHI	 -335.0   -25.0
 97 HIS   PHI	 -205.0    95.0

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1          1HT       MET   1   9.453  20.897  -7.647
    2   2H    MET   1          2HT       MET   1   7.978  21.663  -7.306
    3   3H    MET   1          3HT       MET   1   8.523  21.549  -8.909
    4    HA   MET   1           HA       MET   1   6.765  19.962  -8.470
    5   1HB   MET   1          2HB       MET   1   9.515  18.762  -8.871
    6   2HB   MET   1          1HB       MET   1   8.015  17.901  -9.164
    7   1HG   MET   1          2HG       MET   1   7.416  19.488 -10.900
    8   2HG   MET   1          1HG       MET   1   8.896  20.395 -10.591
    9   1HE   MET   1          1HE       MET   1   8.448  16.488 -10.583
   10   2HE   MET   1          2HE       MET   1   8.834  16.091 -12.258
   11   3HE   MET   1          3HE       MET   1   7.377  17.010 -11.886
   12    HA   PRO   2           HA       PRO   2   6.901  18.359  -4.257
   13   1HB   PRO   2          2HB       PRO   2   4.273  17.258  -4.933
   14   2HB   PRO   2          1HB       PRO   2   4.697  18.450  -3.703
   15   1HG   PRO   2          2HG       PRO   2   3.306  19.099  -5.924
   16   2HG   PRO   2          1HG       PRO   2   4.433  20.226  -5.144
   17   1HD   PRO   2          2HD       PRO   2   4.839  18.514  -7.574
   18   2HD   PRO   2          1HD       PRO   2   5.315  20.204  -7.293
   19    H    THR   3           H        THR   3   7.079  16.263  -3.377
   20    HA   THR   3           HA       THR   3   7.808  14.273  -5.352
   21    HB   THR   3           HB       THR   3   8.710  13.007  -3.418
   22    HG1  THR   3           1HG      THR   3   7.074  14.270  -1.988
   23   1HG2  THR   3          1HG2      THR   3   9.582  15.895  -3.582
   24   2HG2  THR   3          2HG2      THR   3  10.171  14.566  -4.580
   25   3HG2  THR   3          3HG2      THR   3  10.517  14.591  -2.850
   26    H    LYS   4           H        LYS   4   6.482  12.731  -5.970
   27    HA   LYS   4           HA       LYS   4   4.116  12.013  -4.502
   28   1HB   LYS   4          2HB       LYS   4   4.468  11.976  -7.074
   29   2HB   LYS   4          1HB       LYS   4   5.313  10.465  -6.800
   30   1HG   LYS   4          2HG       LYS   4   2.445  11.001  -6.054
   31   2HG   LYS   4          1HG       LYS   4   2.978  10.164  -7.511
   32   1HD   LYS   4          2HD       LYS   4   4.233   8.633  -5.787
   33   2HD   LYS   4          1HD       LYS   4   3.020   9.261  -4.670
   34   1HE   LYS   4          2HE       LYS   4   2.219   7.200  -5.616
   35   2HE   LYS   4          1HE       LYS   4   1.256   8.534  -6.255
   36   1HZ   LYS   4          1HZ       LYS   4   2.511   8.468  -8.293
   37   2HZ   LYS   4          2HZ       LYS   4   1.921   6.915  -7.966
   38   3HZ   LYS   4          3HZ       LYS   4   3.550   7.281  -7.673
   39    H    THR   5           H        THR   5   4.983  11.377  -2.536
   40    HA   THR   5           HA       THR   5   7.141   9.520  -2.379
   41    HB   THR   5           HB       THR   5   7.210  10.974  -0.628
   42    HG1  THR   5           1HG      THR   5   5.725   9.093   0.810
   43   1HG2  THR   5          1HG2      THR   5   4.258  10.579  -0.148
   44   2HG2  THR   5          2HG2      THR   5   4.997  11.978  -0.927
   45   3HG2  THR   5          3HG2      THR   5   5.317  11.646   0.776
   46    H    TYR   6           H        TYR   6   7.207   7.548  -1.531
   47    HA   TYR   6           HA       TYR   6   4.819   6.082  -0.857
   48   1HB   TYR   6          2HB       TYR   6   5.605   4.178  -2.387
   49   2HB   TYR   6          1HB       TYR   6   4.762   5.516  -3.145
   50    HD1  TYR   6           1HD      TYR   6   7.860   3.637  -2.947
   51    HD2  TYR   6           2HD      TYR   6   6.058   7.174  -4.474
   52    HE1  TYR   6           1HE      TYR   6   9.724   3.902  -4.525
   53    HE2  TYR   6           2HE      TYR   6   7.917   7.448  -6.058
   54    HH   TYR   6           HH       TYR   6  10.235   6.770  -6.312
   55    H    SER   7           H        SER   7   5.315   5.139   1.001
   56    HA   SER   7           HA       SER   7   7.996   5.020   1.939
   57   1HB   SER   7          2HB       SER   7   5.517   3.767   3.140
   58   2HB   SER   7          1HB       SER   7   7.037   4.089   3.973
   59    HG   SER   7           HG       SER   7   5.323   5.684   4.287
   60    H    GLU   8           H        GLU   8   9.082   3.118   2.741
   61    HA   GLU   8           HA       GLU   8   9.292   1.015   0.895
   62   1HB   GLU   8          2HB       GLU   8  10.038   0.626   3.778
   63   2HB   GLU   8          1HB       GLU   8  10.854   0.039   2.340
   64   1HG   GLU   8          2HG       GLU   8  12.282   1.672   3.125
   65   2HG   GLU   8          1HG       GLU   8  11.364   2.519   1.881
   66    H    GLU   9           H        GLU   9   7.247   1.503   3.624
   67    HA   GLU   9           HA       GLU   9   6.426  -1.031   4.326
   68   1HB   GLU   9          2HB       GLU   9   5.748   1.127   5.403
   69   2HB   GLU   9          1HB       GLU   9   4.642   1.395   4.066
   70   1HG   GLU   9          2HG       GLU   9   3.314   0.536   5.777
   71   2HG   GLU   9          1HG       GLU   9   3.585  -0.826   4.692
   72    H    PHE  10           H        PHE  10   5.402   0.950   1.585
   73    HA   PHE  10           HA       PHE  10   3.233  -0.710   0.809
   74   1HB   PHE  10          2HB       PHE  10   3.601   1.720   0.159
   75   2HB   PHE  10          1HB       PHE  10   4.782   1.138  -1.009
   76    HD1  PHE  10           1HD      PHE  10   1.233   0.721   0.004
   77    HD2  PHE  10           2HD      PHE  10   4.098   0.540  -3.135
   78    HE1  PHE  10           1HE      PHE  10  -0.576   0.355  -1.617
   79    HE2  PHE  10           2HE      PHE  10   2.292   0.167  -4.765
   80    HZ   PHE  10           HZ       PHE  10  -0.050   0.076  -4.007
   81    H    LYS  11           H        LYS  11   6.573  -0.406  -0.377
   82    HA   LYS  11           HA       LYS  11   6.496  -2.471  -2.279
   83   1HB   LYS  11          2HB       LYS  11   8.860  -1.735  -0.540
   84   2HB   LYS  11          1HB       LYS  11   8.908  -2.512  -2.112
   85   1HG   LYS  11          2HG       LYS  11   8.166  -0.492  -3.194
   86   2HG   LYS  11          1HG       LYS  11   7.938   0.300  -1.630
   87   1HD   LYS  11          2HD       LYS  11  10.348   0.029  -1.173
   88   2HD   LYS  11          1HD       LYS  11  10.555  -0.690  -2.767
   89   1HE   LYS  11          2HE       LYS  11   9.923   1.370  -3.835
   90   2HE   LYS  11          1HE       LYS  11   9.514   2.099  -2.282
   91   1HZ   LYS  11          1HZ       LYS  11  12.242   1.210  -3.085
   92   2HZ   LYS  11          2HZ       LYS  11  11.824   1.964  -1.630
   93   3HZ   LYS  11          3HZ       LYS  11  11.693   2.810  -3.083
   94    H    ARG  12           H        ARG  12   7.293  -2.435   1.138
   95    HA   ARG  12           HA       ARG  12   8.028  -5.088   1.559
   96   1HB   ARG  12          2HB       ARG  12   8.358  -3.264   3.156
   97   2HB   ARG  12          1HB       ARG  12   6.624  -3.125   3.379
   98   1HG   ARG  12          2HG       ARG  12   6.616  -5.405   4.347
   99   2HG   ARG  12          1HG       ARG  12   8.381  -5.416   4.226
  100   1HD   ARG  12          2HD       ARG  12   8.439  -3.350   5.587
  101   2HD   ARG  12          1HD       ARG  12   6.695  -3.463   5.784
  102    HE   ARG  12           HE       ARG  12   8.293  -5.736   6.670
  103   1HH1  ARG  12          1HH1      ARG  12   6.380  -2.916   7.462
  104   2HH1  ARG  12          2HH1      ARG  12   6.318  -3.279   9.161
  105   1HH2  ARG  12          1HH2      ARG  12   8.225  -6.219   8.902
  106   2HH2  ARG  12          2HH2      ARG  12   7.379  -5.147   9.990
  107    H    ASP  13           H        ASP  13   4.846  -3.544   1.891
  108    HA   ASP  13           HA       ASP  13   3.478  -5.868   2.737
  109   1HB   ASP  13          2HB       ASP  13   2.688  -3.521   3.084
  110   2HB   ASP  13          1HB       ASP  13   2.326  -3.432   1.363
  111    H    ALA  14           H        ALA  14   4.068  -4.429  -0.413
  112    HA   ALA  14           HA       ALA  14   2.341  -5.990  -1.968
  113   1HB   ALA  14          1HB       ALA  14   3.441  -3.993  -2.825
  114   2HB   ALA  14          2HB       ALA  14   3.786  -5.382  -3.854
  115   3HB   ALA  14          3HB       ALA  14   5.008  -4.797  -2.727
  116    H    VAL  15           H        VAL  15   5.734  -6.542  -1.052
  117    HA   VAL  15           HA       VAL  15   5.929  -9.035  -2.416
  118    HB   VAL  15           HB       VAL  15   7.625  -8.011  -0.129
  119   1HG1  VAL  15          1HG1      VAL  15   7.860 -10.416  -0.459
  120   2HG1  VAL  15          2HG1      VAL  15   9.319  -9.567  -0.967
  121   3HG1  VAL  15          3HG1      VAL  15   8.180 -10.160  -2.175
  122   1HG2  VAL  15          1HG2      VAL  15   7.628  -6.462  -2.003
  123   2HG2  VAL  15          2HG2      VAL  15   8.022  -7.779  -3.109
  124   3HG2  VAL  15          3HG2      VAL  15   9.183  -7.284  -1.877
  125    H    ALA  16           H        ALA  16   5.048  -8.078   0.858
  126    HA   ALA  16           HA       ALA  16   5.010 -10.650   2.015
  127   1HB   ALA  16          1HB       ALA  16   4.981  -8.578   3.325
  128   2HB   ALA  16          2HB       ALA  16   3.657  -9.656   3.770
  129   3HB   ALA  16          3HB       ALA  16   3.345  -8.248   2.754
  130    H    LEU  17           H        LEU  17   2.641  -8.854   0.153
  131    HA   LEU  17           HA       LEU  17   0.467 -10.638   0.524
  132   1HB   LEU  17          2HB       LEU  17   0.866  -8.213  -0.740
  133   2HB   LEU  17          1HB       LEU  17   0.600  -9.302  -2.084
  134    HG   LEU  17           HG       LEU  17  -1.479  -8.242  -1.431
  135   1HD1  LEU  17          1HD1      LEU  17  -1.398 -11.157  -0.686
  136   2HD1  LEU  17          2HD1      LEU  17  -1.651 -10.489  -2.298
  137   3HD1  LEU  17          3HD1      LEU  17  -2.861 -10.238  -1.038
  138   1HD2  LEU  17          1HD2      LEU  17  -1.025  -9.497   1.271
  139   2HD2  LEU  17          2HD2      LEU  17  -2.489  -8.655   0.760
  140   3HD2  LEU  17          3HD2      LEU  17  -0.966  -7.774   0.898
  141    H    TYR  18           H        TYR  18   3.207 -10.557  -1.656
  142    HA   TYR  18           HA       TYR  18   2.315 -12.554  -3.457
  143   1HB   TYR  18          2HB       TYR  18   4.155 -10.970  -3.956
  144   2HB   TYR  18          1HB       TYR  18   5.157 -11.778  -2.756
  145    HD1  TYR  18           1HD      TYR  18   3.179 -12.559  -5.827
  146    HD2  TYR  18           2HD      TYR  18   6.616 -13.435  -3.474
  147    HE1  TYR  18           1HE      TYR  18   3.950 -14.134  -7.549
  148    HE2  TYR  18           2HE      TYR  18   7.394 -15.015  -5.190
  149    HH   TYR  18           HH       TYR  18   5.914 -15.201  -8.312
  150    H    GLU  19           H        GLU  19   3.738 -12.687  -0.295
  151    HA   GLU  19           HA       GLU  19   4.571 -15.394  -0.308
  152   1HB   GLU  19          2HB       GLU  19   3.502 -13.793   2.026
  153   2HB   GLU  19          1HB       GLU  19   4.454 -15.265   2.128
  154   1HG   GLU  19          2HG       GLU  19   6.358 -14.103   1.135
  155   2HG   GLU  19          1HG       GLU  19   5.398 -12.627   1.032
  156    H    ASN  20           H        ASN  20   1.500 -13.874  -0.218
  157    HA   ASN  20           HA       ASN  20   0.158 -16.306   0.726
  158   1HB   ASN  20          2HB       ASN  20  -0.722 -13.431   0.460
  159   2HB   ASN  20          1HB       ASN  20  -1.854 -14.734   0.793
  160   1HD2  ASN  20          1HD2      ASN  20   0.764 -12.821   2.034
  161   2HD2  ASN  20          2HD2      ASN  20   0.600 -13.306   3.683
  162    H    SER  21           H        SER  21   1.356 -15.827  -1.975
  163    HA   SER  21           HA       SER  21  -0.645 -15.322  -3.879
  164   1HB   SER  21          2HB       SER  21   0.966 -16.462  -5.463
  165   2HB   SER  21          1HB       SER  21   1.617 -15.103  -4.550
  166    HG   SER  21           HG       SER  21   2.955 -16.396  -3.573
  167    H    ASP  22           H        ASP  22  -0.003 -18.091  -1.998
  168    HA   ASP  22           HA       ASP  22  -0.951 -20.211  -3.455
  169   1HB   ASP  22          2HB       ASP  22  -0.149 -20.420  -1.147
  170   2HB   ASP  22          1HB       ASP  22  -1.579 -19.574  -0.564
  171    H    GLY  23           H        GLY  23  -2.788 -17.691  -1.853
  172   1HA   GLY  23          2HA       GLY  23  -5.197 -18.624  -3.288
  173   2HA   GLY  23          1HA       GLY  23  -5.258 -17.898  -1.688
  174    H    ALA  24           H        ALA  24  -2.980 -16.542  -3.857
  175    HA   ALA  24           HA       ALA  24  -4.839 -14.432  -4.663
  176   1HB   ALA  24          1HB       ALA  24  -3.797 -13.699  -2.550
  177   2HB   ALA  24          2HB       ALA  24  -3.356 -12.670  -3.912
  178   3HB   ALA  24          3HB       ALA  24  -2.210 -13.862  -3.300
  179    H    SER  25           H        SER  25  -4.673 -14.332  -6.786
  180    HA   SER  25           HA       SER  25  -2.432 -15.301  -8.241
  181   1HB   SER  25          2HB       SER  25  -4.738 -15.355  -9.140
  182   2HB   SER  25          1HB       SER  25  -4.753 -13.592  -9.186
  183    HG   SER  25           HG       SER  25  -3.380 -15.426 -10.811
  184    H    LEU  26           H        LEU  26  -1.059 -14.077  -9.653
  185    HA   LEU  26           HA       LEU  26   0.209 -11.887  -8.520
  186   1HB   LEU  26          2HB       LEU  26   0.997 -13.490 -10.367
  187   2HB   LEU  26          1HB       LEU  26   0.156 -12.434 -11.481
  188    HG   LEU  26           HG       LEU  26   2.655 -12.083 -11.272
  189   1HD1  LEU  26          1HD1      LEU  26   0.847  -9.744 -10.708
  190   2HD1  LEU  26          2HD1      LEU  26   1.259 -10.399 -12.292
  191   3HD1  LEU  26          3HD1      LEU  26   2.502  -9.634 -11.304
  192   1HD2  LEU  26          1HD2      LEU  26   3.429 -10.744  -9.366
  193   2HD2  LEU  26          2HD2      LEU  26   2.874 -12.345  -8.877
  194   3HD2  LEU  26          3HD2      LEU  26   1.851 -10.936  -8.604
  195    H    GLN  27           H        GLN  27  -2.285 -12.000 -11.038
  196    HA   GLN  27           HA       GLN  27  -2.459  -9.201 -11.398
  197   1HB   GLN  27          2HB       GLN  27  -3.370 -10.696 -13.074
  198   2HB   GLN  27          1HB       GLN  27  -4.501 -11.371 -11.908
  199   1HG   GLN  27          2HG       GLN  27  -5.657  -9.835 -13.357
  200   2HG   GLN  27          1HG       GLN  27  -5.591  -9.176 -11.726
  201   1HE2  GLN  27          1HE2      GLN  27  -5.881  -7.080 -12.417
  202   2HE2  GLN  27          2HE2      GLN  27  -4.646  -6.185 -13.228
  203    H    GLN  28           H        GLN  28  -4.245 -11.478  -9.358
  204    HA   GLN  28           HA       GLN  28  -6.248  -9.814  -8.420
  205   1HB   GLN  28          2HB       GLN  28  -5.883 -12.340  -8.068
  206   2HB   GLN  28          1HB       GLN  28  -4.908 -11.880  -6.683
  207   1HG   GLN  28          2HG       GLN  28  -7.664 -10.785  -6.894
  208   2HG   GLN  28          1HG       GLN  28  -7.466 -12.479  -6.464
  209   1HE2  GLN  28          1HE2      GLN  28  -7.107  -9.203  -5.449
  210   2HE2  GLN  28          2HE2      GLN  28  -6.699  -9.546  -3.798
  211    H    ILE  29           H        ILE  29  -3.003 -10.330  -7.081
  212    HA   ILE  29           HA       ILE  29  -3.236  -8.700  -4.823
  213    HB   ILE  29           HB       ILE  29  -0.756  -9.153  -6.493
  214   1HG1  ILE  29          2HG1      ILE  29  -1.768 -10.681  -4.082
  215   2HG1  ILE  29          1HG1      ILE  29  -1.867 -11.247  -5.746
  216   1HG2  ILE  29          1HG2      ILE  29   0.460  -8.662  -4.427
  217   2HG2  ILE  29          2HG2      ILE  29  -1.068  -8.321  -3.612
  218   3HG2  ILE  29          3HG2      ILE  29  -0.526  -7.292  -4.938
  219   1HD1  ILE  29          1HD1      ILE  29   0.560 -11.247  -5.891
  220   2HD1  ILE  29          2HD1      ILE  29  -0.013 -12.276  -4.578
  221   3HD1  ILE  29          3HD1      ILE  29   0.658 -10.684  -4.225
  222    H    ALA  30           H        ALA  30  -1.833  -7.844  -7.992
  223    HA   ALA  30           HA       ALA  30  -1.441  -5.119  -7.353
  224   1HB   ALA  30          1HB       ALA  30  -1.049  -4.804  -9.737
  225   2HB   ALA  30          2HB       ALA  30  -1.734  -6.396 -10.067
  226   3HB   ALA  30          3HB       ALA  30  -0.233  -6.255  -9.153
  227    H    ASN  31           H        ASN  31  -4.082  -6.877  -8.827
  228    HA   ASN  31           HA       ASN  31  -5.573  -4.655  -9.754
  229   1HB   ASN  31          2HB       ASN  31  -5.844  -7.011 -10.534
  230   2HB   ASN  31          1HB       ASN  31  -6.555  -7.412  -8.979
  231   1HD2  ASN  31          1HD2      ASN  31  -8.428  -8.090  -9.995
  232   2HD2  ASN  31          2HD2      ASN  31  -9.584  -6.971 -10.624
  233    H    ASP  32           H        ASP  32  -5.494  -6.412  -6.701
  234    HA   ASP  32           HA       ASP  32  -7.838  -5.211  -5.608
  235   1HB   ASP  32          2HB       ASP  32  -6.903  -7.349  -4.776
  236   2HB   ASP  32          1HB       ASP  32  -5.502  -6.483  -4.163
  237    H    LEU  33           H        LEU  33  -4.386  -4.500  -5.404
  238    HA   LEU  33           HA       LEU  33  -4.716  -2.298  -3.617
  239   1HB   LEU  33          2HB       LEU  33  -2.450  -3.396  -5.222
  240   2HB   LEU  33          1HB       LEU  33  -2.313  -1.782  -4.560
  241    HG   LEU  33           HG       LEU  33  -2.660  -2.698  -2.287
  242   1HD1  LEU  33          1HD1      LEU  33  -2.574  -5.371  -3.679
  243   2HD1  LEU  33          2HD1      LEU  33  -3.956  -4.672  -2.833
  244   3HD1  LEU  33          3HD1      LEU  33  -2.507  -5.121  -1.933
  245   1HD2  LEU  33          1HD2      LEU  33  -0.469  -3.742  -2.083
  246   2HD2  LEU  33          2HD2      LEU  33  -0.411  -2.347  -3.160
  247   3HD2  LEU  33          3HD2      LEU  33  -0.409  -3.979  -3.829
  248    H    GLY  34           H        GLY  34  -4.411  -2.657  -7.103
  249   1HA   GLY  34          2HA       GLY  34  -5.556  -1.114  -8.565
  250   2HA   GLY  34          1HA       GLY  34  -5.256   0.156  -7.389
  251    H    ILE  35           H        ILE  35  -2.664  -1.976  -7.924
  252    HA   ILE  35           HA       ILE  35  -1.267   0.146  -9.402
  253    HB   ILE  35           HB       ILE  35   0.827  -0.890  -8.597
  254   1HG1  ILE  35          2HG1      ILE  35  -0.994  -2.614  -6.898
  255   2HG1  ILE  35          1HG1      ILE  35  -0.078  -3.188  -8.288
  256   1HG2  ILE  35          1HG2      ILE  35  -1.144  -0.104  -6.454
  257   2HG2  ILE  35          2HG2      ILE  35  -0.112   0.979  -7.388
  258   3HG2  ILE  35          3HG2      ILE  35   0.608  -0.159  -6.251
  259   1HD1  ILE  35          1HD1      ILE  35   2.002  -2.571  -7.105
  260   2HD1  ILE  35          2HD1      ILE  35   1.052  -3.794  -6.265
  261   3HD1  ILE  35          3HD1      ILE  35   1.034  -2.122  -5.700
  262    H    ASN  36           H        ASN  36   0.620  -0.787 -10.769
  263    HA   ASN  36           HA       ASN  36  -0.515  -2.599 -12.670
  264   1HB   ASN  36          2HB       ASN  36   0.966  -0.624 -13.227
  265   2HB   ASN  36          1HB       ASN  36   2.315  -1.551 -12.594
  266   1HD2  ASN  36          1HD2      ASN  36  -0.094  -1.351 -15.088
  267   2HD2  ASN  36          2HD2      ASN  36   0.693  -2.408 -16.192
  268    H    ARG  37           H        ARG  37   0.158  -4.661 -13.168
  269    HA   ARG  37           HA       ARG  37   1.105  -6.198 -10.985
  270   1HB   ARG  37          2HB       ARG  37   0.837  -8.091 -12.502
  271   2HB   ARG  37          1HB       ARG  37  -0.570  -7.057 -12.497
  272   1HG   ARG  37          2HG       ARG  37   0.148  -6.081 -14.617
  273   2HG   ARG  37          1HG       ARG  37   1.554  -7.154 -14.623
  274   1HD   ARG  37          2HD       ARG  37   0.074  -9.099 -14.633
  275   2HD   ARG  37          1HD       ARG  37  -1.331  -8.039 -14.595
  276    HE   ARG  37           HE       ARG  37   0.218  -7.354 -16.823
  277   1HH1  ARG  37          1HH1      ARG  37  -1.716 -10.028 -15.649
  278   2HH1  ARG  37          2HH1      ARG  37  -2.157 -10.587 -17.233
  279   1HH2  ARG  37          1HH2      ARG  37  -0.359  -8.073 -18.921
  280   2HH2  ARG  37          2HH2      ARG  37  -1.377  -9.479 -19.097
  281    H    VAL  38           H        VAL  38   2.589  -4.860 -13.835
  282    HA   VAL  38           HA       VAL  38   4.977  -6.428 -13.679
  283    HB   VAL  38           HB       VAL  38   4.544  -3.758 -15.031
  284   1HG1  VAL  38          1HG1      VAL  38   6.732  -5.804 -15.380
  285   2HG1  VAL  38          2HG1      VAL  38   6.899  -4.198 -14.669
  286   3HG1  VAL  38          3HG1      VAL  38   6.506  -4.368 -16.379
  287   1HG2  VAL  38          1HG2      VAL  38   3.037  -5.497 -15.861
  288   2HG2  VAL  38          2HG2      VAL  38   4.423  -6.543 -16.177
  289   3HG2  VAL  38          3HG2      VAL  38   4.231  -5.035 -17.073
  290    H    THR  39           H        THR  39   4.058  -3.152 -12.631
  291    HA   THR  39           HA       THR  39   6.511  -2.436 -11.473
  292    HB   THR  39           HB       THR  39   3.780  -1.596 -10.482
  293    HG1  THR  39           1HG      THR  39   5.300  -0.725 -12.739
  294   1HG2  THR  39          1HG2      THR  39   5.665  -0.862  -9.098
  295   2HG2  THR  39          2HG2      THR  39   4.925   0.505  -9.933
  296   3HG2  THR  39          3HG2      THR  39   6.444  -0.173 -10.521
  297    H    LEU  40           H        LEU  40   3.730  -4.193 -10.197
  298    HA   LEU  40           HA       LEU  40   4.617  -4.573  -7.562
  299   1HB   LEU  40          2HB       LEU  40   2.339  -5.064  -8.227
  300   2HB   LEU  40          1HB       LEU  40   2.888  -6.285  -9.359
  301    HG   LEU  40           HG       LEU  40   3.758  -7.587  -7.393
  302   1HD1  LEU  40          1HD1      LEU  40   2.822  -7.045  -5.194
  303   2HD1  LEU  40          2HD1      LEU  40   2.165  -5.545  -5.854
  304   3HD1  LEU  40          3HD1      LEU  40   3.911  -5.791  -5.784
  305   1HD2  LEU  40          1HD2      LEU  40   0.796  -7.020  -7.456
  306   2HD2  LEU  40          2HD2      LEU  40   1.569  -8.458  -6.787
  307   3HD2  LEU  40          3HD2      LEU  40   1.661  -8.134  -8.517
  308    H    LYS  41           H        LYS  41   4.982  -6.547 -10.470
  309    HA   LYS  41           HA       LYS  41   6.385  -8.708  -9.433
  310   1HB   LYS  41          2HB       LYS  41   5.367  -8.338 -11.763
  311   2HB   LYS  41          1HB       LYS  41   6.878  -7.549 -12.171
  312   1HG   LYS  41          2HG       LYS  41   8.104  -9.590 -11.759
  313   2HG   LYS  41          1HG       LYS  41   6.628 -10.394 -11.213
  314   1HD   LYS  41          2HD       LYS  41   5.647  -9.952 -13.466
  315   2HD   LYS  41          1HD       LYS  41   7.221  -9.351 -13.980
  316   1HE   LYS  41          2HE       LYS  41   6.721 -12.122 -12.908
  317   2HE   LYS  41          1HE       LYS  41   6.772 -11.713 -14.621
  318   1HZ   LYS  41          1HZ       LYS  41   8.886 -12.539 -14.034
  319   2HZ   LYS  41          2HZ       LYS  41   8.989 -11.558 -12.661
  320   3HZ   LYS  41          3HZ       LYS  41   9.072 -10.862 -14.204
  321    H    ASN  42           H        ASN  42   7.545  -5.610 -10.633
  322    HA   ASN  42           HA       ASN  42  10.287  -6.045 -10.533
  323   1HB   ASN  42          2HB       ASN  42   8.570  -3.619 -10.289
  324   2HB   ASN  42          1HB       ASN  42  10.267  -3.476  -9.852
  325   1HD2  ASN  42          1HD2      ASN  42  11.841  -3.725 -11.428
  326   2HD2  ASN  42          2HD2      ASN  42  11.474  -3.646 -13.118
  327    H    TRP  43           H        TRP  43   8.220  -4.724  -7.917
  328    HA   TRP  43           HA       TRP  43  10.325  -4.520  -6.046
  329   1HB   TRP  43          2HB       TRP  43   7.342  -4.743  -5.626
  330   2HB   TRP  43          1HB       TRP  43   8.489  -4.452  -4.323
  331    HD1  TRP  43           HD       TRP  43  10.285  -2.344  -6.151
  332    HE1  TRP  43           1HE      TRP  43   9.348   0.040  -6.418
  333    HE3  TRP  43           3HE      TRP  43   5.396  -3.253  -4.979
  334    HZ2  TRP  43           2HZ      TRP  43   6.866   1.362  -6.159
  335    HZ3  TRP  43           3HZ      TRP  43   3.809  -1.380  -5.009
  336    HH2  TRP  43           HH       TRP  43   4.531   0.877  -5.586
  337    H    ILE  44           H        ILE  44   8.086  -7.116  -6.810
  338    HA   ILE  44           HA       ILE  44   8.587  -8.828  -4.667
  339    HB   ILE  44           HB       ILE  44   7.941  -9.526  -7.538
  340   1HG1  ILE  44          2HG1      ILE  44   6.160  -9.351  -5.097
  341   2HG1  ILE  44          1HG1      ILE  44   6.284  -8.109  -6.337
  342   1HG2  ILE  44          1HG2      ILE  44   7.242 -11.702  -6.710
  343   2HG2  ILE  44          2HG2      ILE  44   7.747 -11.262  -5.079
  344   3HG2  ILE  44          3HG2      ILE  44   8.949 -11.425  -6.360
  345   1HD1  ILE  44          1HD1      ILE  44   5.314 -10.926  -6.763
  346   2HD1  ILE  44          2HD1      ILE  44   5.431  -9.672  -7.996
  347   3HD1  ILE  44          3HD1      ILE  44   4.308  -9.481  -6.652
  348    H    ILE  45           H        ILE  45  10.269  -8.580  -7.790
  349    HA   ILE  45           HA       ILE  45  12.169 -10.631  -7.140
  350    HB   ILE  45           HB       ILE  45  12.302  -8.517  -9.298
  351   1HG1  ILE  45          2HG1      ILE  45  11.298 -11.370  -9.451
  352   2HG1  ILE  45          1HG1      ILE  45  10.275  -9.938  -9.432
  353   1HG2  ILE  45          1HG2      ILE  45  14.471  -9.495  -8.869
  354   2HG2  ILE  45          2HG2      ILE  45  13.846 -10.073 -10.413
  355   3HG2  ILE  45          3HG2      ILE  45  13.791 -11.120  -8.995
  356   1HD1  ILE  45          1HD1      ILE  45  12.289 -10.637 -11.561
  357   2HD1  ILE  45          2HD1      ILE  45  11.250  -9.211 -11.542
  358   3HD1  ILE  45          3HD1      ILE  45  10.538 -10.818 -11.681
  359    H    LYS  46           H        LYS  46  12.017  -7.160  -6.881
  360    HA   LYS  46           HA       LYS  46  14.775  -6.649  -6.558
  361   1HB   LYS  46          2HB       LYS  46  13.162  -4.942  -7.228
  362   2HB   LYS  46          1HB       LYS  46  12.383  -5.046  -5.657
  363   1HG   LYS  46          2HG       LYS  46  14.608  -4.370  -4.663
  364   2HG   LYS  46          1HG       LYS  46  15.105  -3.972  -6.311
  365   1HD   LYS  46          2HD       LYS  46  13.305  -2.384  -6.518
  366   2HD   LYS  46          1HD       LYS  46  12.664  -2.848  -4.941
  367   1HE   LYS  46          2HE       LYS  46  15.239  -1.424  -5.550
  368   2HE   LYS  46          1HE       LYS  46  13.860  -0.829  -4.625
  369   1HZ   LYS  46          1HZ       LYS  46  14.438  -2.931  -3.177
  370   2HZ   LYS  46          2HZ       LYS  46  15.209  -1.447  -2.929
  371   3HZ   LYS  46          3HZ       LYS  46  15.983  -2.668  -3.819
  372    H    TYR  47           H        TYR  47  12.189  -7.278  -4.208
  373    HA   TYR  47           HA       TYR  47  14.173  -7.034  -2.059
  374   1HB   TYR  47          2HB       TYR  47  11.160  -7.043  -2.032
  375   2HB   TYR  47          1HB       TYR  47  12.121  -7.174  -0.562
  376    HD1  TYR  47           1HD      TYR  47  10.904  -4.953  -3.155
  377    HD2  TYR  47           2HD      TYR  47  13.593  -5.295   0.123
  378    HE1  TYR  47           1HE      TYR  47  11.128  -2.506  -3.089
  379    HE2  TYR  47           2HE      TYR  47  13.819  -2.849   0.201
  380    HH   TYR  47           HH       TYR  47  13.557  -0.920  -1.314
  381    H    GLY  48           H        GLY  48  11.856  -9.315  -3.455
  382   1HA   GLY  48          2HA       GLY  48  12.780 -11.423  -1.667
  383   2HA   GLY  48          1HA       GLY  48  11.554 -11.576  -2.919
  384    H    SER  49           H        SER  49  14.924 -10.475  -3.001
  385    HA   SER  49           HA       SER  49  15.427 -11.724  -5.494
  386   1HB   SER  49          2HB       SER  49  17.413 -10.655  -3.476
  387   2HB   SER  49          1HB       SER  49  17.726 -10.968  -5.183
  388    HG   SER  49           HG       SER  49  15.713  -9.427  -5.309
  389    H    ASN  50           H        ASN  50  16.086 -12.641  -2.148
  390    HA   ASN  50           HA       ASN  50  17.805 -14.813  -2.791
  391   1HB   ASN  50          2HB       ASN  50  16.135 -14.419  -0.313
  392   2HB   ASN  50          1HB       ASN  50  17.474 -15.538  -0.477
  393   1HD2  ASN  50          1HD2      ASN  50  17.081 -13.319   1.386
  394   2HD2  ASN  50          2HD2      ASN  50  18.445 -12.275   1.164
  395    H    HIS  51           H        HIS  51  17.259 -16.521  -3.796
  396    HA   HIS  51           HA       HIS  51  15.158 -18.284  -3.266
  397   1HB   HIS  51          2HB       HIS  51  14.553 -16.144  -5.251
  398   2HB   HIS  51          1HB       HIS  51  14.128 -17.784  -5.719
  399    HD1  HIS  51           1HD      HIS  51  12.101 -15.398  -5.088
  400    HD2  HIS  51           2HD      HIS  51  13.076 -18.560  -2.560
  401    HE1  HIS  51           1HE      HIS  51  10.154 -15.636  -3.510
  402    HE2  HIS  51           2HE      HIS  51  10.843 -17.435  -1.882
  403    H    ASN  52           H        ASN  52  14.798 -19.579  -5.603
  404    HA   ASN  52           HA       ASN  52  17.490 -20.389  -6.366
  405   1HB   ASN  52          2HB       ASN  52  15.501 -21.972  -5.902
  406   2HB   ASN  52          1HB       ASN  52  14.895 -21.474  -7.476
  407   1HD2  ASN  52          1HD2      ASN  52  15.741 -24.090  -6.502
  408   2HD2  ASN  52          2HD2      ASN  52  16.978 -24.629  -7.594
  409    H    VAL  53           H        VAL  53  16.965 -17.793  -7.098
  410    HA   VAL  53           HA       VAL  53  15.988 -17.698  -9.813
  411    HB   VAL  53           HB       VAL  53  16.575 -15.268  -9.697
  412   1HG1  VAL  53          1HG1      VAL  53  14.794 -14.703  -8.101
  413   2HG1  VAL  53          2HG1      VAL  53  14.838 -16.356  -7.483
  414   3HG1  VAL  53          3HG1      VAL  53  14.345 -16.049  -9.148
  415   1HG2  VAL  53          1HG2      VAL  53  17.151 -14.305  -7.532
  416   2HG2  VAL  53          2HG2      VAL  53  18.408 -15.412  -8.085
  417   3HG2  VAL  53          3HG2      VAL  53  17.271 -15.918  -6.833
  418    H    GLN  54           H        GLN  54  19.134 -17.360  -8.198
  419    HA   GLN  54           HA       GLN  54  20.626 -18.210 -10.418
  420   1HB   GLN  54          2HB       GLN  54  19.750 -15.851 -11.108
  421   2HB   GLN  54          1HB       GLN  54  20.951 -15.249  -9.977
  422   1HG   GLN  54          2HG       GLN  54  21.775 -15.245 -12.276
  423   2HG   GLN  54          1HG       GLN  54  22.723 -16.310 -11.239
  424   1HE2  GLN  54          1HE2      GLN  54  19.559 -17.186 -12.424
  425   2HE2  GLN  54          2HE2      GLN  54  20.099 -18.419 -13.514
  426    H    GLY  55           H        GLY  55  23.022 -16.812  -9.957
  427   1HA   GLY  55          2HA       GLY  55  23.907 -18.092  -7.571
  428   2HA   GLY  55          1HA       GLY  55  24.870 -17.073  -8.617
  429    H    THR  56           H        THR  56  25.034 -14.882  -8.188
  430    HA   THR  56           HA       THR  56  23.621 -13.744  -5.938
  431    HB   THR  56           HB       THR  56  26.139 -13.000  -5.200
  432    HG1  THR  56           1HG      THR  56  26.802 -14.796  -6.754
  433   1HG2  THR  56          1HG2      THR  56  24.610 -15.388  -4.166
  434   2HG2  THR  56          2HG2      THR  56  24.321 -13.708  -3.713
  435   3HG2  THR  56          3HG2      THR  56  25.845 -14.488  -3.292
  436    H    THR  57           H        THR  57  22.855 -12.134  -7.200
  437    HA   THR  57           HA       THR  57  24.843 -10.135  -8.035
  438    HB   THR  57           HB       THR  57  23.096  -9.453  -9.797
  439    HG1  THR  57           1HG      THR  57  21.327 -10.627  -9.559
  440   1HG2  THR  57          1HG2      THR  57  23.977 -11.026 -11.438
  441   2HG2  THR  57          2HG2      THR  57  24.519 -12.097 -10.145
  442   3HG2  THR  57          3HG2      THR  57  25.257 -10.507 -10.343
  443    HA   PRO  58           HA       PRO  58  22.480  -7.800  -5.033
  444   1HB   PRO  58          2HB       PRO  58  23.782  -5.425  -5.417
  445   2HB   PRO  58          1HB       PRO  58  24.416  -6.741  -4.423
  446   1HG   PRO  58          2HG       PRO  58  25.098  -5.989  -7.235
  447   2HG   PRO  58          1HG       PRO  58  26.168  -6.526  -5.927
  448   1HD   PRO  58          2HD       PRO  58  25.360  -8.174  -7.915
  449   2HD   PRO  58          1HD       PRO  58  25.674  -8.752  -6.266
  450    H    SER  59           H        SER  59  20.552  -7.925  -6.275
  451    HA   SER  59           HA       SER  59  20.145  -6.006  -8.421
  452   1HB   SER  59          2HB       SER  59  18.224  -8.076  -7.339
  453   2HB   SER  59          1HB       SER  59  18.122  -7.234  -8.885
  454    HG   SER  59           HG       SER  59  20.187  -9.028  -8.099
  455    H    ALA  60           H        ALA  60  19.375  -6.461  -5.087
  456    HA   ALA  60           HA       ALA  60  17.034  -4.947  -4.884
  457   1HB   ALA  60          1HB       ALA  60  19.196  -5.326  -2.823
  458   2HB   ALA  60          2HB       ALA  60  17.829  -6.404  -3.100
  459   3HB   ALA  60          3HB       ALA  60  17.555  -4.767  -2.505
  460    H    ALA  61           H        ALA  61  20.349  -3.978  -5.141
  461    HA   ALA  61           HA       ALA  61  19.749  -1.259  -4.290
  462   1HB   ALA  61          1HB       ALA  61  22.157  -0.902  -4.378
  463   2HB   ALA  61          2HB       ALA  61  22.372  -2.517  -5.055
  464   3HB   ALA  61          3HB       ALA  61  21.756  -2.322  -3.414
  465    H    VAL  62           H        VAL  62  19.425  -2.859  -7.106
  466    HA   VAL  62           HA       VAL  62  20.665  -0.945  -8.880
  467    HB   VAL  62           HB       VAL  62  18.726  -3.174  -9.531
  468   1HG1  VAL  62          1HG1      VAL  62  19.503  -2.914 -11.837
  469   2HG1  VAL  62          2HG1      VAL  62  20.498  -1.543 -11.348
  470   3HG1  VAL  62          3HG1      VAL  62  18.741  -1.439 -11.244
  471   1HG2  VAL  62          1HG2      VAL  62  20.788  -4.020  -8.563
  472   2HG2  VAL  62          2HG2      VAL  62  21.732  -3.079  -9.716
  473   3HG2  VAL  62          3HG2      VAL  62  20.711  -4.400 -10.283
  474    H    SER  63           H        SER  63  17.328  -1.931  -8.256
  475    HA   SER  63           HA       SER  63  16.263   0.338  -9.643
  476   1HB   SER  63          2HB       SER  63  14.924  -1.718  -7.884
  477   2HB   SER  63          1HB       SER  63  14.090  -0.535  -8.883
  478    HG   SER  63           HG       SER  63  15.412  -1.528 -10.666
  479    H    GLU  64           H        GLU  64  17.291  -0.282  -6.460
  480    HA   GLU  64           HA       GLU  64  15.585   1.560  -5.103
  481   1HB   GLU  64          2HB       GLU  64  16.985  -0.426  -4.148
  482   2HB   GLU  64          1HB       GLU  64  18.273   0.767  -4.045
  483   1HG   GLU  64          2HG       GLU  64  17.262   0.778  -1.938
  484   2HG   GLU  64          1HG       GLU  64  16.628   2.207  -2.752
  485    H    ALA  65           H        ALA  65  18.310   1.905  -7.077
  486    HA   ALA  65           HA       ALA  65  19.772   3.986  -6.041
  487   1HB   ALA  65          1HB       ALA  65  20.393   4.531  -8.342
  488   2HB   ALA  65          2HB       ALA  65  19.062   3.543  -8.940
  489   3HB   ALA  65          3HB       ALA  65  20.398   2.787  -8.072
  490    H    GLU  66           H        GLU  66  16.647   4.143  -7.628
  491    HA   GLU  66           HA       GLU  66  16.428   6.893  -8.054
  492   1HB   GLU  66          2HB       GLU  66  14.819   5.171  -8.862
  493   2HB   GLU  66          1HB       GLU  66  14.234   4.981  -7.217
  494   1HG   GLU  66          2HG       GLU  66  12.724   6.379  -8.468
  495   2HG   GLU  66          1HG       GLU  66  13.521   7.335  -7.217
  496    H    GLN  67           H        GLN  67  15.694   4.945  -5.197
  497    HA   GLN  67           HA       GLN  67  14.752   7.174  -3.648
  498   1HB   GLN  67          2HB       GLN  67  15.690   4.598  -2.429
  499   2HB   GLN  67          1HB       GLN  67  14.353   5.630  -1.942
  500   1HG   GLN  67          2HG       GLN  67  14.426   3.848  -4.368
  501   2HG   GLN  67          1HG       GLN  67  13.568   3.526  -2.864
  502   1HE2  GLN  67          1HE2      GLN  67  12.585   3.753  -5.593
  503   2HE2  GLN  67          2HE2      GLN  67  11.393   5.015  -5.577
  504    H    ILE  68           H        ILE  68  17.709   5.351  -4.052
  505    HA   ILE  68           HA       ILE  68  19.171   6.267  -1.865
  506    HB   ILE  68           HB       ILE  68  20.152   5.430  -4.604
  507   1HG1  ILE  68          2HG1      ILE  68  20.014   3.931  -1.975
  508   2HG1  ILE  68          1HG1      ILE  68  18.904   3.718  -3.323
  509   1HG2  ILE  68          1HG2      ILE  68  22.347   5.106  -3.531
  510   2HG2  ILE  68          2HG2      ILE  68  21.709   5.822  -2.051
  511   3HG2  ILE  68          3HG2      ILE  68  21.839   6.797  -3.512
  512   1HD1  ILE  68          1HD1      ILE  68  20.521   1.948  -3.324
  513   2HD1  ILE  68          2HD1      ILE  68  21.845   3.114  -3.307
  514   3HD1  ILE  68          3HD1      ILE  68  20.797   2.992  -4.720
  515    H    ARG  69           H        ARG  69  19.126   7.554  -5.209
  516    HA   ARG  69           HA       ARG  69  20.948   9.633  -4.633
  517   1HB   ARG  69          2HB       ARG  69  20.224  10.620  -6.780
  518   2HB   ARG  69          1HB       ARG  69  20.660   8.923  -6.903
  519   1HG   ARG  69          2HG       ARG  69  18.269   8.329  -6.898
  520   2HG   ARG  69          1HG       ARG  69  17.864  10.048  -6.832
  521   1HD   ARG  69          2HD       ARG  69  18.896  10.442  -8.949
  522   2HD   ARG  69          1HD       ARG  69  19.562   8.815  -8.989
  523    HE   ARG  69           HE       ARG  69  16.644   9.104  -8.971
  524   1HH1  ARG  69          1HH1      ARG  69  19.603   8.304 -10.668
  525   2HH1  ARG  69          2HH1      ARG  69  18.789   7.640 -12.055
  526   1HH2  ARG  69          1HH2      ARG  69  15.557   8.205 -10.785
  527   2HH2  ARG  69          2HH2      ARG  69  16.490   7.595 -12.119
  528    H    GLN  70           H        GLN  70  17.500   9.406  -4.230
  529    HA   GLN  70           HA       GLN  70  16.974  12.184  -4.026
  530   1HB   GLN  70          2HB       GLN  70  15.362  10.204  -4.405
  531   2HB   GLN  70          1HB       GLN  70  15.412  10.009  -2.664
  532   1HG   GLN  70          2HG       GLN  70  14.829  12.721  -3.623
  533   2HG   GLN  70          1HG       GLN  70  13.611  11.500  -3.971
  534   1HE2  GLN  70          1HE2      GLN  70  12.134  12.476  -2.592
  535   2HE2  GLN  70          2HE2      GLN  70  12.279  12.384  -0.875
  536    H    LEU  71           H        LEU  71  17.434   9.626  -1.621
  537    HA   LEU  71           HA       LEU  71  17.261  11.422   0.607
  538   1HB   LEU  71          2HB       LEU  71  16.543   9.081   0.733
  539   2HB   LEU  71          1HB       LEU  71  18.191   8.556   0.459
  540    HG   LEU  71           HG       LEU  71  18.847   9.648   2.600
  541   1HD1  LEU  71          1HD1      LEU  71  15.871  10.005   2.934
  542   2HD1  LEU  71          2HD1      LEU  71  17.056  11.295   2.726
  543   3HD1  LEU  71          3HD1      LEU  71  17.095  10.290   4.175
  544   1HD2  LEU  71          1HD2      LEU  71  17.836   7.937   4.040
  545   2HD2  LEU  71          2HD2      LEU  71  18.390   7.264   2.508
  546   3HD2  LEU  71          3HD2      LEU  71  16.671   7.564   2.768
  547    H    LYS  72           H        LYS  72  19.827  10.063  -1.295
  548    HA   LYS  72           HA       LYS  72  21.946  10.525   0.540
  549   1HB   LYS  72          2HB       LYS  72  22.184   8.870  -1.179
  550   2HB   LYS  72          1HB       LYS  72  21.880  10.055  -2.437
  551   1HG   LYS  72          2HG       LYS  72  23.994  11.158  -1.904
  552   2HG   LYS  72          1HG       LYS  72  24.298   9.952  -0.648
  553   1HD   LYS  72          2HD       LYS  72  24.326   8.185  -2.293
  554   2HD   LYS  72          1HD       LYS  72  23.877   9.317  -3.569
  555   1HE   LYS  72          2HE       LYS  72  25.986  10.494  -3.291
  556   2HE   LYS  72          1HE       LYS  72  26.425   9.417  -1.963
  557   1HZ   LYS  72          1HZ       LYS  72  25.938   8.545  -4.762
  558   2HZ   LYS  72          2HZ       LYS  72  26.439   7.560  -3.477
  559   3HZ   LYS  72          3HZ       LYS  72  27.470   8.768  -4.069
  560    H    LYS  73           H        LYS  73  20.420  12.494  -1.927
  561    HA   LYS  73           HA       LYS  73  22.642  14.359  -1.916
  562   1HB   LYS  73          2HB       LYS  73  21.608  13.800  -4.062
  563   2HB   LYS  73          1HB       LYS  73  20.067  14.436  -3.499
  564   1HG   LYS  73          2HG       LYS  73  21.348  15.963  -4.988
  565   2HG   LYS  73          1HG       LYS  73  20.926  16.658  -3.420
  566   1HD   LYS  73          2HD       LYS  73  23.215  15.967  -2.622
  567   2HD   LYS  73          1HD       LYS  73  23.596  15.568  -4.297
  568   1HE   LYS  73          2HE       LYS  73  23.297  17.829  -4.979
  569   2HE   LYS  73          1HE       LYS  73  22.643  18.277  -3.405
  570   1HZ   LYS  73          1HZ       LYS  73  24.964  18.957  -3.683
  571   2HZ   LYS  73          2HZ       LYS  73  25.422  17.337  -3.890
  572   3HZ   LYS  73          3HZ       LYS  73  24.782  17.857  -2.407
  573    H    GLU  74           H        GLU  74  19.114  14.956  -1.706
  574    HA   GLU  74           HA       GLU  74  19.822  17.272  -0.033
  575   1HB   GLU  74          2HB       GLU  74  17.644  16.944  -2.092
  576   2HB   GLU  74          1HB       GLU  74  17.705  18.293  -0.965
  577   1HG   GLU  74          2HG       GLU  74  19.842  17.599  -2.969
  578   2HG   GLU  74          1HG       GLU  74  18.622  18.860  -3.161
  579    H    ASN  75           H        ASN  75  19.217  17.112   1.990
  580    HA   ASN  75           HA       ASN  75  17.147  15.348   2.874
  581   1HB   ASN  75          2HB       ASN  75  18.958  17.304   4.180
  582   2HB   ASN  75          1HB       ASN  75  17.449  16.953   5.012
  583   1HD2  ASN  75          1HD2      ASN  75  17.042  14.852   5.726
  584   2HD2  ASN  75          2HD2      ASN  75  18.327  13.716   5.958
  585    H    ALA  76           H        ALA  76  17.201  18.530   1.642
  586    HA   ALA  76           HA       ALA  76  15.014  19.698   2.925
  587   1HB   ALA  76          1HB       ALA  76  15.931  20.113   0.083
  588   2HB   ALA  76          2HB       ALA  76  16.559  20.949   1.504
  589   3HB   ALA  76          3HB       ALA  76  14.885  21.194   1.004
  590    H    LEU  77           H        LEU  77  15.173  17.208   0.572
  591    HA   LEU  77           HA       LEU  77  12.618  17.470  -0.586
  592   1HB   LEU  77          2HB       LEU  77  14.441  15.083  -0.323
  593   2HB   LEU  77          1HB       LEU  77  13.016  15.144  -1.339
  594    HG   LEU  77           HG       LEU  77  15.431  16.926  -1.651
  595   1HD1  LEU  77          1HD1      LEU  77  15.958  14.621  -2.213
  596   2HD1  LEU  77          2HD1      LEU  77  15.883  15.613  -3.667
  597   3HD1  LEU  77          3HD1      LEU  77  14.544  14.540  -3.266
  598   1HD2  LEU  77          1HD2      LEU  77  13.395  18.003  -2.413
  599   2HD2  LEU  77          2HD2      LEU  77  12.970  16.581  -3.363
  600   3HD2  LEU  77          3HD2      LEU  77  14.387  17.538  -3.793
  601    H    GLN  78           H        GLN  78  13.678  16.165   2.445
  602    HA   GLN  78           HA       GLN  78  11.744  14.182   2.859
  603   1HB   GLN  78          2HB       GLN  78  12.355  14.227   5.160
  604   2HB   GLN  78          1HB       GLN  78  13.809  14.570   4.238
  605   1HG   GLN  78          2HG       GLN  78  13.410  17.000   4.681
  606   2HG   GLN  78          1HG       GLN  78  12.118  16.520   5.780
  607   1HE2  GLN  78          1HE2      GLN  78  13.128  17.376   7.586
  608   2HE2  GLN  78          2HE2      GLN  78  14.552  16.670   8.276
  609    H    ARG  79           H        ARG  79  11.513  17.655   3.133
  610    HA   ARG  79           HA       ARG  79   9.136  17.621   4.742
  611   1HB   ARG  79          2HB       ARG  79  10.517  19.814   3.207
  612   2HB   ARG  79          1HB       ARG  79   9.042  20.074   4.127
  613   1HG   ARG  79          2HG       ARG  79  10.243  19.256   6.151
  614   2HG   ARG  79          1HG       ARG  79  11.720  19.195   5.186
  615   1HD   ARG  79          2HD       ARG  79  11.626  21.255   6.462
  616   2HD   ARG  79          1HD       ARG  79  11.513  21.592   4.735
  617    HE   ARG  79           HE       ARG  79   8.911  21.374   5.733
  618   1HH1  ARG  79          1HH1      ARG  79  11.708  23.466   6.080
  619   2HH1  ARG  79          2HH1      ARG  79  10.758  24.881   6.421
  620   1HH2  ARG  79          1HH2      ARG  79   7.663  23.238   6.199
  621   2HH2  ARG  79          2HH2      ARG  79   8.470  24.754   6.511
  622    H    ALA  80           H        ALA  80   9.776  17.146   1.470
  623    HA   ALA  80           HA       ALA  80   7.265  18.134   0.470
  624   1HB   ALA  80          1HB       ALA  80   9.293  18.091  -0.928
  625   2HB   ALA  80          2HB       ALA  80   7.945  17.219  -1.659
  626   3HB   ALA  80          3HB       ALA  80   9.260  16.328  -0.890
  627    H    ARG  81           H        ARG  81   8.395  15.260   1.943
  628    HA   ARG  81           HA       ARG  81   6.474  13.436   0.891
  629   1HB   ARG  81          2HB       ARG  81   8.050  13.383   3.464
  630   2HB   ARG  81          1HB       ARG  81   7.046  12.066   2.899
  631   1HG   ARG  81          2HG       ARG  81   8.496  12.073   0.806
  632   2HG   ARG  81          1HG       ARG  81   9.593  13.110   1.720
  633   1HD   ARG  81          2HD       ARG  81  10.397  10.913   2.026
  634   2HD   ARG  81          1HD       ARG  81   9.555  11.320   3.520
  635    HE   ARG  81           HE       ARG  81   8.065   9.861   1.466
  636   1HH1  ARG  81          1HH1      ARG  81   9.613   9.869   4.615
  637   2HH1  ARG  81          2HH1      ARG  81   9.016   8.290   5.049
  638   1HH2  ARG  81          1HH2      ARG  81   7.247   7.818   2.056
  639   2HH2  ARG  81          2HH2      ARG  81   7.628   7.144   3.607
  640    H    THR  82           H        THR  82   6.377  15.910   3.206
  641    HA   THR  82           HA       THR  82   4.252  14.963   4.830
  642    HB   THR  82           HB       THR  82   4.940  17.871   4.445
  643    HG1  THR  82           1HG      THR  82   6.406  15.812   5.731
  644   1HG2  THR  82          1HG2      THR  82   4.073  16.261   6.852
  645   2HG2  THR  82          2HG2      THR  82   3.037  17.326   5.903
  646   3HG2  THR  82          3HG2      THR  82   4.380  17.999   6.826
  647    H    ARG  83           H        ARG  83   4.294  16.161   1.661
  648    HA   ARG  83           HA       ARG  83   1.761  17.511   1.700
  649   1HB   ARG  83          2HB       ARG  83   3.743  17.683  -0.035
  650   2HB   ARG  83          1HB       ARG  83   2.904  16.344  -0.809
  651   1HG   ARG  83          2HG       ARG  83   0.832  17.994  -0.456
  652   2HG   ARG  83          1HG       ARG  83   2.127  19.185  -0.562
  653   1HD   ARG  83          2HD       ARG  83   1.458  18.957  -2.771
  654   2HD   ARG  83          1HD       ARG  83   2.843  17.873  -2.670
  655    HE   ARG  83           HE       ARG  83   0.722  16.264  -2.102
  656   1HH1  ARG  83          1HH1      ARG  83   1.529  18.367  -4.792
  657   2HH1  ARG  83          2HH1      ARG  83   0.576  17.474  -5.937
  658   1HH2  ARG  83          1HH2      ARG  83  -0.552  15.114  -3.593
  659   2HH2  ARG  83          2HH2      ARG  83  -0.627  15.642  -5.251
  660    H    HIS  84           H        HIS  84  -0.220  16.740   0.947
  661    HA   HIS  84           HA       HIS  84  -0.772  14.007   1.460
  662   1HB   HIS  84          2HB       HIS  84  -2.408  16.167   0.112
  663   2HB   HIS  84          1HB       HIS  84  -3.028  14.550   0.436
  664    HD1  HIS  84           1HD      HIS  84  -4.843  15.846   1.918
  665    HD2  HIS  84           2HD      HIS  84  -0.926  15.961   3.327
  666    HE1  HIS  84           1HE      HIS  84  -4.999  16.587   4.319
  667    HE2  HIS  84           2HE      HIS  84  -2.644  16.434   5.204
  668    HA   PRO  85           HA       PRO  85   0.468  12.261  -2.395
  669   1HB   PRO  85          2HB       PRO  85  -0.939   9.931  -2.294
  670   2HB   PRO  85          1HB       PRO  85   0.519  10.224  -1.340
  671   1HG   PRO  85          2HG       PRO  85  -2.352  10.413  -0.520
  672   2HG   PRO  85          1HG       PRO  85  -0.978   9.723   0.364
  673   1HD   PRO  85          2HD       PRO  85  -1.958  12.188   0.898
  674   2HD   PRO  85          1HD       PRO  85  -0.239  11.790   1.080
  675    H    ALA  86           H        ALA  86  -0.574  11.193  -4.367
  676    HA   ALA  86           HA       ALA  86  -3.058  12.646  -4.970
  677   1HB   ALA  86          1HB       ALA  86  -2.349  12.678  -7.295
  678   2HB   ALA  86          2HB       ALA  86  -0.901  11.761  -6.883
  679   3HB   ALA  86          3HB       ALA  86  -1.115  13.398  -6.263
  680    H    GLU  87           H        GLU  87  -4.508  11.086  -4.363
  681    HA   GLU  87           HA       GLU  87  -4.305   8.381  -5.275
  682   1HB   GLU  87          2HB       GLU  87  -6.634   8.193  -4.343
  683   2HB   GLU  87          1HB       GLU  87  -5.411   8.724  -3.196
  684   1HG   GLU  87          2HG       GLU  87  -6.170  10.986  -3.339
  685   2HG   GLU  87          1HG       GLU  87  -7.256  10.591  -4.672
  686    H    SER  88           H        SER  88  -5.641  11.304  -6.512
  687    HA   SER  88           HA       SER  88  -7.641  10.344  -8.207
  688   1HB   SER  88          2HB       SER  88  -5.791  12.685  -8.705
  689   2HB   SER  88          1HB       SER  88  -7.392  12.440  -9.406
  690    HG   SER  88           HG       SER  88  -7.925  13.642  -7.737
  691    H    CYS  89           H        CYS  89  -4.214  10.094  -8.438
  692    HA   CYS  89           HA       CYS  89  -3.870  10.016 -11.204
  693   1HB   CYS  89          2HB       CYS  89  -2.260   8.717  -9.012
  694   2HB   CYS  89          1HB       CYS  89  -1.738   8.833 -10.690
  695    HG   CYS  89           HG       CYS  89  -1.195  11.428 -10.735
  696    H    LEU  90           H        LEU  90  -5.162   7.608  -9.077
  697    HA   LEU  90           HA       LEU  90  -4.553   5.405 -10.807
  698   1HB   LEU  90          2HB       LEU  90  -5.996   4.070  -9.342
  699   2HB   LEU  90          1HB       LEU  90  -4.778   4.960  -8.460
  700    HG   LEU  90           HG       LEU  90  -6.692   6.681  -8.042
  701   1HD1  LEU  90          1HD1      LEU  90  -8.303   4.201  -8.616
  702   2HD1  LEU  90          2HD1      LEU  90  -8.299   5.670  -9.590
  703   3HD1  LEU  90          3HD1      LEU  90  -8.909   5.712  -7.936
  704   1HD2  LEU  90          1HD2      LEU  90  -7.363   5.433  -6.037
  705   2HD2  LEU  90          2HD2      LEU  90  -5.621   5.373  -6.306
  706   3HD2  LEU  90          3HD2      LEU  90  -6.623   3.978  -6.708
  707    H    GLU  91           H        GLU  91  -6.952   7.812 -10.764
  708    HA   GLU  91           HA       GLU  91  -8.945   6.278 -12.193
  709   1HB   GLU  91          2HB       GLU  91  -9.318   8.296 -10.588
  710   2HB   GLU  91          1HB       GLU  91  -8.891   9.286 -11.975
  711   1HG   GLU  91          2HG       GLU  91 -11.159   7.309 -11.878
  712   2HG   GLU  91          1HG       GLU  91 -11.312   9.051 -11.679
  713    H    HIS  92           H        HIS  92  -6.760   8.980 -12.911
  714    HA   HIS  92           HA       HIS  92  -7.387   8.844 -15.735
  715   1HB   HIS  92          2HB       HIS  92  -6.005  10.742 -13.947
  716   2HB   HIS  92          1HB       HIS  92  -5.382  10.661 -15.589
  717    HD1  HIS  92           1HD      HIS  92  -6.661  11.845 -17.368
  718    HD2  HIS  92           2HD      HIS  92  -8.783  11.552 -13.802
  719    HE1  HIS  92           1HE      HIS  92  -8.694  13.303 -17.663
  720    HE2  HIS  92           2HE      HIS  92  -9.861  13.258 -15.427
  721    H    HIS  93           H        HIS  93  -5.820   6.699 -14.270
  722    HA   HIS  93           HA       HIS  93  -3.208   6.906 -15.549
  723   1HB   HIS  93          2HB       HIS  93  -3.526   6.120 -13.146
  724   2HB   HIS  93          1HB       HIS  93  -4.186   4.634 -13.818
  725    HD1  HIS  93           1HD      HIS  93  -2.336   3.048 -13.140
  726    HD2  HIS  93           2HD      HIS  93  -0.934   6.402 -15.173
  727    HE1  HIS  93           1HE      HIS  93   0.101   2.605 -13.595
  728    HE2  HIS  93           2HE      HIS  93   0.877   4.561 -14.982
  729    H    HIS  94           H        HIS  94  -3.710   6.642 -17.704
  730    HA   HIS  94           HA       HIS  94  -4.649   3.951 -18.459
  731   1HB   HIS  94          2HB       HIS  94  -6.013   6.006 -19.209
  732   2HB   HIS  94          1HB       HIS  94  -4.664   6.355 -20.286
  733    HD1  HIS  94           1HD      HIS  94  -5.181   5.581 -22.583
  734    HD2  HIS  94           2HD      HIS  94  -6.776   3.043 -19.692
  735    HE1  HIS  94           1HE      HIS  94  -6.341   3.740 -23.851
  736    HE2  HIS  94           2HE      HIS  94  -7.452   2.325 -22.084
  737    H    HIS  95           H        HIS  95  -3.540   2.952 -20.271
  738    HA   HIS  95           HA       HIS  95  -0.779   2.985 -20.018
  739   1HB   HIS  95          2HB       HIS  95  -2.126   1.101 -20.934
  740   2HB   HIS  95          1HB       HIS  95  -2.354   2.021 -22.417
  741    HD1  HIS  95           1HD      HIS  95  -1.165  -0.503 -23.048
  742    HD2  HIS  95           2HD      HIS  95   1.225   2.590 -21.610
  743    HE1  HIS  95           1HE      HIS  95   1.179  -1.053 -23.778
  744    HE2  HIS  95           2HE      HIS  95   2.615   0.832 -22.907
  745    H    HIS  96           H        HIS  96   0.560   4.585 -20.490
  746    HA   HIS  96           HA       HIS  96   0.777   5.523 -23.197
  747   1HB   HIS  96          2HB       HIS  96  -0.936   7.083 -22.348
  748   2HB   HIS  96          1HB       HIS  96   0.130   7.530 -21.019
  749    HD1  HIS  96           1HD      HIS  96   1.943   9.254 -21.493
  750    HD2  HIS  96           2HD      HIS  96  -0.111   8.050 -24.909
  751    HE1  HIS  96           1HE      HIS  96   2.662  10.836 -23.311
  752    HE2  HIS  96           2HE      HIS  96   1.268  10.207 -25.315
  753    H    HIS  97           H        HIS  97   2.899   5.580 -23.590
  754    HA   HIS  97           HA       HIS  97   4.703   5.945 -21.307
  755   1HB   HIS  97          2HB       HIS  97   6.501   5.130 -22.895
  756   2HB   HIS  97          1HB       HIS  97   5.278   3.953 -22.448
  757    HD1  HIS  97           1HD      HIS  97   6.587   5.901 -25.350
  758    HD2  HIS  97           2HD      HIS  97   3.668   3.058 -24.547
  759    HE1  HIS  97           1HE      HIS  97   5.821   5.065 -27.595
  760    HE2  HIS  97           2HE      HIS  97   3.898   3.519 -27.078
  Start of MODEL    2
    1   1H    MET   1          1HT       MET   1   7.663  12.153 -17.530
    2   2H    MET   1          2HT       MET   1   9.133  11.491 -18.052
    3   3H    MET   1          3HT       MET   1   9.125  12.843 -17.032
    4    HA   MET   1           HA       MET   1   8.106  10.162 -16.313
    5   1HB   MET   1          2HB       MET   1  10.665  11.582 -15.553
    6   2HB   MET   1          1HB       MET   1  10.075  10.123 -14.771
    7   1HG   MET   1          2HG       MET   1  10.227   8.926 -16.895
    8   2HG   MET   1          1HG       MET   1  10.822  10.387 -17.674
    9   1HE   MET   1          1HE       MET   1  12.963   9.086 -18.591
   10   2HE   MET   1          2HE       MET   1  12.309   7.617 -17.859
   11   3HE   MET   1          3HE       MET   1  13.987   8.076 -17.566
   12    HA   PRO   2           HA       PRO   2   5.964  12.804 -13.396
   13   1HB   PRO   2          2HB       PRO   2   4.455  10.859 -12.280
   14   2HB   PRO   2          1HB       PRO   2   4.089  11.549 -13.865
   15   1HG   PRO   2          2HG       PRO   2   5.455   8.977 -13.189
   16   2HG   PRO   2          1HG       PRO   2   4.257   9.311 -14.451
   17   1HD   PRO   2          2HD       PRO   2   6.941   9.136 -14.924
   18   2HD   PRO   2          1HD       PRO   2   5.834  10.116 -15.905
   19    H    THR   3           H        THR   3   6.183  13.240 -11.215
   20    HA   THR   3           HA       THR   3   8.199  11.678  -9.805
   21    HB   THR   3           HB       THR   3   7.936  13.613  -8.113
   22    HG1  THR   3           1HG      THR   3   6.389  14.956  -8.627
   23   1HG2  THR   3          1HG2      THR   3   9.877  13.370  -9.570
   24   2HG2  THR   3          2HG2      THR   3   9.408  15.067  -9.454
   25   3HG2  THR   3          3HG2      THR   3   8.995  14.134 -10.892
   26    H    LYS   4           H        LYS   4   7.468  10.016  -8.680
   27    HA   LYS   4           HA       LYS   4   5.266  10.401  -6.822
   28   1HB   LYS   4          2HB       LYS   4   4.225   9.517  -8.895
   29   2HB   LYS   4          1HB       LYS   4   5.299   8.128  -8.822
   30   1HG   LYS   4          2HG       LYS   4   3.177   7.474  -7.972
   31   2HG   LYS   4          1HG       LYS   4   4.304   7.555  -6.616
   32   1HD   LYS   4          2HD       LYS   4   3.432   9.804  -6.069
   33   2HD   LYS   4          1HD       LYS   4   2.257   9.638  -7.379
   34   1HE   LYS   4          2HE       LYS   4   1.102   9.051  -5.411
   35   2HE   LYS   4          1HE       LYS   4   1.469   7.531  -6.220
   36   1HZ   LYS   4          1HZ       LYS   4   1.991   7.184  -3.987
   37   2HZ   LYS   4          2HZ       LYS   4   2.751   8.690  -3.821
   38   3HZ   LYS   4          3HZ       LYS   4   3.498   7.462  -4.716
   39    H    THR   5           H        THR   5   6.215   9.913  -4.968
   40    HA   THR   5           HA       THR   5   8.312   7.910  -4.841
   41    HB   THR   5           HB       THR   5   7.177   9.215  -2.404
   42    HG1  THR   5           1HG      THR   5   8.987  10.534  -4.183
   43   1HG2  THR   5          1HG2      THR   5   9.039   7.645  -2.181
   44   2HG2  THR   5          2HG2      THR   5   9.550   9.278  -1.752
   45   3HG2  THR   5          3HG2      THR   5   9.991   8.599  -3.320
   46    H    TYR   6           H        TYR   6   8.238   6.131  -3.354
   47    HA   TYR   6           HA       TYR   6   5.631   5.381  -2.278
   48   1HB   TYR   6          2HB       TYR   6   7.113   3.918  -4.397
   49   2HB   TYR   6          1HB       TYR   6   6.407   2.944  -3.113
   50    HD1  TYR   6           1HD      TYR   6   5.742   4.938  -6.074
   51    HD2  TYR   6           2HD      TYR   6   3.957   2.978  -2.743
   52    HE1  TYR   6           1HE      TYR   6   3.550   5.036  -7.191
   53    HE2  TYR   6           2HE      TYR   6   1.770   3.072  -3.853
   54    HH   TYR   6           HH       TYR   6   1.390   3.879  -7.127
   55    H    SER   7           H        SER   7   5.788   4.622  -0.289
   56    HA   SER   7           HA       SER   7   8.291   4.508   1.028
   57   1HB   SER   7          2HB       SER   7   6.863   3.640   2.955
   58   2HB   SER   7          1HB       SER   7   6.427   5.221   2.313
   59    HG   SER   7           HG       SER   7   4.562   4.011   2.545
   60    H    GLU   8           H        GLU   8   9.432   2.781   1.846
   61    HA   GLU   8           HA       GLU   8   9.527   0.445   0.303
   62   1HB   GLU   8          2HB       GLU   8  10.564   0.861   3.113
   63   2HB   GLU   8          1HB       GLU   8  11.051  -0.424   2.019
   64   1HG   GLU   8          2HG       GLU   8  12.007   1.214   0.497
   65   2HG   GLU   8          1HG       GLU   8  11.497   2.519   1.570
   66    H    GLU   9           H        GLU   9   7.975   1.154   3.365
   67    HA   GLU   9           HA       GLU   9   7.330  -1.382   4.226
   68   1HB   GLU   9          2HB       GLU   9   5.614   1.075   4.558
   69   2HB   GLU   9          1HB       GLU   9   5.721  -0.309   5.624
   70   1HG   GLU   9          2HG       GLU   9   7.833   1.759   5.134
   71   2HG   GLU   9          1HG       GLU   9   6.904   1.512   6.611
   72    H    PHE  10           H        PHE  10   5.565   0.765   2.038
   73    HA   PHE  10           HA       PHE  10   3.263  -0.879   1.787
   74   1HB   PHE  10          2HB       PHE  10   3.263   1.535   1.253
   75   2HB   PHE  10          1HB       PHE  10   4.348   1.234  -0.097
   76    HD1  PHE  10           1HD      PHE  10   0.949   0.641   1.193
   77    HD2  PHE  10           2HD      PHE  10   3.530   0.511  -2.184
   78    HE1  PHE  10           1HE      PHE  10  -0.995   0.293  -0.273
   79    HE2  PHE  10           2HE      PHE  10   1.593   0.162  -3.656
   80    HZ   PHE  10           HZ       PHE  10  -0.674   0.052  -2.703
   81    H    LYS  11           H        LYS  11   6.190  -0.456  -0.128
   82    HA   LYS  11           HA       LYS  11   5.479  -2.220  -2.219
   83   1HB   LYS  11          2HB       LYS  11   8.230  -1.362  -1.288
   84   2HB   LYS  11          1HB       LYS  11   7.843  -2.068  -2.853
   85   1HG   LYS  11          2HG       LYS  11   6.653  -0.160  -3.544
   86   2HG   LYS  11          1HG       LYS  11   6.585   0.486  -1.904
   87   1HD   LYS  11          2HD       LYS  11   8.208   1.747  -3.113
   88   2HD   LYS  11          1HD       LYS  11   9.069   0.712  -1.981
   89   1HE   LYS  11          2HE       LYS  11   9.523  -0.875  -3.781
   90   2HE   LYS  11          1HE       LYS  11   8.670   0.170  -4.911
   91   1HZ   LYS  11          1HZ       LYS  11  10.291   1.872  -4.601
   92   2HZ   LYS  11          2HZ       LYS  11  11.121   0.432  -4.951
   93   3HZ   LYS  11          3HZ       LYS  11  11.053   1.008  -3.357
   94    H    ARG  12           H        ARG  12   7.204  -2.654   0.821
   95    HA   ARG  12           HA       ARG  12   8.008  -5.336   0.379
   96   1HB   ARG  12          2HB       ARG  12   7.590  -3.747   2.909
   97   2HB   ARG  12          1HB       ARG  12   8.217  -5.389   2.899
   98   1HG   ARG  12          2HG       ARG  12  10.132  -4.688   1.604
   99   2HG   ARG  12          1HG       ARG  12   9.490  -3.046   1.502
  100   1HD   ARG  12          2HD       ARG  12   9.613  -2.864   3.947
  101   2HD   ARG  12          1HD       ARG  12  10.282  -4.494   4.024
  102    HE   ARG  12           HE       ARG  12  11.977  -3.194   2.357
  103   1HH1  ARG  12          1HH1      ARG  12  10.768  -2.523   5.573
  104   2HH1  ARG  12          2HH1      ARG  12  12.215  -1.704   6.079
  105   1HH2  ARG  12          1HH2      ARG  12  13.876  -2.093   3.013
  106   2HH2  ARG  12          2HH2      ARG  12  13.963  -1.444   4.620
  107    H    ASP  13           H        ASP  13   5.114  -3.884   1.765
  108    HA   ASP  13           HA       ASP  13   3.999  -6.262   2.811
  109   1HB   ASP  13          2HB       ASP  13   3.290  -3.863   3.314
  110   2HB   ASP  13          1HB       ASP  13   2.423  -3.900   1.784
  111    H    ALA  14           H        ALA  14   3.816  -4.687  -0.323
  112    HA   ALA  14           HA       ALA  14   1.917  -6.381  -1.523
  113   1HB   ALA  14          1HB       ALA  14   2.566  -4.229  -2.478
  114   2HB   ALA  14          2HB       ALA  14   2.789  -5.534  -3.647
  115   3HB   ALA  14          3HB       ALA  14   4.182  -4.856  -2.805
  116    H    VAL  15           H        VAL  15   5.409  -6.655  -1.119
  117    HA   VAL  15           HA       VAL  15   5.763  -8.922  -2.785
  118    HB   VAL  15           HB       VAL  15   7.422  -8.145  -0.370
  119   1HG1  VAL  15          1HG1      VAL  15   8.075  -9.858  -2.760
  120   2HG1  VAL  15          2HG1      VAL  15   7.854 -10.415  -1.102
  121   3HG1  VAL  15          3HG1      VAL  15   9.217  -9.372  -1.509
  122   1HG2  VAL  15          1HG2      VAL  15   7.652  -7.322  -3.256
  123   2HG2  VAL  15          2HG2      VAL  15   8.901  -7.058  -2.041
  124   3HG2  VAL  15          3HG2      VAL  15   7.327  -6.280  -1.871
  125    H    ALA  16           H        ALA  16   4.878  -8.496   0.588
  126    HA   ALA  16           HA       ALA  16   5.024 -11.217   1.363
  127   1HB   ALA  16          1HB       ALA  16   4.947  -9.354   2.979
  128   2HB   ALA  16          2HB       ALA  16   3.703 -10.563   3.292
  129   3HB   ALA  16          3HB       ALA  16   3.273  -9.041   2.517
  130    H    LEU  17           H        LEU  17   2.496  -9.254  -0.103
  131    HA   LEU  17           HA       LEU  17   0.408 -11.133   0.008
  132   1HB   LEU  17          2HB       LEU  17   0.967  -8.643  -1.398
  133   2HB   LEU  17          1HB       LEU  17   0.043  -9.757  -2.377
  134    HG   LEU  17           HG       LEU  17  -1.510  -8.332  -1.276
  135   1HD1  LEU  17          1HD1      LEU  17  -2.819  -9.898   0.061
  136   2HD1  LEU  17          2HD1      LEU  17  -1.422 -10.964   0.191
  137   3HD1  LEU  17          3HD1      LEU  17  -2.167 -10.678  -1.382
  138   1HD2  LEU  17          1HD2      LEU  17  -0.155  -9.062   1.316
  139   2HD2  LEU  17          2HD2      LEU  17  -1.586  -8.042   1.139
  140   3HD2  LEU  17          3HD2      LEU  17  -0.035  -7.509   0.487
  141    H    TYR  18           H        TYR  18   3.051 -10.675  -2.266
  142    HA   TYR  18           HA       TYR  18   2.237 -12.544  -4.206
  143   1HB   TYR  18          2HB       TYR  18   3.952 -10.973  -4.759
  144   2HB   TYR  18          1HB       TYR  18   4.962 -11.510  -3.422
  145    HD1  TYR  18           1HD      TYR  18   6.506 -13.250  -3.706
  146    HD2  TYR  18           2HD      TYR  18   3.572 -12.565  -6.710
  147    HE1  TYR  18           1HE      TYR  18   7.671 -14.820  -5.188
  148    HE2  TYR  18           2HE      TYR  18   4.734 -14.143  -8.205
  149    HH   TYR  18           HH       TYR  18   6.948 -15.115  -8.521
  150    H    GLU  19           H        GLU  19   4.173 -12.892  -1.273
  151    HA   GLU  19           HA       GLU  19   4.820 -15.617  -1.636
  152   1HB   GLU  19          2HB       GLU  19   4.576 -13.938   0.861
  153   2HB   GLU  19          1HB       GLU  19   5.178 -15.589   0.857
  154   1HG   GLU  19          2HG       GLU  19   6.410 -13.324  -0.698
  155   2HG   GLU  19          1HG       GLU  19   6.952 -13.868   0.890
  156    H    ASN  20           H        ASN  20   2.015 -13.979  -0.359
  157    HA   ASN  20           HA       ASN  20   0.805 -16.492   0.525
  158   1HB   ASN  20          2HB       ASN  20   0.067 -13.586   0.882
  159   2HB   ASN  20          1HB       ASN  20  -1.046 -14.882   1.297
  160   1HD2  ASN  20          1HD2      ASN  20   1.995 -13.353   2.061
  161   2HD2  ASN  20          2HD2      ASN  20   2.183 -14.065   3.633
  162    H    SER  21           H        SER  21   1.230 -16.256  -2.205
  163    HA   SER  21           HA       SER  21  -1.106 -15.262  -3.539
  164   1HB   SER  21          2HB       SER  21   0.006 -16.293  -5.554
  165   2HB   SER  21          1HB       SER  21   0.960 -15.087  -4.693
  166    HG   SER  21           HG       SER  21   2.387 -16.545  -4.232
  167    H    ASP  22           H        ASP  22  -0.367 -18.121  -1.944
  168    HA   ASP  22           HA       ASP  22  -1.430 -20.189  -3.389
  169   1HB   ASP  22          2HB       ASP  22  -1.950 -19.741  -0.446
  170   2HB   ASP  22          1HB       ASP  22  -1.999 -21.282  -1.292
  171    H    GLY  23           H        GLY  23  -3.221 -17.872  -1.424
  172   1HA   GLY  23          2HA       GLY  23  -5.715 -18.878  -2.620
  173   2HA   GLY  23          1HA       GLY  23  -5.609 -17.977  -1.119
  174    H    ALA  24           H        ALA  24  -3.531 -16.450  -3.154
  175    HA   ALA  24           HA       ALA  24  -5.616 -14.639  -4.154
  176   1HB   ALA  24          1HB       ALA  24  -3.096 -13.771  -2.740
  177   2HB   ALA  24          2HB       ALA  24  -4.724 -13.725  -2.062
  178   3HB   ALA  24          3HB       ALA  24  -4.318 -12.709  -3.445
  179    H    SER  25           H        SER  25  -5.424 -14.503  -6.268
  180    HA   SER  25           HA       SER  25  -3.282 -15.507  -7.762
  181   1HB   SER  25          2HB       SER  25  -5.348 -13.490  -8.668
  182   2HB   SER  25          1HB       SER  25  -4.438 -14.605  -9.689
  183    HG   SER  25           HG       SER  25  -5.489 -16.329  -8.583
  184    H    LEU  26           H        LEU  26  -1.661 -14.512  -8.953
  185    HA   LEU  26           HA       LEU  26  -0.300 -12.371  -7.769
  186   1HB   LEU  26          2HB       LEU  26   0.377 -14.237  -9.558
  187   2HB   LEU  26          1HB       LEU  26   0.077 -12.922 -10.675
  188    HG   LEU  26           HG       LEU  26   2.046 -12.777  -8.386
  189   1HD1  LEU  26          1HD1      LEU  26   2.531 -13.285 -11.317
  190   2HD1  LEU  26          2HD1      LEU  26   2.753 -14.445 -10.007
  191   3HD1  LEU  26          3HD1      LEU  26   3.777 -13.012 -10.099
  192   1HD2  LEU  26          1HD2      LEU  26   2.885 -10.801  -9.553
  193   2HD2  LEU  26          2HD2      LEU  26   1.193 -10.600  -9.095
  194   3HD2  LEU  26          3HD2      LEU  26   1.616 -10.973 -10.765
  195    H    GLN  27           H        GLN  27  -2.435 -12.482 -10.600
  196    HA   GLN  27           HA       GLN  27  -2.382  -9.782 -11.315
  197   1HB   GLN  27          2HB       GLN  27  -3.502 -11.377 -12.723
  198   2HB   GLN  27          1HB       GLN  27  -4.624 -11.805 -11.438
  199   1HG   GLN  27          2HG       GLN  27  -5.797 -10.425 -12.983
  200   2HG   GLN  27          1HG       GLN  27  -5.509  -9.475 -11.533
  201   1HE2  GLN  27          1HE2      GLN  27  -4.117  -7.738 -11.609
  202   2HE2  GLN  27          2HE2      GLN  27  -3.546  -7.069 -13.100
  203    H    GLN  28           H        GLN  28  -4.402 -11.467  -8.949
  204    HA   GLN  28           HA       GLN  28  -6.062  -9.299  -8.303
  205   1HB   GLN  28          2HB       GLN  28  -6.566 -11.674  -7.796
  206   2HB   GLN  28          1HB       GLN  28  -5.328 -11.646  -6.550
  207   1HG   GLN  28          2HG       GLN  28  -7.518 -11.397  -5.570
  208   2HG   GLN  28          1HG       GLN  28  -6.577  -9.921  -5.350
  209   1HE2  GLN  28          1HE2      GLN  28  -9.296 -11.381  -6.924
  210   2HE2  GLN  28          2HE2      GLN  28  -9.995  -9.917  -7.529
  211    H    ILE  29           H        ILE  29  -2.929 -10.277  -7.086
  212    HA   ILE  29           HA       ILE  29  -2.811  -8.725  -4.766
  213    HB   ILE  29           HB       ILE  29  -0.502  -9.250  -6.651
  214   1HG1  ILE  29          2HG1      ILE  29  -1.575 -11.367  -6.119
  215   2HG1  ILE  29          1HG1      ILE  29  -0.054 -11.248  -5.245
  216   1HG2  ILE  29          1HG2      ILE  29  -0.575  -8.676  -3.692
  217   2HG2  ILE  29          2HG2      ILE  29  -0.017  -7.580  -4.959
  218   3HG2  ILE  29          3HG2      ILE  29   0.872  -9.070  -4.623
  219   1HD1  ILE  29          1HD1      ILE  29  -1.746 -12.193  -3.827
  220   2HD1  ILE  29          2HD1      ILE  29  -2.805 -10.811  -4.111
  221   3HD1  ILE  29          3HD1      ILE  29  -1.297 -10.598  -3.224
  222    H    ALA  30           H        ALA  30  -1.633  -7.898  -8.032
  223    HA   ALA  30           HA       ALA  30  -1.122  -5.172  -7.370
  224   1HB   ALA  30          1HB       ALA  30  -0.741  -4.872  -9.756
  225   2HB   ALA  30          2HB       ALA  30  -1.435  -6.462 -10.077
  226   3HB   ALA  30          3HB       ALA  30   0.075  -6.325  -9.171
  227    H    ASN  31           H        ASN  31  -3.821  -6.928  -8.697
  228    HA   ASN  31           HA       ASN  31  -5.275  -4.723  -9.708
  229   1HB   ASN  31          2HB       ASN  31  -5.619  -7.083 -10.401
  230   2HB   ASN  31          1HB       ASN  31  -6.296  -7.426  -8.815
  231   1HD2  ASN  31          1HD2      ASN  31  -8.208  -8.095  -9.722
  232   2HD2  ASN  31          2HD2      ASN  31  -9.362  -6.985 -10.371
  233    H    ASP  32           H        ASP  32  -5.070  -6.230  -6.564
  234    HA   ASP  32           HA       ASP  32  -7.357  -4.921  -5.453
  235   1HB   ASP  32          2HB       ASP  32  -6.305  -7.021  -4.518
  236   2HB   ASP  32          1HB       ASP  32  -4.968  -6.026  -3.954
  237    H    LEU  33           H        LEU  33  -3.880  -4.300  -5.469
  238    HA   LEU  33           HA       LEU  33  -4.091  -1.974  -3.805
  239   1HB   LEU  33          2HB       LEU  33  -1.885  -3.310  -5.307
  240   2HB   LEU  33          1HB       LEU  33  -1.658  -1.670  -4.741
  241    HG   LEU  33           HG       LEU  33  -2.084  -2.419  -2.427
  242   1HD1  LEU  33          1HD1      LEU  33  -3.500  -4.339  -2.864
  243   2HD1  LEU  33          2HD1      LEU  33  -2.091  -4.807  -1.909
  244   3HD1  LEU  33          3HD1      LEU  33  -2.152  -5.178  -3.633
  245   1HD2  LEU  33          1HD2      LEU  33   0.189  -2.278  -3.265
  246   2HD2  LEU  33          2HD2      LEU  33   0.084  -3.933  -3.863
  247   3HD2  LEU  33          3HD2      LEU  33   0.020  -3.617  -2.128
  248    H    GLY  34           H        GLY  34  -4.511  -2.584  -7.127
  249   1HA   GLY  34          2HA       GLY  34  -5.269  -1.126  -8.760
  250   2HA   GLY  34          1HA       GLY  34  -5.085   0.199  -7.616
  251    H    ILE  35           H        ILE  35  -2.637  -2.120  -8.658
  252    HA   ILE  35           HA       ILE  35  -1.178   0.081  -9.956
  253    HB   ILE  35           HB       ILE  35   0.931  -0.927  -9.108
  254   1HG1  ILE  35          2HG1      ILE  35  -0.914  -2.510  -7.307
  255   2HG1  ILE  35          1HG1      ILE  35   0.042  -3.181  -8.624
  256   1HG2  ILE  35          1HG2      ILE  35   0.078   1.035  -8.030
  257   2HG2  ILE  35          2HG2      ILE  35   0.718  -0.053  -6.796
  258   3HG2  ILE  35          3HG2      ILE  35  -1.024   0.069  -7.051
  259   1HD1  ILE  35          1HD1      ILE  35   2.087  -2.578  -7.468
  260   2HD1  ILE  35          2HD1      ILE  35   1.062  -3.581  -6.443
  261   3HD1  ILE  35          3HD1      ILE  35   1.153  -1.842  -6.167
  262    H    ASN  36           H        ASN  36   0.624  -0.796 -11.357
  263    HA   ASN  36           HA       ASN  36  -0.364  -2.732 -13.171
  264   1HB   ASN  36          2HB       ASN  36   1.028  -0.898 -13.915
  265   2HB   ASN  36          1HB       ASN  36   2.327  -1.392 -12.848
  266   1HD2  ASN  36          1HD2      ASN  36   3.767  -1.509 -14.497
  267   2HD2  ASN  36          2HD2      ASN  36   3.730  -2.757 -15.684
  268    H    ARG  37           H        ARG  37   0.327  -4.847 -13.527
  269    HA   ARG  37           HA       ARG  37   1.151  -6.247 -11.188
  270   1HB   ARG  37          2HB       ARG  37  -0.426  -7.194 -12.836
  271   2HB   ARG  37          1HB       ARG  37   0.874  -7.280 -14.017
  272   1HG   ARG  37          2HG       ARG  37   2.026  -8.925 -12.775
  273   2HG   ARG  37          1HG       ARG  37   1.003  -8.674 -11.361
  274   1HD   ARG  37          2HD       ARG  37   0.367 -10.719 -12.485
  275   2HD   ARG  37          1HD       ARG  37  -0.924  -9.531 -12.626
  276    HE   ARG  37           HE       ARG  37   0.423  -9.172 -14.928
  277   1HH1  ARG  37          1HH1      ARG  37  -0.808 -12.038 -13.334
  278   2HH1  ARG  37          2HH1      ARG  37  -1.067 -12.920 -14.809
  279   1HH2  ARG  37          1HH2      ARG  37   0.086 -10.309 -16.877
  280   2HH2  ARG  37          2HH2      ARG  37  -0.544 -11.932 -16.836
  281    H    VAL  38           H        VAL  38   2.743  -5.173 -14.108
  282    HA   VAL  38           HA       VAL  38   5.163  -6.618 -13.698
  283    HB   VAL  38           HB       VAL  38   4.855  -4.001 -15.177
  284   1HG1  VAL  38          1HG1      VAL  38   7.161  -4.572 -14.794
  285   2HG1  VAL  38          2HG1      VAL  38   6.777  -4.847 -16.493
  286   3HG1  VAL  38          3HG1      VAL  38   6.890  -6.211 -15.382
  287   1HG2  VAL  38          1HG2      VAL  38   4.479  -6.815 -16.198
  288   2HG2  VAL  38          2HG2      VAL  38   4.534  -5.366 -17.203
  289   3HG2  VAL  38          3HG2      VAL  38   3.226  -5.582 -16.039
  290    H    THR  39           H        THR  39   4.049  -3.369 -12.830
  291    HA   THR  39           HA       THR  39   6.421  -2.502 -11.590
  292    HB   THR  39           HB       THR  39   3.595  -1.702 -10.861
  293    HG1  THR  39           1HG      THR  39   5.198  -0.275 -12.691
  294   1HG2  THR  39          1HG2      THR  39   5.314  -0.904  -9.300
  295   2HG2  THR  39          2HG2      THR  39   4.624   0.429 -10.226
  296   3HG2  THR  39          3HG2      THR  39   6.216  -0.207 -10.646
  297    H    LEU  40           H        LEU  40   3.654  -4.345 -10.411
  298    HA   LEU  40           HA       LEU  40   4.348  -4.501  -7.701
  299   1HB   LEU  40          2HB       LEU  40   2.186  -5.245  -8.512
  300   2HB   LEU  40          1HB       LEU  40   2.941  -6.496  -9.482
  301    HG   LEU  40           HG       LEU  40   3.768  -7.514  -7.320
  302   1HD1  LEU  40          1HD1      LEU  40   3.500  -5.527  -5.913
  303   2HD1  LEU  40          2HD1      LEU  40   2.598  -6.903  -5.275
  304   3HD1  LEU  40          3HD1      LEU  40   1.752  -5.613  -6.131
  305   1HD2  LEU  40          1HD2      LEU  40   1.881  -8.416  -8.584
  306   2HD2  LEU  40          2HD2      LEU  40   0.788  -7.320  -7.736
  307   3HD2  LEU  40          3HD2      LEU  40   1.632  -8.587  -6.846
  308    H    LYS  41           H        LYS  41   5.084  -6.712 -10.380
  309    HA   LYS  41           HA       LYS  41   6.597  -8.563  -8.918
  310   1HB   LYS  41          2HB       LYS  41   5.600  -8.671 -11.308
  311   2HB   LYS  41          1HB       LYS  41   7.119  -7.942 -11.806
  312   1HG   LYS  41          2HG       LYS  41   8.365  -9.805 -10.949
  313   2HG   LYS  41          1HG       LYS  41   6.901 -10.517 -10.261
  314   1HD   LYS  41          2HD       LYS  41   5.981 -10.549 -12.621
  315   2HD   LYS  41          1HD       LYS  41   7.619 -10.176 -13.163
  316   1HE   LYS  41          2HE       LYS  41   8.465 -12.195 -12.154
  317   2HE   LYS  41          1HE       LYS  41   6.883 -12.551 -11.460
  318   1HZ   LYS  41          1HZ       LYS  41   7.556 -12.488 -14.353
  319   2HZ   LYS  41          2HZ       LYS  41   6.003 -12.745 -13.728
  320   3HZ   LYS  41          3HZ       LYS  41   7.235 -13.867 -13.424
  321    H    ASN  42           H        ASN  42   7.456  -5.598 -10.535
  322    HA   ASN  42           HA       ASN  42  10.228  -5.641 -10.521
  323   1HB   ASN  42          2HB       ASN  42   8.722  -3.821 -11.395
  324   2HB   ASN  42          1HB       ASN  42   8.502  -3.282  -9.752
  325   1HD2  ASN  42          1HD2      ASN  42  10.752  -3.532 -12.395
  326   2HD2  ASN  42          2HD2      ASN  42  11.915  -2.418 -11.763
  327    H    TRP  43           H        TRP  43   8.125  -4.288  -8.039
  328    HA   TRP  43           HA       TRP  43  10.063  -3.819  -6.078
  329   1HB   TRP  43          2HB       TRP  43   7.143  -4.508  -5.696
  330   2HB   TRP  43          1HB       TRP  43   8.186  -3.814  -4.459
  331    HD1  TRP  43           HD       TRP  43   9.479  -1.814  -6.926
  332    HE1  TRP  43           1HE      TRP  43   8.140   0.339  -7.394
  333    HE3  TRP  43           3HE      TRP  43   5.033  -3.159  -4.788
  334    HZ2  TRP  43           2HZ      TRP  43   5.539   1.328  -6.901
  335    HZ3  TRP  43           3HZ      TRP  43   3.172  -1.551  -4.821
  336    HH2  TRP  43           HH       TRP  43   3.419   0.647  -5.857
  337    H    ILE  44           H        ILE  44   8.092  -6.682  -6.684
  338    HA   ILE  44           HA       ILE  44   8.784  -8.191  -4.435
  339    HB   ILE  44           HB       ILE  44   8.098  -9.181  -7.208
  340   1HG1  ILE  44          2HG1      ILE  44   6.327  -8.856  -4.777
  341   2HG1  ILE  44          1HG1      ILE  44   6.428  -7.682  -6.086
  342   1HG2  ILE  44          1HG2      ILE  44   9.181 -10.915  -5.885
  343   2HG2  ILE  44          2HG2      ILE  44   7.467 -11.275  -6.105
  344   3HG2  ILE  44          3HG2      ILE  44   8.045 -10.630  -4.567
  345   1HD1  ILE  44          1HD1      ILE  44   4.488  -9.101  -6.349
  346   2HD1  ILE  44          2HD1      ILE  44   5.513 -10.537  -6.335
  347   3HD1  ILE  44          3HD1      ILE  44   5.635  -9.378  -7.656
  348    H    ILE  45           H        ILE  45  10.423  -7.855  -7.548
  349    HA   ILE  45           HA       ILE  45  12.363  -9.870  -7.072
  350    HB   ILE  45           HB       ILE  45  12.507  -7.454  -8.884
  351   1HG1  ILE  45          2HG1      ILE  45  11.849 -10.341  -9.509
  352   2HG1  ILE  45          1HG1      ILE  45  10.657  -9.051  -9.368
  353   1HG2  ILE  45          1HG2      ILE  45  14.741  -8.282  -8.411
  354   2HG2  ILE  45          2HG2      ILE  45  14.284  -8.693 -10.062
  355   3HG2  ILE  45          3HG2      ILE  45  14.243  -9.928  -8.805
  356   1HD1  ILE  45          1HD1      ILE  45  11.667  -7.918 -11.285
  357   2HD1  ILE  45          2HD1      ILE  45  11.174  -9.560 -11.697
  358   3HD1  ILE  45          3HD1      ILE  45  12.876  -9.197 -11.405
  359    H    LYS  46           H        LYS  46  12.397  -6.348  -6.608
  360    HA   LYS  46           HA       LYS  46  15.112  -6.203  -5.839
  361   1HB   LYS  46          2HB       LYS  46  13.841  -4.268  -6.688
  362   2HB   LYS  46          1HB       LYS  46  12.858  -4.280  -5.234
  363   1HG   LYS  46          2HG       LYS  46  15.754  -4.103  -4.764
  364   2HG   LYS  46          1HG       LYS  46  15.044  -2.723  -5.601
  365   1HD   LYS  46          2HD       LYS  46  13.387  -2.498  -3.801
  366   2HD   LYS  46          1HD       LYS  46  14.117  -3.870  -2.965
  367   1HE   LYS  46          2HE       LYS  46  15.603  -1.340  -3.660
  368   2HE   LYS  46          1HE       LYS  46  14.803  -1.608  -2.112
  369   1HZ   LYS  46          1HZ       LYS  46  17.124  -2.140  -1.925
  370   2HZ   LYS  46          2HZ       LYS  46  17.049  -3.201  -3.242
  371   3HZ   LYS  46          3HZ       LYS  46  16.227  -3.577  -1.804
  372    H    TYR  47           H        TYR  47  12.116  -6.189  -3.880
  373    HA   TYR  47           HA       TYR  47  13.649  -6.149  -1.443
  374   1HB   TYR  47          2HB       TYR  47  10.682  -6.464  -1.934
  375   2HB   TYR  47          1HB       TYR  47  11.415  -6.382  -0.333
  376    HD1  TYR  47           1HD      TYR  47  12.591  -4.291   0.377
  377    HD2  TYR  47           2HD      TYR  47  10.333  -4.500  -3.221
  378    HE1  TYR  47           1HE      TYR  47  12.524  -1.836   0.282
  379    HE2  TYR  47           2HE      TYR  47  10.259  -2.048  -3.322
  380    HH   TYR  47           HH       TYR  47  12.236  -0.066  -1.432
  381    H    GLY  48           H        GLY  48  12.055  -8.580  -3.386
  382   1HA   GLY  48          2HA       GLY  48  12.290 -10.687  -1.460
  383   2HA   GLY  48          1HA       GLY  48  11.951 -10.872  -3.173
  384    H    SER  49           H        SER  49  14.605  -9.054  -3.186
  385    HA   SER  49           HA       SER  49  16.383 -11.195  -3.798
  386   1HB   SER  49          2HB       SER  49  16.505  -8.955  -4.893
  387   2HB   SER  49          1HB       SER  49  17.042  -8.271  -3.359
  388    HG   SER  49           HG       SER  49  18.673 -10.192  -3.672
  389    H    ASN  50           H        ASN  50  15.572  -9.397  -0.981
  390    HA   ASN  50           HA       ASN  50  16.024  -9.751   1.211
  391   1HB   ASN  50          2HB       ASN  50  16.155 -12.153   0.693
  392   2HB   ASN  50          1HB       ASN  50  17.857 -11.966   0.282
  393   1HD2  ASN  50          1HD2      ASN  50  15.508 -12.038   2.823
  394   2HD2  ASN  50          2HD2      ASN  50  16.634 -12.200   4.133
  395    H    HIS  51           H        HIS  51  19.129 -10.377  -0.437
  396    HA   HIS  51           HA       HIS  51  20.219  -8.003   0.880
  397   1HB   HIS  51          2HB       HIS  51  20.693 -10.023   2.291
  398   2HB   HIS  51          1HB       HIS  51  21.615 -10.682   0.949
  399    HD1  HIS  51           1HD      HIS  51  23.621 -10.661   2.724
  400    HD2  HIS  51           2HD      HIS  51  22.238  -6.937   1.490
  401    HE1  HIS  51           1HE      HIS  51  25.408  -9.018   3.388
  402    HE2  HIS  51           2HE      HIS  51  24.449  -6.754   2.818
  403    H    ASN  52           H        ASN  52  20.776  -6.814  -0.785
  404    HA   ASN  52           HA       ASN  52  22.836  -7.442  -2.576
  405   1HB   ASN  52          2HB       ASN  52  21.082  -8.926  -3.556
  406   2HB   ASN  52          1HB       ASN  52  20.079  -7.509  -3.825
  407   1HD2  ASN  52          1HD2      ASN  52  20.053  -7.948  -6.026
  408   2HD2  ASN  52          2HD2      ASN  52  21.405  -7.601  -7.045
  409    H    VAL  53           H        VAL  53  23.683  -5.457  -2.638
  410    HA   VAL  53           HA       VAL  53  21.988  -3.171  -2.211
  411    HB   VAL  53           HB       VAL  53  23.999  -3.205  -0.957
  412   1HG1  VAL  53          1HG1      VAL  53  25.304  -4.629  -2.549
  413   2HG1  VAL  53          2HG1      VAL  53  26.199  -3.316  -1.791
  414   3HG1  VAL  53          3HG1      VAL  53  25.654  -3.159  -3.458
  415   1HG2  VAL  53          1HG2      VAL  53  25.032  -1.066  -1.579
  416   2HG2  VAL  53          2HG2      VAL  53  23.272  -1.011  -1.632
  417   3HG2  VAL  53          3HG2      VAL  53  24.194  -1.134  -3.128
  418    H    GLN  54           H        GLN  54  24.532  -3.777  -4.673
  419    HA   GLN  54           HA       GLN  54  23.267  -1.754  -6.357
  420   1HB   GLN  54          2HB       GLN  54  25.943  -2.579  -5.845
  421   2HB   GLN  54          1HB       GLN  54  25.612  -2.831  -7.553
  422   1HG   GLN  54          2HG       GLN  54  25.096  -0.554  -7.888
  423   2HG   GLN  54          1HG       GLN  54  25.027  -0.245  -6.151
  424   1HE2  GLN  54          1HE2      GLN  54  26.913  -0.079  -4.982
  425   2HE2  GLN  54          2HE2      GLN  54  28.455   0.117  -5.730
  426    H    GLY  55           H        GLY  55  23.230  -2.152  -8.723
  427   1HA   GLY  55          2HA       GLY  55  23.357  -4.652  -9.930
  428   2HA   GLY  55          1HA       GLY  55  21.710  -4.456  -9.338
  429    H    THR  56           H        THR  56  23.747  -3.946 -11.898
  430    HA   THR  56           HA       THR  56  23.799  -2.692 -13.765
  431    HB   THR  56           HB       THR  56  21.537  -2.277 -14.819
  432    HG1  THR  56           1HG      THR  56  20.628  -2.530 -12.439
  433   1HG2  THR  56          1HG2      THR  56  22.861  -4.276 -15.280
  434   2HG2  THR  56          2HG2      THR  56  21.137  -4.646 -15.254
  435   3HG2  THR  56          3HG2      THR  56  22.148  -5.072 -13.873
  436    H    THR  57           H        THR  57  24.779  -0.806 -13.228
  437    HA   THR  57           HA       THR  57  23.027   1.519 -13.017
  438    HB   THR  57           HB       THR  57  25.292   1.098 -11.056
  439    HG1  THR  57           1HG      THR  57  22.635   0.364 -10.986
  440   1HG2  THR  57          1HG2      THR  57  23.164   3.236 -11.245
  441   2HG2  THR  57          2HG2      THR  57  24.879   3.445 -11.609
  442   3HG2  THR  57          3HG2      THR  57  24.363   3.094  -9.957
  443    HA   PRO  58           HA       PRO  58  26.476   2.563 -15.791
  444   1HB   PRO  58          2HB       PRO  58  24.657   4.079 -17.375
  445   2HB   PRO  58          1HB       PRO  58  25.338   2.493 -17.744
  446   1HG   PRO  58          2HG       PRO  58  22.660   3.015 -17.207
  447   2HG   PRO  58          1HG       PRO  58  23.433   1.422 -17.133
  448   1HD   PRO  58          2HD       PRO  58  22.760   3.313 -14.920
  449   2HD   PRO  58          1HD       PRO  58  22.717   1.536 -14.940
  450    H    SER  59           H        SER  59  27.673   4.047 -14.729
  451    HA   SER  59           HA       SER  59  26.604   6.416 -13.575
  452   1HB   SER  59          2HB       SER  59  29.082   6.969 -13.297
  453   2HB   SER  59          1HB       SER  59  28.517   5.483 -12.534
  454    HG   SER  59           HG       SER  59  30.145   4.655 -13.609
  455    H    ALA  60           H        ALA  60  28.045   5.631 -16.647
  456    HA   ALA  60           HA       ALA  60  28.759   8.243 -17.457
  457   1HB   ALA  60          1HB       ALA  60  28.039   5.876 -19.175
  458   2HB   ALA  60          2HB       ALA  60  29.640   6.237 -18.531
  459   3HB   ALA  60          3HB       ALA  60  28.897   7.325 -19.701
  460    H    ALA  61           H        ALA  61  25.720   6.719 -17.175
  461    HA   ALA  61           HA       ALA  61  24.404   8.125 -19.285
  462   1HB   ALA  61          1HB       ALA  61  23.204   6.650 -16.952
  463   2HB   ALA  61          2HB       ALA  61  23.624   5.942 -18.512
  464   3HB   ALA  61          3HB       ALA  61  22.358   7.164 -18.411
  465    H    VAL  62           H        VAL  62  25.496   9.117 -16.327
  466    HA   VAL  62           HA       VAL  62  23.383  10.944 -15.679
  467    HB   VAL  62           HB       VAL  62  26.259  10.934 -14.718
  468   1HG1  VAL  62          1HG1      VAL  62  25.450  12.320 -12.871
  469   2HG1  VAL  62          2HG1      VAL  62  23.843  12.359 -13.600
  470   3HG1  VAL  62          3HG1      VAL  62  25.205  13.119 -14.425
  471   1HG2  VAL  62          1HG2      VAL  62  25.118   8.879 -14.118
  472   2HG2  VAL  62          2HG2      VAL  62  23.761   9.797 -13.463
  473   3HG2  VAL  62          3HG2      VAL  62  25.342   9.885 -12.686
  474    H    SER  63           H        SER  63  26.506  11.140 -17.259
  475    HA   SER  63           HA       SER  63  26.424  13.911 -17.824
  476   1HB   SER  63          2HB       SER  63  27.903  11.786 -19.390
  477   2HB   SER  63          1HB       SER  63  28.325  13.486 -19.218
  478    HG   SER  63           HG       SER  63  28.909  13.141 -17.114
  479    H    GLU  64           H        GLU  64  25.296  11.042 -19.461
  480    HA   GLU  64           HA       GLU  64  24.711  12.303 -21.948
  481   1HB   GLU  64          2HB       GLU  64  25.207   9.912 -21.777
  482   2HB   GLU  64          1HB       GLU  64  23.775   9.674 -20.788
  483   1HG   GLU  64          2HG       GLU  64  22.337  10.165 -22.628
  484   2HG   GLU  64          1HG       GLU  64  23.700  10.680 -23.622
  485    H    ALA  65           H        ALA  65  22.920  11.584 -19.047
  486    HA   ALA  65           HA       ALA  65  20.326  12.050 -19.954
  487   1HB   ALA  65          1HB       ALA  65  19.725  12.349 -17.626
  488   2HB   ALA  65          2HB       ALA  65  21.421  12.575 -17.198
  489   3HB   ALA  65          3HB       ALA  65  20.866  11.015 -17.801
  490    H    GLU  66           H        GLU  66  22.776  14.300 -18.738
  491    HA   GLU  66           HA       GLU  66  21.154  16.576 -18.511
  492   1HB   GLU  66          2HB       GLU  66  23.537  16.348 -17.709
  493   2HB   GLU  66          1HB       GLU  66  24.046  16.561 -19.377
  494   1HG   GLU  66          2HG       GLU  66  22.867  18.754 -19.389
  495   2HG   GLU  66          1HG       GLU  66  22.573  18.544 -17.665
  496    H    GLN  67           H        GLN  67  23.094  15.396 -21.215
  497    HA   GLN  67           HA       GLN  67  22.453  17.482 -23.009
  498   1HB   GLN  67          2HB       GLN  67  23.346  14.651 -23.611
  499   2HB   GLN  67          1HB       GLN  67  23.422  16.020 -24.717
  500   1HG   GLN  67          2HG       GLN  67  25.063  17.109 -23.407
  501   2HG   GLN  67          1HG       GLN  67  24.837  15.986 -22.069
  502   1HE2  GLN  67          1HE2      GLN  67  26.960  15.371 -21.997
  503   2HE2  GLN  67          2HE2      GLN  67  27.697  14.400 -23.219
  504    H    ILE  68           H        ILE  68  21.050  14.330 -22.361
  505    HA   ILE  68           HA       ILE  68  19.085  14.329 -24.374
  506    HB   ILE  68           HB       ILE  68  19.188  13.000 -21.662
  507   1HG1  ILE  68          2HG1      ILE  68  20.826  12.206 -23.287
  508   2HG1  ILE  68          1HG1      ILE  68  19.609  10.970 -23.004
  509   1HG2  ILE  68          1HG2      ILE  68  17.124  12.611 -23.836
  510   2HG2  ILE  68          2HG2      ILE  68  16.847  13.288 -22.229
  511   3HG2  ILE  68          3HG2      ILE  68  17.304  11.593 -22.405
  512   1HD1  ILE  68          1HD1      ILE  68  18.499  11.579 -25.091
  513   2HD1  ILE  68          2HD1      ILE  68  20.182  11.111 -25.357
  514   3HD1  ILE  68          3HD1      ILE  68  19.725  12.815 -25.375
  515    H    ARG  69           H        ARG  69  19.089  15.618 -21.081
  516    HA   ARG  69           HA       ARG  69  16.387  16.391 -20.977
  517   1HB   ARG  69          2HB       ARG  69  18.837  17.342 -19.513
  518   2HB   ARG  69          1HB       ARG  69  17.253  18.042 -19.210
  519   1HG   ARG  69          2HG       ARG  69  17.653  15.085 -19.049
  520   2HG   ARG  69          1HG       ARG  69  18.102  16.128 -17.700
  521   1HD   ARG  69          2HD       ARG  69  15.809  15.176 -17.520
  522   2HD   ARG  69          1HD       ARG  69  15.856  16.937 -17.492
  523    HE   ARG  69           HE       ARG  69  15.395  15.816 -20.103
  524   1HH1  ARG  69          1HH1      ARG  69  13.874  16.790 -17.112
  525   2HH1  ARG  69          2HH1      ARG  69  12.367  17.238 -17.871
  526   1HH2  ARG  69          1HH2      ARG  69  13.394  16.334 -21.100
  527   2HH2  ARG  69          2HH2      ARG  69  12.090  16.946 -20.136
  528    H    GLN  70           H        GLN  70  19.252  18.095 -22.140
  529    HA   GLN  70           HA       GLN  70  17.863  20.538 -22.654
  530   1HB   GLN  70          2HB       GLN  70  20.532  19.600 -22.621
  531   2HB   GLN  70          1HB       GLN  70  20.237  20.215 -24.231
  532   1HG   GLN  70          2HG       GLN  70  19.756  21.755 -21.689
  533   2HG   GLN  70          1HG       GLN  70  21.212  21.875 -22.669
  534   1HE2  GLN  70          1HE2      GLN  70  20.981  24.027 -23.115
  535   2HE2  GLN  70          2HE2      GLN  70  19.734  24.658 -24.142
  536    H    LEU  71           H        LEU  71  18.671  17.651 -24.463
  537    HA   LEU  71           HA       LEU  71  18.101  18.593 -27.044
  538   1HB   LEU  71          2HB       LEU  71  19.250  16.412 -26.276
  539   2HB   LEU  71          1HB       LEU  71  17.629  15.760 -26.148
  540    HG   LEU  71           HG       LEU  71  18.819  15.171 -28.262
  541   1HD1  LEU  71          1HD1      LEU  71  16.311  16.804 -28.626
  542   2HD1  LEU  71          2HD1      LEU  71  16.386  15.100 -28.182
  543   3HD1  LEU  71          3HD1      LEU  71  16.952  15.624 -29.767
  544   1HD2  LEU  71          1HD2      LEU  71  20.025  17.276 -28.569
  545   2HD2  LEU  71          2HD2      LEU  71  18.503  18.104 -28.889
  546   3HD2  LEU  71          3HD2      LEU  71  19.078  16.858 -29.995
  547    H    LYS  72           H        LYS  72  16.040  16.682 -24.831
  548    HA   LYS  72           HA       LYS  72  13.770  17.091 -26.575
  549   1HB   LYS  72          2HB       LYS  72  14.210  14.937 -25.373
  550   2HB   LYS  72          1HB       LYS  72  13.847  15.759 -23.864
  551   1HG   LYS  72          2HG       LYS  72  11.970  14.412 -24.758
  552   2HG   LYS  72          1HG       LYS  72  11.575  16.118 -24.527
  553   1HD   LYS  72          2HD       LYS  72  10.686  15.282 -26.645
  554   2HD   LYS  72          1HD       LYS  72  11.902  16.527 -26.910
  555   1HE   LYS  72          2HE       LYS  72  12.308  14.807 -28.497
  556   2HE   LYS  72          1HE       LYS  72  13.571  14.686 -27.275
  557   1HZ   LYS  72          1HZ       LYS  72  11.123  13.005 -27.349
  558   2HZ   LYS  72          2HZ       LYS  72  12.426  12.839 -26.273
  559   3HZ   LYS  72          3HZ       LYS  72  12.643  12.527 -27.925
  560    H    LYS  73           H        LYS  73  14.973  18.339 -23.549
  561    HA   LYS  73           HA       LYS  73  14.444  20.147 -22.309
  562   1HB   LYS  73          2HB       LYS  73  12.863  20.798 -24.776
  563   2HB   LYS  73          1HB       LYS  73  12.814  21.835 -23.356
  564   1HG   LYS  73          2HG       LYS  73  15.153  22.276 -23.506
  565   2HG   LYS  73          1HG       LYS  73  15.356  21.062 -24.769
  566   1HD   LYS  73          2HD       LYS  73  13.597  23.485 -25.084
  567   2HD   LYS  73          1HD       LYS  73  15.301  23.466 -25.541
  568   1HE   LYS  73          2HE       LYS  73  13.182  21.602 -26.606
  569   2HE   LYS  73          1HE       LYS  73  13.806  23.022 -27.446
  570   1HZ   LYS  73          1HZ       LYS  73  16.019  22.004 -27.418
  571   2HZ   LYS  73          2HZ       LYS  73  14.896  21.029 -28.235
  572   3HZ   LYS  73          3HZ       LYS  73  15.384  20.625 -26.666
  573    H    GLU  74           H        GLU  74  12.534  21.342 -21.281
  574    HA   GLU  74           HA       GLU  74  10.577  19.372 -20.420
  575   1HB   GLU  74          2HB       GLU  74  11.409  22.092 -19.439
  576   2HB   GLU  74          1HB       GLU  74   9.938  21.330 -18.855
  577   1HG   GLU  74          2HG       GLU  74  12.549  19.887 -18.725
  578   2HG   GLU  74          1HG       GLU  74  12.117  21.084 -17.504
  579    H    ASN  75           H        ASN  75   8.743  19.229 -21.554
  580    HA   ASN  75           HA       ASN  75   7.495  21.732 -22.468
  581   1HB   ASN  75          2HB       ASN  75   8.650  20.301 -24.314
  582   2HB   ASN  75          1HB       ASN  75   7.288  19.207 -24.094
  583   1HD2  ASN  75          1HD2      ASN  75   8.272  22.378 -25.143
  584   2HD2  ASN  75          2HD2      ASN  75   6.820  22.772 -25.997
  585    H    ALA  76           H        ALA  76   5.109  21.044 -23.268
  586    HA   ALA  76           HA       ALA  76   3.737  20.481 -20.899
  587   1HB   ALA  76          1HB       ALA  76   2.694  20.424 -23.723
  588   2HB   ALA  76          2HB       ALA  76   2.779  21.838 -22.675
  589   3HB   ALA  76          3HB       ALA  76   1.709  20.500 -22.264
  590    H    LEU  77           H        LEU  77   4.805  18.411 -23.461
  591    HA   LEU  77           HA       LEU  77   3.127  16.273 -23.406
  592   1HB   LEU  77          2HB       LEU  77   6.133  16.245 -23.612
  593   2HB   LEU  77          1HB       LEU  77   5.090  14.912 -24.051
  594    HG   LEU  77           HG       LEU  77   5.054  17.621 -25.380
  595   1HD1  LEU  77          1HD1      LEU  77   6.192  15.003 -26.354
  596   2HD1  LEU  77          2HD1      LEU  77   7.136  16.396 -25.826
  597   3HD1  LEU  77          3HD1      LEU  77   6.121  16.512 -27.263
  598   1HD2  LEU  77          1HD2      LEU  77   3.659  16.495 -27.046
  599   2HD2  LEU  77          2HD2      LEU  77   2.905  16.483 -25.451
  600   3HD2  LEU  77          3HD2      LEU  77   3.683  15.027 -26.070
  601    H    GLN  78           H        GLN  78   5.739  16.941 -21.118
  602    HA   GLN  78           HA       GLN  78   5.380  14.423 -19.772
  603   1HB   GLN  78          2HB       GLN  78   7.605  15.336 -19.867
  604   2HB   GLN  78          1HB       GLN  78   7.072  16.833 -19.117
  605   1HG   GLN  78          2HG       GLN  78   6.605  15.656 -17.044
  606   2HG   GLN  78          1HG       GLN  78   7.064  14.128 -17.792
  607   1HE2  GLN  78          1HE2      GLN  78   8.192  17.148 -16.531
  608   2HE2  GLN  78          2HE2      GLN  78   9.869  16.742 -16.474
  609    H    ARG  79           H        ARG  79   4.714  17.838 -19.007
  610    HA   ARG  79           HA       ARG  79   3.865  17.105 -16.359
  611   1HB   ARG  79          2HB       ARG  79   3.932  19.789 -17.736
  612   2HB   ARG  79          1HB       ARG  79   3.470  19.545 -16.057
  613   1HG   ARG  79          2HG       ARG  79   5.757  18.416 -15.790
  614   2HG   ARG  79          1HG       ARG  79   6.155  19.161 -17.336
  615   1HD   ARG  79          2HD       ARG  79   5.229  20.640 -14.875
  616   2HD   ARG  79          1HD       ARG  79   6.904  20.491 -15.391
  617    HE   ARG  79           HE       ARG  79   4.833  22.152 -16.596
  618   1HH1  ARG  79          1HH1      ARG  79   8.113  20.904 -16.782
  619   2HH1  ARG  79          2HH1      ARG  79   8.668  22.199 -17.795
  620   1HH2  ARG  79          1HH2      ARG  79   5.597  23.878 -17.883
  621   2HH2  ARG  79          2HH2      ARG  79   7.250  23.867 -18.437
  622    H    ALA  80           H        ALA  80   2.308  17.546 -19.360
  623    HA   ALA  80           HA       ALA  80  -0.285  18.173 -18.275
  624   1HB   ALA  80          1HB       ALA  80   0.328  18.886 -20.533
  625   2HB   ALA  80          2HB       ALA  80  -1.111  17.862 -20.547
  626   3HB   ALA  80          3HB       ALA  80   0.451  17.197 -21.032
  627    H    ARG  81           H        ARG  81   1.538  15.323 -18.835
  628    HA   ARG  81           HA       ARG  81  -0.708  13.526 -18.790
  629   1HB   ARG  81          2HB       ARG  81   2.267  13.118 -18.560
  630   2HB   ARG  81          1HB       ARG  81   1.125  11.796 -18.373
  631   1HG   ARG  81          2HG       ARG  81   0.267  12.252 -20.641
  632   2HG   ARG  81          1HG       ARG  81   1.481  13.519 -20.819
  633   1HD   ARG  81          2HD       ARG  81   3.257  11.857 -20.522
  634   2HD   ARG  81          1HD       ARG  81   2.043  10.594 -20.332
  635    HE   ARG  81           HE       ARG  81   1.629  11.928 -22.785
  636   1HH1  ARG  81          1HH1      ARG  81   3.884   9.728 -21.265
  637   2HH1  ARG  81          2HH1      ARG  81   4.361   8.970 -22.750
  638   1HH2  ARG  81          1HH2      ARG  81   2.235  10.940 -24.745
  639   2HH2  ARG  81          2HH2      ARG  81   3.410   9.660 -24.746
  640    H    THR  82           H        THR  82   1.175  15.194 -16.546
  641    HA   THR  82           HA       THR  82   0.223  13.600 -14.301
  642    HB   THR  82           HB       THR  82   2.062  15.993 -14.236
  643    HG1  THR  82           1HG      THR  82   2.533  13.226 -14.597
  644   1HG2  THR  82          1HG2      THR  82   2.685  15.132 -12.023
  645   2HG2  THR  82          2HG2      THR  82   1.504  13.837 -12.197
  646   3HG2  THR  82          3HG2      THR  82   0.965  15.512 -12.101
  647    H    ARG  83           H        ARG  83   0.666  17.080 -14.473
  648    HA   ARG  83           HA       ARG  83  -1.791  17.611 -13.127
  649   1HB   ARG  83          2HB       ARG  83   0.205  19.385 -14.523
  650   2HB   ARG  83          1HB       ARG  83  -1.250  20.013 -13.770
  651   1HG   ARG  83          2HG       ARG  83  -0.531  19.207 -11.609
  652   2HG   ARG  83          1HG       ARG  83   0.889  18.453 -12.339
  653   1HD   ARG  83          2HD       ARG  83   1.266  20.684 -11.204
  654   2HD   ARG  83          1HD       ARG  83   1.857  20.540 -12.859
  655    HE   ARG  83           HE       ARG  83  -0.175  21.778 -13.546
  656   1HH1  ARG  83          1HH1      ARG  83   0.841  21.989 -10.190
  657   2HH1  ARG  83          2HH1      ARG  83   0.159  23.567  -9.963
  658   1HH2  ARG  83          1HH2      ARG  83  -1.061  23.828 -13.241
  659   2HH2  ARG  83          2HH2      ARG  83  -0.920  24.628 -11.698
  660    H    HIS  84           H        HIS  84  -3.736  17.907 -13.962
  661    HA   HIS  84           HA       HIS  84  -4.028  17.592 -16.840
  662   1HB   HIS  84          2HB       HIS  84  -6.337  17.022 -16.404
  663   2HB   HIS  84          1HB       HIS  84  -5.312  16.116 -15.301
  664    HD1  HIS  84           1HD      HIS  84  -8.141  18.429 -15.413
  665    HD2  HIS  84           2HD      HIS  84  -5.383  17.139 -12.575
  666    HE1  HIS  84           1HE      HIS  84  -9.102  19.090 -13.182
  667    HE2  HIS  84           2HE      HIS  84  -7.383  18.374 -11.480
  668    HA   PRO  85           HA       PRO  85  -5.176  21.756 -17.792
  669   1HB   PRO  85          2HB       PRO  85  -7.474  20.591 -19.268
  670   2HB   PRO  85          1HB       PRO  85  -6.209  21.687 -19.833
  671   1HG   PRO  85          2HG       PRO  85  -6.197  19.116 -20.522
  672   2HG   PRO  85          1HG       PRO  85  -4.687  19.974 -20.159
  673   1HD   PRO  85          2HD       PRO  85  -6.216  18.033 -18.480
  674   2HD   PRO  85          1HD       PRO  85  -4.468  18.247 -18.657
  675    H    ALA  86           H        ALA  86  -7.249  23.147 -17.917
  676    HA   ALA  86           HA       ALA  86  -9.024  22.403 -15.699
  677   1HB   ALA  86          1HB       ALA  86  -8.712  24.551 -14.618
  678   2HB   ALA  86          2HB       ALA  86  -7.586  25.045 -15.881
  679   3HB   ALA  86          3HB       ALA  86  -7.160  23.730 -14.788
  680    H    GLU  87           H        GLU  87  -9.311  22.697 -18.640
  681    HA   GLU  87           HA       GLU  87 -10.821  24.975 -19.258
  682   1HB   GLU  87          2HB       GLU  87 -10.828  22.209 -20.458
  683   2HB   GLU  87          1HB       GLU  87 -11.818  23.515 -21.091
  684   1HG   GLU  87          2HG       GLU  87  -9.937  23.532 -22.444
  685   2HG   GLU  87          1HG       GLU  87  -9.638  24.831 -21.294
  686    H    SER  88           H        SER  88 -11.620  22.204 -17.426
  687    HA   SER  88           HA       SER  88 -14.433  22.205 -17.712
  688   1HB   SER  88          2HB       SER  88 -13.247  20.268 -16.852
  689   2HB   SER  88          1HB       SER  88 -12.645  21.201 -15.485
  690    HG   SER  88           HG       SER  88 -15.421  21.035 -15.884
  691    H    CYS  89           H        CYS  89 -12.270  24.188 -15.816
  692    HA   CYS  89           HA       CYS  89 -14.035  24.629 -13.641
  693   1HB   CYS  89          2HB       CYS  89 -12.452  26.264 -12.857
  694   2HB   CYS  89          1HB       CYS  89 -11.572  24.872 -13.480
  695    HG   CYS  89           HG       CYS  89 -10.566  26.052 -15.680
  696    H    LEU  90           H        LEU  90 -13.828  26.092 -16.746
  697    HA   LEU  90           HA       LEU  90 -14.754  28.671 -15.968
  698   1HB   LEU  90          2HB       LEU  90 -15.029  29.084 -18.390
  699   2HB   LEU  90          1HB       LEU  90 -13.434  28.513 -17.947
  700    HG   LEU  90           HG       LEU  90 -14.326  26.178 -18.679
  701   1HD1  LEU  90          1HD1      LEU  90 -16.668  26.806 -18.910
  702   2HD1  LEU  90          2HD1      LEU  90 -16.001  26.266 -20.451
  703   3HD1  LEU  90          3HD1      LEU  90 -16.239  27.986 -20.147
  704   1HD2  LEU  90          1HD2      LEU  90 -13.741  28.374 -20.659
  705   2HD2  LEU  90          2HD2      LEU  90 -13.653  26.645 -20.996
  706   3HD2  LEU  90          3HD2      LEU  90 -12.557  27.371 -19.819
  707    H    GLU  91           H        GLU  91 -16.340  25.713 -16.422
  708    HA   GLU  91           HA       GLU  91 -18.855  26.819 -17.260
  709   1HB   GLU  91          2HB       GLU  91 -17.865  24.107 -16.533
  710   2HB   GLU  91          1HB       GLU  91 -19.596  24.404 -16.456
  711   1HG   GLU  91          2HG       GLU  91 -17.891  24.904 -18.883
  712   2HG   GLU  91          1HG       GLU  91 -18.841  23.444 -18.604
  713    H    HIS  92           H        HIS  92 -17.571  25.520 -14.209
  714    HA   HIS  92           HA       HIS  92 -18.334  25.581 -12.063
  715   1HB   HIS  92          2HB       HIS  92 -19.809  28.026 -13.082
  716   2HB   HIS  92          1HB       HIS  92 -19.821  27.518 -11.400
  717    HD1  HIS  92           1HD      HIS  92 -18.028  28.472  -9.966
  718    HD2  HIS  92           2HD      HIS  92 -17.096  28.689 -14.016
  719    HE1  HIS  92           1HE      HIS  92 -15.892  29.795 -10.102
  720    HE2  HIS  92           2HE      HIS  92 -15.295  29.843 -12.557
  721    H    HIS  93           H        HIS  93 -20.697  25.857 -10.834
  722    HA   HIS  93           HA       HIS  93 -22.639  24.457 -12.543
  723   1HB   HIS  93          2HB       HIS  93 -23.552  23.414 -10.436
  724   2HB   HIS  93          1HB       HIS  93 -21.977  22.838 -10.959
  725    HD1  HIS  93           1HD      HIS  93 -19.963  23.329  -9.447
  726    HD2  HIS  93           2HD      HIS  93 -23.574  24.797  -7.982
  727    HE1  HIS  93           1HE      HIS  93 -19.539  23.905  -7.034
  728    HE2  HIS  93           2HE      HIS  93 -21.792  24.558  -6.116
  729    H    HIS  94           H        HIS  94 -22.006  27.153 -10.632
  730    HA   HIS  94           HA       HIS  94 -23.160  29.040 -10.185
  731   1HB   HIS  94          2HB       HIS  94 -24.521  28.054 -12.671
  732   2HB   HIS  94          1HB       HIS  94 -24.991  29.571 -11.912
  733    HD1  HIS  94           1HD      HIS  94 -22.588  28.143 -14.248
  734    HD2  HIS  94           2HD      HIS  94 -22.777  31.475 -11.760
  735    HE1  HIS  94           1HE      HIS  94 -20.802  29.720 -15.074
  736    HE2  HIS  94           2HE      HIS  94 -20.922  31.723 -13.541
  737    H    HIS  95           H        HIS  95 -24.027  28.641  -8.168
  738    HA   HIS  95           HA       HIS  95 -26.656  27.480  -7.933
  739   1HB   HIS  95          2HB       HIS  95 -24.979  27.313  -6.091
  740   2HB   HIS  95          1HB       HIS  95 -25.091  29.058  -5.871
  741    HD1  HIS  95           1HD      HIS  95 -26.906  25.870  -5.211
  742    HD2  HIS  95           2HD      HIS  95 -27.454  29.951  -4.620
  743    HE1  HIS  95           1HE      HIS  95 -28.846  26.072  -3.618
  744    HE2  HIS  95           2HE      HIS  95 -29.277  28.552  -3.425
  745    H    HIS  96           H        HIS  96 -28.448  28.531  -8.438
  746    HA   HIS  96           HA       HIS  96 -28.430  31.267  -9.170
  747   1HB   HIS  96          2HB       HIS  96 -30.810  31.020  -9.585
  748   2HB   HIS  96          1HB       HIS  96 -29.950  29.611 -10.197
  749    HD1  HIS  96           1HD      HIS  96 -32.727  30.599  -8.065
  750    HD2  HIS  96           2HD      HIS  96 -30.244  27.281  -8.449
  751    HE1  HIS  96           1HE      HIS  96 -33.889  28.731  -6.836
  752    HE2  HIS  96           2HE      HIS  96 -32.430  26.698  -7.194
  753    H    HIS  97           H        HIS  97 -28.826  33.044  -8.090
  754    HA   HIS  97           HA       HIS  97 -29.326  34.514  -6.449
  755   1HB   HIS  97          2HB       HIS  97 -31.618  33.506  -6.750
  756   2HB   HIS  97          1HB       HIS  97 -31.263  32.447  -5.388
  757    HD1  HIS  97           1HD      HIS  97 -31.458  33.434  -3.048
  758    HD2  HIS  97           2HD      HIS  97 -31.920  36.256  -6.073
  759    HE1  HIS  97           1HE      HIS  97 -32.301  35.518  -1.914
  760    HE2  HIS  97           2HE      HIS  97 -32.689  37.175  -3.775
  Start of MODEL    3
    1   1H    MET   1          1HT       MET   1   5.828  18.648 -14.187
    2   2H    MET   1          2HT       MET   1   7.403  19.267 -14.119
    3   3H    MET   1          3HT       MET   1   6.291  19.643 -12.896
    4    HA   MET   1           HA       MET   1   7.381  16.959 -13.497
    5   1HB   MET   1          2HB       MET   1   7.943  18.939 -11.291
    6   2HB   MET   1          1HB       MET   1   8.313  17.231 -11.133
    7   1HG   MET   1          2HG       MET   1  10.297  18.364 -11.760
    8   2HG   MET   1          1HG       MET   1   9.755  17.415 -13.142
    9   1HE   MET   1          1HE       MET   1  11.925  19.741 -13.318
   10   2HE   MET   1          2HE       MET   1  11.411  20.562 -14.792
   11   3HE   MET   1          3HE       MET   1  11.395  18.800 -14.716
   12    HA   PRO   2           HA       PRO   2   3.562  15.945 -11.304
   13   1HB   PRO   2          2HB       PRO   2   3.318  13.460 -12.294
   14   2HB   PRO   2          1HB       PRO   2   2.889  14.883 -13.251
   15   1HG   PRO   2          2HG       PRO   2   5.346  13.188 -13.363
   16   2HG   PRO   2          1HG       PRO   2   4.426  13.919 -14.688
   17   1HD   PRO   2          2HD       PRO   2   6.764  14.950 -13.627
   18   2HD   PRO   2          1HD       PRO   2   5.558  15.893 -14.524
   19    H    THR   3           H        THR   3   3.059  14.114  -9.793
   20    HA   THR   3           HA       THR   3   5.484  12.855  -8.741
   21    HB   THR   3           HB       THR   3   5.137  14.644  -7.228
   22    HG1  THR   3           1HG      THR   3   4.812  13.495  -5.326
   23   1HG2  THR   3          1HG2      THR   3   2.850  15.252  -7.798
   24   2HG2  THR   3          2HG2      THR   3   3.001  15.026  -6.055
   25   3HG2  THR   3          3HG2      THR   3   2.257  13.772  -7.046
   26    H    LYS   4           H        LYS   4   5.253  10.903  -7.818
   27    HA   LYS   4           HA       LYS   4   2.667   9.600  -7.648
   28   1HB   LYS   4          2HB       LYS   4   3.546   9.474 -10.082
   29   2HB   LYS   4          1HB       LYS   4   4.757   8.375  -9.450
   30   1HG   LYS   4          2HG       LYS   4   1.804   7.914  -9.152
   31   2HG   LYS   4          1HG       LYS   4   2.748   7.319 -10.515
   32   1HD   LYS   4          2HD       LYS   4   4.233   6.160  -8.847
   33   2HD   LYS   4          1HD       LYS   4   3.059   6.601  -7.606
   34   1HE   LYS   4          2HE       LYS   4   2.627   4.349  -8.347
   35   2HE   LYS   4          1HE       LYS   4   1.314   5.397  -8.879
   36   1HZ   LYS   4          1HZ       LYS   4   2.161   5.403 -11.078
   37   2HZ   LYS   4          2HZ       LYS   4   2.160   3.782 -10.573
   38   3HZ   LYS   4          3HZ       LYS   4   3.608   4.657 -10.609
   39    H    THR   5           H        THR   5   3.094   9.213  -5.493
   40    HA   THR   5           HA       THR   5   5.632   7.865  -4.851
   41    HB   THR   5           HB       THR   5   3.999   9.218  -2.753
   42    HG1  THR   5           1HG      THR   5   5.113  10.464  -4.930
   43   1HG2  THR   5          1HG2      THR   5   6.204   9.658  -1.788
   44   2HG2  THR   5          2HG2      THR   5   6.972   8.943  -3.203
   45   3HG2  THR   5          3HG2      THR   5   5.996   7.941  -2.131
   46    H    TYR   6           H        TYR   6   5.626   6.281  -3.228
   47    HA   TYR   6           HA       TYR   6   3.102   5.227  -2.243
   48   1HB   TYR   6          2HB       TYR   6   5.010   3.747  -4.012
   49   2HB   TYR   6          1HB       TYR   6   4.232   2.870  -2.704
   50    HD1  TYR   6           1HD      TYR   6   4.039   3.286  -6.039
   51    HD2  TYR   6           2HD      TYR   6   1.535   3.698  -2.628
   52    HE1  TYR   6           1HE      TYR   6   2.060   2.934  -7.453
   53    HE2  TYR   6           2HE      TYR   6  -0.452   3.347  -4.035
   54    HH   TYR   6           HH       TYR   6  -0.210   2.303  -7.330
   55    H    SER   7           H        SER   7   3.378   4.028  -0.283
   56    HA   SER   7           HA       SER   7   5.697   4.822   1.196
   57   1HB   SER   7          2HB       SER   7   4.491   3.313   2.977
   58   2HB   SER   7          1HB       SER   7   3.798   4.872   2.524
   59    HG   SER   7           HG       SER   7   2.294   3.064   2.535
   60    H    GLU   8           H        GLU   8   7.184   3.433   2.211
   61    HA   GLU   8           HA       GLU   8   8.119   1.362   0.522
   62   1HB   GLU   8          2HB       GLU   8   9.581   0.999   2.773
   63   2HB   GLU   8          1HB       GLU   8   9.947   2.196   1.543
   64   1HG   GLU   8          2HG       GLU   8  10.095   3.158   3.761
   65   2HG   GLU   8          1HG       GLU   8   8.790   3.903   2.845
   66    H    GLU   9           H        GLU   9   6.472   1.366   3.648
   67    HA   GLU   9           HA       GLU   9   6.647  -1.417   4.114
   68   1HB   GLU   9          2HB       GLU   9   6.055   0.429   5.768
   69   2HB   GLU   9          1HB       GLU   9   4.437   0.389   5.089
   70   1HG   GLU   9          2HG       GLU   9   4.555  -0.920   7.123
   71   2HG   GLU   9          1HG       GLU   9   4.214  -1.952   5.735
   72    H    PHE  10           H        PHE  10   4.444   0.556   2.279
   73    HA   PHE  10           HA       PHE  10   2.361  -1.291   1.875
   74   1HB   PHE  10          2HB       PHE  10   2.143   1.086   1.342
   75   2HB   PHE  10          1HB       PHE  10   3.374   0.941   0.096
   76    HD1  PHE  10           1HD      PHE  10  -0.034  -0.128   1.044
   77    HD2  PHE  10           2HD      PHE  10   2.810   0.328  -2.088
   78    HE1  PHE  10           1HE      PHE  10  -1.794  -0.570  -0.617
   79    HE2  PHE  10           2HE      PHE  10   1.055  -0.114  -3.753
   80    HZ   PHE  10           HZ       PHE  10  -1.251  -0.561  -3.017
   81    H    LYS  11           H        LYS  11   5.205  -0.526  -0.108
   82    HA   LYS  11           HA       LYS  11   4.726  -2.589  -2.013
   83   1HB   LYS  11          2HB       LYS  11   7.331  -1.143  -1.476
   84   2HB   LYS  11          1HB       LYS  11   6.858  -1.961  -2.959
   85   1HG   LYS  11          2HG       LYS  11   4.915  -0.282  -3.029
   86   2HG   LYS  11          1HG       LYS  11   5.851   0.624  -1.839
   87   1HD   LYS  11          2HD       LYS  11   6.793  -0.195  -4.585
   88   2HD   LYS  11          1HD       LYS  11   6.266   1.419  -4.115
   89   1HE   LYS  11          2HE       LYS  11   8.108   1.600  -2.571
   90   2HE   LYS  11          1HE       LYS  11   8.607  -0.054  -2.919
   91   1HZ   LYS  11          1HZ       LYS  11   8.643   2.259  -4.774
   92   2HZ   LYS  11          2HZ       LYS  11   8.925   0.664  -5.254
   93   3HZ   LYS  11          3HZ       LYS  11   9.981   1.414  -4.164
   94    H    ARG  12           H        ARG  12   6.503  -2.329   0.962
   95    HA   ARG  12           HA       ARG  12   8.041  -4.694   0.791
   96   1HB   ARG  12          2HB       ARG  12   8.398  -2.828   2.397
   97   2HB   ARG  12          1HB       ARG  12   6.926  -3.296   3.230
   98   1HG   ARG  12          2HG       ARG  12   7.942  -5.444   3.804
   99   2HG   ARG  12          1HG       ARG  12   9.431  -4.947   2.987
  100   1HD   ARG  12          2HD       ARG  12   9.584  -3.012   4.506
  101   2HD   ARG  12          1HD       ARG  12   8.141  -3.577   5.346
  102    HE   ARG  12           HE       ARG  12  10.514  -5.306   5.208
  103   1HH1  ARG  12          1HH1      ARG  12   8.213  -3.422   7.096
  104   2HH1  ARG  12          2HH1      ARG  12   8.799  -4.024   8.622
  105   1HH2  ARG  12          1HH2      ARG  12  11.267  -6.082   7.197
  106   2HH2  ARG  12          2HH2      ARG  12  10.543  -5.538   8.683
  107    H    ASP  13           H        ASP  13   4.842  -4.012   2.177
  108    HA   ASP  13           HA       ASP  13   4.345  -6.689   2.981
  109   1HB   ASP  13          2HB       ASP  13   3.147  -4.711   3.904
  110   2HB   ASP  13          1HB       ASP  13   2.325  -4.528   2.358
  111    H    ALA  14           H        ALA  14   3.905  -4.920   0.016
  112    HA   ALA  14           HA       ALA  14   2.246  -6.722  -1.345
  113   1HB   ALA  14          1HB       ALA  14   4.408  -4.979  -2.511
  114   2HB   ALA  14          2HB       ALA  14   2.766  -4.451  -2.139
  115   3HB   ALA  14          3HB       ALA  14   3.040  -5.679  -3.377
  116    H    VAL  15           H        VAL  15   5.734  -6.666  -0.831
  117    HA   VAL  15           HA       VAL  15   6.444  -8.802  -2.504
  118    HB   VAL  15           HB       VAL  15   7.699  -7.935   0.115
  119   1HG1  VAL  15          1HG1      VAL  15   9.705  -9.113  -0.623
  120   2HG1  VAL  15          2HG1      VAL  15   8.851  -9.692  -2.053
  121   3HG1  VAL  15          3HG1      VAL  15   8.348 -10.228  -0.450
  122   1HG2  VAL  15          1HG2      VAL  15   7.684  -6.173  -1.545
  123   2HG2  VAL  15          2HG2      VAL  15   8.386  -7.263  -2.741
  124   3HG2  VAL  15          3HG2      VAL  15   9.323  -6.785  -1.324
  125    H    ALA  16           H        ALA  16   5.293  -8.687   0.832
  126    HA   ALA  16           HA       ALA  16   5.423 -11.489   1.290
  127   1HB   ALA  16          1HB       ALA  16   5.333  -9.879   3.124
  128   2HB   ALA  16          2HB       ALA  16   4.032 -11.063   3.236
  129   3HB   ALA  16          3HB       ALA  16   3.691  -9.435   2.654
  130    H    LEU  17           H        LEU  17   2.859  -9.351   0.125
  131    HA   LEU  17           HA       LEU  17   0.782 -11.224   0.009
  132   1HB   LEU  17          2HB       LEU  17   1.363  -8.835  -1.743
  133   2HB   LEU  17          1HB       LEU  17  -0.129  -9.752  -1.813
  134    HG   LEU  17           HG       LEU  17   0.832  -8.348   0.682
  135   1HD1  LEU  17          1HD1      LEU  17  -1.105  -7.402  -1.426
  136   2HD1  LEU  17          2HD1      LEU  17   0.463  -6.690  -1.045
  137   3HD1  LEU  17          3HD1      LEU  17  -0.844  -6.631   0.136
  138   1HD2  LEU  17          1HD2      LEU  17  -1.491  -8.628   1.389
  139   2HD2  LEU  17          2HD2      LEU  17  -0.733 -10.185   1.051
  140   3HD2  LEU  17          3HD2      LEU  17  -1.851  -9.475  -0.117
  141    H    TYR  18           H        TYR  18   3.460 -10.615  -2.129
  142    HA   TYR  18           HA       TYR  18   2.561 -11.968  -4.420
  143   1HB   TYR  18          2HB       TYR  18   4.427 -10.366  -4.372
  144   2HB   TYR  18          1HB       TYR  18   5.381 -11.508  -3.440
  145    HD1  TYR  18           1HD      TYR  18   6.630 -13.208  -4.515
  146    HD2  TYR  18           2HD      TYR  18   3.813 -10.928  -6.738
  147    HE1  TYR  18           1HE      TYR  18   7.547 -14.123  -6.605
  148    HE2  TYR  18           2HE      TYR  18   4.715 -11.842  -8.832
  149    HH   TYR  18           HH       TYR  18   7.078 -14.418  -8.858
  150    H    GLU  19           H        GLU  19   4.393 -13.130  -1.597
  151    HA   GLU  19           HA       GLU  19   4.775 -15.739  -2.728
  152   1HB   GLU  19          2HB       GLU  19   5.667 -16.388  -0.576
  153   2HB   GLU  19          1HB       GLU  19   6.317 -14.815  -1.020
  154   1HG   GLU  19          2HG       GLU  19   5.273 -13.751   0.673
  155   2HG   GLU  19          1HG       GLU  19   3.861 -14.802   0.607
  156    H    ASN  20           H        ASN  20   2.274 -14.161  -0.994
  157    HA   ASN  20           HA       ASN  20   1.016 -16.657  -0.164
  158   1HB   ASN  20          2HB       ASN  20   0.396 -13.755   0.357
  159   2HB   ASN  20          1HB       ASN  20  -0.735 -15.037   0.779
  160   1HD2  ASN  20          1HD2      ASN  20   2.254 -13.487   1.546
  161   2HD2  ASN  20          2HD2      ASN  20   2.546 -14.324   3.038
  162    H    SER  21           H        SER  21   1.324 -15.854  -2.979
  163    HA   SER  21           HA       SER  21  -1.153 -14.916  -3.985
  164   1HB   SER  21          2HB       SER  21  -0.141 -15.779  -6.180
  165   2HB   SER  21          1HB       SER  21   0.678 -14.470  -5.332
  166    HG   SER  21           HG       SER  21   2.346 -15.701  -5.056
  167    H    ASP  22           H        ASP  22  -0.127 -18.008  -2.991
  168    HA   ASP  22           HA       ASP  22  -1.730 -19.623  -4.641
  169   1HB   ASP  22          2HB       ASP  22   0.009 -20.470  -3.026
  170   2HB   ASP  22          1HB       ASP  22  -1.132 -20.149  -1.723
  171    H    GLY  23           H        GLY  23  -2.432 -17.698  -1.841
  172   1HA   GLY  23          2HA       GLY  23  -5.242 -18.570  -1.906
  173   2HA   GLY  23          1HA       GLY  23  -4.462 -17.749  -0.559
  174    H    ALA  24           H        ALA  24  -3.429 -16.306  -3.372
  175    HA   ALA  24           HA       ALA  24  -5.690 -14.527  -3.710
  176   1HB   ALA  24          1HB       ALA  24  -3.069 -13.460  -2.650
  177   2HB   ALA  24          2HB       ALA  24  -4.580 -13.554  -1.747
  178   3HB   ALA  24          3HB       ALA  24  -4.457 -12.493  -3.148
  179    H    SER  25           H        SER  25  -5.828 -14.318  -5.832
  180    HA   SER  25           HA       SER  25  -3.835 -15.199  -7.588
  181   1HB   SER  25          2HB       SER  25  -6.155 -13.362  -8.225
  182   2HB   SER  25          1HB       SER  25  -5.290 -14.399  -9.359
  183    HG   SER  25           HG       SER  25  -7.084 -15.541  -8.798
  184    H    LEU  26           H        LEU  26  -2.264 -14.188  -8.702
  185    HA   LEU  26           HA       LEU  26  -0.992 -11.980  -7.654
  186   1HB   LEU  26          2HB       LEU  26  -0.059 -13.714  -9.210
  187   2HB   LEU  26          1HB       LEU  26  -0.820 -12.853 -10.530
  188    HG   LEU  26           HG       LEU  26   0.552 -10.866 -10.017
  189   1HD1  LEU  26          1HD1      LEU  26   1.871 -12.671  -7.991
  190   2HD1  LEU  26          2HD1      LEU  26   0.865 -11.269  -7.628
  191   3HD1  LEU  26          3HD1      LEU  26   2.409 -11.054  -8.446
  192   1HD2  LEU  26          1HD2      LEU  26   2.140 -13.403 -10.408
  193   2HD2  LEU  26          2HD2      LEU  26   2.679 -11.774 -10.810
  194   3HD2  LEU  26          3HD2      LEU  26   1.321 -12.492 -11.675
  195    H    GLN  27           H        GLN  27  -3.322 -12.093 -10.298
  196    HA   GLN  27           HA       GLN  27  -3.051  -9.340 -10.985
  197   1HB   GLN  27          2HB       GLN  27  -3.937 -11.107 -12.516
  198   2HB   GLN  27          1HB       GLN  27  -5.391 -11.172 -11.532
  199   1HG   GLN  27          2HG       GLN  27  -5.630  -9.822 -13.593
  200   2HG   GLN  27          1HG       GLN  27  -5.971  -8.934 -12.109
  201   1HE2  GLN  27          1HE2      GLN  27  -4.687  -7.239 -11.528
  202   2HE2  GLN  27          2HE2      GLN  27  -3.470  -6.573 -12.561
  203    H    GLN  28           H        GLN  28  -4.973 -11.115  -8.673
  204    HA   GLN  28           HA       GLN  28  -6.838  -9.068  -8.070
  205   1HB   GLN  28          2HB       GLN  28  -7.145 -11.452  -7.410
  206   2HB   GLN  28          1HB       GLN  28  -5.828 -11.282  -6.262
  207   1HG   GLN  28          2HG       GLN  28  -8.214  -9.486  -6.097
  208   2HG   GLN  28          1HG       GLN  28  -8.278 -11.120  -5.442
  209   1HE2  GLN  28          1HE2      GLN  28  -8.405  -8.480  -4.127
  210   2HE2  GLN  28          2HE2      GLN  28  -7.152  -8.494  -2.937
  211    H    ILE  29           H        ILE  29  -3.707  -9.989  -6.670
  212    HA   ILE  29           HA       ILE  29  -3.512  -8.018  -4.705
  213    HB   ILE  29           HB       ILE  29  -1.257  -9.104  -6.412
  214   1HG1  ILE  29          2HG1      ILE  29  -2.606 -10.872  -5.289
  215   2HG1  ILE  29          1HG1      ILE  29  -0.949 -10.797  -4.704
  216   1HG2  ILE  29          1HG2      ILE  29  -0.685  -7.078  -5.139
  217   2HG2  ILE  29          2HG2      ILE  29   0.200  -8.494  -4.575
  218   3HG2  ILE  29          3HG2      ILE  29  -1.175  -7.886  -3.651
  219   1HD1  ILE  29          1HD1      ILE  29  -2.524 -11.140  -2.887
  220   2HD1  ILE  29          2HD1      ILE  29  -3.358  -9.645  -3.318
  221   3HD1  ILE  29          3HD1      ILE  29  -1.696  -9.592  -2.726
  222    H    ALA  30           H        ALA  30  -2.495  -7.953  -8.105
  223    HA   ALA  30           HA       ALA  30  -1.532  -5.320  -8.153
  224   1HB   ALA  30          1HB       ALA  30  -1.042  -6.973  -9.884
  225   2HB   ALA  30          2HB       ALA  30  -1.699  -5.491 -10.578
  226   3HB   ALA  30          3HB       ALA  30  -2.720  -6.921 -10.417
  227    H    ASN  31           H        ASN  31  -4.773  -6.631  -8.740
  228    HA   ASN  31           HA       ASN  31  -5.961  -4.214  -9.602
  229   1HB   ASN  31          2HB       ASN  31  -7.012  -6.826  -8.561
  230   2HB   ASN  31          1HB       ASN  31  -8.097  -5.481  -8.835
  231   1HD2  ASN  31          1HD2      ASN  31  -8.083  -8.037 -10.134
  232   2HD2  ASN  31          2HD2      ASN  31  -7.836  -7.732 -11.824
  233    H    ASP  32           H        ASP  32  -5.763  -5.830  -6.465
  234    HA   ASP  32           HA       ASP  32  -7.498  -4.073  -5.092
  235   1HB   ASP  32          2HB       ASP  32  -6.832  -6.393  -4.356
  236   2HB   ASP  32          1HB       ASP  32  -5.272  -5.729  -3.892
  237    H    LEU  33           H        LEU  33  -3.999  -4.138  -5.513
  238    HA   LEU  33           HA       LEU  33  -3.599  -1.817  -3.848
  239   1HB   LEU  33          2HB       LEU  33  -1.827  -3.595  -5.475
  240   2HB   LEU  33          1HB       LEU  33  -1.228  -2.042  -4.940
  241    HG   LEU  33           HG       LEU  33  -1.605  -2.698  -2.598
  242   1HD1  LEU  33          1HD1      LEU  33  -3.456  -4.254  -2.924
  243   2HD1  LEU  33          2HD1      LEU  33  -2.135  -5.001  -2.027
  244   3HD1  LEU  33          3HD1      LEU  33  -2.368  -5.382  -3.733
  245   1HD2  LEU  33          1HD2      LEU  33   0.043  -4.663  -4.179
  246   2HD2  LEU  33          2HD2      LEU  33   0.197  -4.334  -2.453
  247   3HD2  LEU  33          3HD2      LEU  33   0.567  -3.071  -3.627
  248    H    GLY  34           H        GLY  34  -4.172  -2.478  -7.184
  249   1HA   GLY  34          2HA       GLY  34  -4.738  -0.963  -8.847
  250   2HA   GLY  34          1HA       GLY  34  -4.335   0.349  -7.752
  251    H    ILE  35           H        ILE  35  -2.286  -2.350  -8.715
  252    HA   ILE  35           HA       ILE  35  -0.451  -0.427  -9.992
  253    HB   ILE  35           HB       ILE  35   1.425  -1.799  -9.128
  254   1HG1  ILE  35          2HG1      ILE  35  -0.726  -3.119  -7.455
  255   2HG1  ILE  35          1HG1      ILE  35   0.157  -3.882  -8.774
  256   1HG2  ILE  35          1HG2      ILE  35   0.781   0.261  -7.998
  257   2HG2  ILE  35          2HG2      ILE  35   1.364  -0.936  -6.840
  258   3HG2  ILE  35          3HG2      ILE  35  -0.366  -0.633  -7.002
  259   1HD1  ILE  35          1HD1      ILE  35   1.344  -2.890  -6.192
  260   2HD1  ILE  35          2HD1      ILE  35   2.236  -3.636  -7.517
  261   3HD1  ILE  35          3HD1      ILE  35   1.038  -4.571  -6.627
  262    H    ASN  36           H        ASN  36   1.069  -1.464 -11.527
  263    HA   ASN  36           HA       ASN  36  -0.212  -3.378 -13.202
  264   1HB   ASN  36          2HB       ASN  36   1.329  -1.533 -13.945
  265   2HB   ASN  36          1HB       ASN  36   2.661  -2.442 -13.249
  266   1HD2  ASN  36          1HD2      ASN  36   1.961  -1.584 -16.002
  267   2HD2  ASN  36          2HD2      ASN  36   2.063  -3.024 -16.946
  268    H    ARG  37           H        ARG  37   0.315  -5.501 -13.528
  269    HA   ARG  37           HA       ARG  37   1.095  -7.050 -11.334
  270   1HB   ARG  37          2HB       ARG  37  -0.312  -7.802 -13.253
  271   2HB   ARG  37          1HB       ARG  37   1.131  -7.835 -14.256
  272   1HG   ARG  37          2HG       ARG  37   2.091  -9.510 -12.659
  273   2HG   ARG  37          1HG       ARG  37   0.509  -9.571 -11.879
  274   1HD   ARG  37          2HD       ARG  37   1.144 -10.264 -14.743
  275   2HD   ARG  37          1HD       ARG  37   0.715 -11.388 -13.458
  276    HE   ARG  37           HE       ARG  37  -1.277  -9.361 -14.005
  277   1HH1  ARG  37          1HH1      ARG  37  -0.118 -12.577 -14.785
  278   2HH1  ARG  37          2HH1      ARG  37  -1.657 -13.118 -15.391
  279   1HH2  ARG  37          1HH2      ARG  37  -3.288 -10.053 -14.853
  280   2HH2  ARG  37          2HH2      ARG  37  -3.447 -11.677 -15.464
  281    H    VAL  38           H        VAL  38   2.907  -5.823 -14.081
  282    HA   VAL  38           HA       VAL  38   5.297  -7.301 -13.570
  283    HB   VAL  38           HB       VAL  38   4.971  -4.717 -15.115
  284   1HG1  VAL  38          1HG1      VAL  38   7.138  -6.815 -15.249
  285   2HG1  VAL  38          2HG1      VAL  38   7.294  -5.221 -14.512
  286   3HG1  VAL  38          3HG1      VAL  38   7.023  -5.365 -16.248
  287   1HG2  VAL  38          1HG2      VAL  38   4.870  -7.566 -16.107
  288   2HG2  VAL  38          2HG2      VAL  38   4.788  -6.114 -17.105
  289   3HG2  VAL  38          3HG2      VAL  38   3.490  -6.475 -15.963
  290    H    THR  39           H        THR  39   4.179  -4.038 -12.753
  291    HA   THR  39           HA       THR  39   6.529  -3.106 -11.538
  292    HB   THR  39           HB       THR  39   3.699  -2.388 -10.736
  293    HG1  THR  39           1HG      THR  39   5.328  -1.230 -12.781
  294   1HG2  THR  39          1HG2      THR  39   5.469  -1.539  -9.247
  295   2HG2  THR  39          2HG2      THR  39   4.668  -0.237 -10.126
  296   3HG2  THR  39          3HG2      THR  39   6.263  -0.790 -10.634
  297    H    LEU  40           H        LEU  40   3.765  -4.900 -10.254
  298    HA   LEU  40           HA       LEU  40   4.531  -5.027  -7.570
  299   1HB   LEU  40          2HB       LEU  40   2.333  -5.713  -8.300
  300   2HB   LEU  40          1HB       LEU  40   3.016  -6.999  -9.275
  301    HG   LEU  40           HG       LEU  40   3.789  -8.124  -7.202
  302   1HD1  LEU  40          1HD1      LEU  40   2.900  -7.381  -5.049
  303   2HD1  LEU  40          2HD1      LEU  40   2.218  -5.949  -5.823
  304   3HD1  LEU  40          3HD1      LEU  40   3.967  -6.170  -5.760
  305   1HD2  LEU  40          1HD2      LEU  40   0.843  -7.506  -7.349
  306   2HD2  LEU  40          2HD2      LEU  40   1.564  -8.863  -6.486
  307   3HD2  LEU  40          3HD2      LEU  40   1.693  -8.766  -8.240
  308    H    LYS  41           H        LYS  41   5.197  -7.268 -10.239
  309    HA   LYS  41           HA       LYS  41   6.669  -9.166  -8.844
  310   1HB   LYS  41          2HB       LYS  41   6.019  -8.504 -11.552
  311   2HB   LYS  41          1HB       LYS  41   7.715  -8.924 -11.462
  312   1HG   LYS  41          2HG       LYS  41   7.132 -11.056 -10.416
  313   2HG   LYS  41          1HG       LYS  41   5.424 -10.623 -10.503
  314   1HD   LYS  41          2HD       LYS  41   5.702 -10.418 -12.987
  315   2HD   LYS  41          1HD       LYS  41   7.321 -11.093 -12.797
  316   1HE   LYS  41          2HE       LYS  41   4.767 -12.451 -11.948
  317   2HE   LYS  41          1HE       LYS  41   5.625 -12.769 -13.453
  318   1HZ   LYS  41          1HZ       LYS  41   6.677 -13.227 -10.706
  319   2HZ   LYS  41          2HZ       LYS  41   7.547 -13.487 -12.140
  320   3HZ   LYS  41          3HZ       LYS  41   6.169 -14.419 -11.803
  321    H    ASN  42           H        ASN  42   7.664  -6.158 -10.381
  322    HA   ASN  42           HA       ASN  42  10.448  -6.524 -10.143
  323   1HB   ASN  42          2HB       ASN  42   8.752  -4.049 -10.433
  324   2HB   ASN  42          1HB       ASN  42  10.506  -3.980 -10.355
  325   1HD2  ASN  42          1HD2      ASN  42   8.766  -3.197 -12.523
  326   2HD2  ASN  42          2HD2      ASN  42   9.227  -4.143 -13.891
  327    H    TRP  43           H        TRP  43   8.052  -5.278  -7.893
  328    HA   TRP  43           HA       TRP  43   9.838  -4.030  -6.100
  329   1HB   TRP  43          2HB       TRP  43   7.095  -5.214  -5.667
  330   2HB   TRP  43          1HB       TRP  43   7.984  -4.370  -4.406
  331    HD1  TRP  43           HD       TRP  43   8.947  -2.343  -7.112
  332    HE1  TRP  43           1HE      TRP  43   7.349  -0.368  -7.522
  333    HE3  TRP  43           3HE      TRP  43   4.897  -3.995  -4.458
  334    HZ2  TRP  43           2HZ      TRP  43   4.730   0.394  -6.809
  335    HZ3  TRP  43           3HZ      TRP  43   2.887  -2.583  -4.375
  336    HH2  TRP  43           HH       TRP  43   2.807  -0.432  -5.528
  337    H    ILE  44           H        ILE  44   8.569  -7.320  -6.262
  338    HA   ILE  44           HA       ILE  44   9.674  -8.247  -3.844
  339    HB   ILE  44           HB       ILE  44   8.783  -9.675  -6.342
  340   1HG1  ILE  44          2HG1      ILE  44   7.107 -10.626  -4.710
  341   2HG1  ILE  44          1HG1      ILE  44   7.736  -9.505  -3.514
  342   1HG2  ILE  44          1HG2      ILE  44  10.633 -10.976  -5.451
  343   2HG2  ILE  44          2HG2      ILE  44   9.102 -11.813  -5.197
  344   3HG2  ILE  44          3HG2      ILE  44   9.884 -10.975  -3.857
  345   1HD1  ILE  44          1HD1      ILE  44   6.419  -8.767  -6.114
  346   2HD1  ILE  44          2HD1      ILE  44   7.067  -7.632  -4.928
  347   3HD1  ILE  44          3HD1      ILE  44   5.701  -8.668  -4.507
  348    H    ILE  45           H        ILE  45  10.883  -8.293  -7.161
  349    HA   ILE  45           HA       ILE  45  13.197  -9.833  -6.586
  350    HB   ILE  45           HB       ILE  45  12.684  -8.017  -8.950
  351   1HG1  ILE  45          2HG1      ILE  45  12.197 -10.991  -8.643
  352   2HG1  ILE  45          1HG1      ILE  45  10.942  -9.754  -8.616
  353   1HG2  ILE  45          1HG2      ILE  45  14.626 -10.304  -8.609
  354   2HG2  ILE  45          2HG2      ILE  45  15.037  -8.595  -8.738
  355   3HG2  ILE  45          3HG2      ILE  45  14.322  -9.436 -10.114
  356   1HD1  ILE  45          1HD1      ILE  45  12.753 -10.354 -10.944
  357   2HD1  ILE  45          2HD1      ILE  45  11.457  -9.158 -10.915
  358   3HD1  ILE  45          3HD1      ILE  45  11.078 -10.874 -10.779
  359    H    LYS  46           H        LYS  46  12.541  -6.371  -6.593
  360    HA   LYS  46           HA       LYS  46  15.375  -5.758  -6.431
  361   1HB   LYS  46          2HB       LYS  46  13.791  -4.358  -7.747
  362   2HB   LYS  46          1HB       LYS  46  13.029  -3.871  -6.238
  363   1HG   LYS  46          2HG       LYS  46  15.091  -2.841  -5.496
  364   2HG   LYS  46          1HG       LYS  46  15.913  -3.390  -6.958
  365   1HD   LYS  46          2HD       LYS  46  14.279  -2.062  -8.288
  366   2HD   LYS  46          1HD       LYS  46  13.643  -1.418  -6.776
  367   1HE   LYS  46          2HE       LYS  46  15.227   0.143  -7.755
  368   2HE   LYS  46          1HE       LYS  46  15.845  -0.499  -6.236
  369   1HZ   LYS  46          1HZ       LYS  46  17.550  -0.405  -7.961
  370   2HZ   LYS  46          2HZ       LYS  46  16.639  -1.448  -8.940
  371   3HZ   LYS  46          3HZ       LYS  46  17.266  -2.000  -7.463
  372    H    TYR  47           H        TYR  47  12.522  -5.523  -4.310
  373    HA   TYR  47           HA       TYR  47  14.171  -4.289  -2.253
  374   1HB   TYR  47          2HB       TYR  47  11.207  -4.775  -2.456
  375   2HB   TYR  47          1HB       TYR  47  11.975  -4.089  -1.030
  376    HD1  TYR  47           1HD      TYR  47  13.041  -1.864  -1.147
  377    HD2  TYR  47           2HD      TYR  47  10.864  -3.466  -4.433
  378    HE1  TYR  47           1HE      TYR  47  12.883   0.383  -2.131
  379    HE2  TYR  47           2HE      TYR  47  10.711  -1.224  -5.429
  380    HH   TYR  47           HH       TYR  47  12.562   1.399  -4.357
  381    H    GLY  48           H        GLY  48  12.432  -7.350  -2.730
  382   1HA   GLY  48          2HA       GLY  48  13.079  -8.039   0.064
  383   2HA   GLY  48          1HA       GLY  48  11.793  -8.766  -0.878
  384    H    SER  49           H        SER  49  14.861  -8.334  -2.419
  385    HA   SER  49           HA       SER  49  15.033 -11.217  -2.654
  386   1HB   SER  49          2HB       SER  49  16.932 -10.588  -4.261
  387   2HB   SER  49          1HB       SER  49  15.294 -10.110  -4.714
  388    HG   SER  49           HG       SER  49  16.159  -8.201  -4.880
  389    H    ASN  50           H        ASN  50  17.325  -8.613  -1.808
  390    HA   ASN  50           HA       ASN  50  19.320  -8.609  -0.718
  391   1HB   ASN  50          2HB       ASN  50  18.166  -9.396   1.257
  392   2HB   ASN  50          1HB       ASN  50  18.164 -11.051   0.655
  393   1HD2  ASN  50          1HD2      ASN  50  19.206 -11.780   2.519
  394   2HD2  ASN  50          2HD2      ASN  50  20.888 -11.495   2.803
  395    H    HIS  51           H        HIS  51  18.838 -12.101  -0.938
  396    HA   HIS  51           HA       HIS  51  19.792 -13.743  -2.145
  397   1HB   HIS  51          2HB       HIS  51  19.128 -12.140  -4.022
  398   2HB   HIS  51          1HB       HIS  51  20.821 -11.662  -4.065
  399    HD1  HIS  51           1HD      HIS  51  22.164 -12.916  -5.723
  400    HD2  HIS  51           2HD      HIS  51  18.918 -15.128  -4.357
  401    HE1  HIS  51           1HE      HIS  51  22.194 -15.057  -7.043
  402    HE2  HIS  51           2HE      HIS  51  20.339 -16.456  -6.060
  403    H    ASN  52           H        ASN  52  22.236 -11.304  -3.004
  404    HA   ASN  52           HA       ASN  52  24.181 -12.878  -1.492
  405   1HB   ASN  52          2HB       ASN  52  25.759 -12.456  -3.354
  406   2HB   ASN  52          1HB       ASN  52  24.410 -13.475  -3.812
  407   1HD2  ASN  52          1HD2      ASN  52  25.997 -10.433  -4.238
  408   2HD2  ASN  52          2HD2      ASN  52  25.039  -9.893  -5.573
  409    H    VAL  53           H        VAL  53  22.732 -10.097  -1.321
  410    HA   VAL  53           HA       VAL  53  24.882  -8.208  -1.386
  411    HB   VAL  53           HB       VAL  53  22.188  -8.019  -0.016
  412   1HG1  VAL  53          1HG1      VAL  53  22.600  -5.594   0.036
  413   2HG1  VAL  53          2HG1      VAL  53  24.229  -5.867  -0.579
  414   3HG1  VAL  53          3HG1      VAL  53  23.774  -6.481   1.011
  415   1HG2  VAL  53          1HG2      VAL  53  23.151  -6.917  -2.653
  416   2HG2  VAL  53          2HG2      VAL  53  21.567  -6.632  -1.932
  417   3HG2  VAL  53          3HG2      VAL  53  22.030  -8.258  -2.437
  418    H    GLN  54           H        GLN  54  23.131  -9.802   1.254
  419    HA   GLN  54           HA       GLN  54  23.660 -10.303   3.394
  420   1HB   GLN  54          2HB       GLN  54  26.475 -10.361   2.296
  421   2HB   GLN  54          1HB       GLN  54  25.901 -11.161   3.753
  422   1HG   GLN  54          2HG       GLN  54  24.705 -12.751   2.575
  423   2HG   GLN  54          1HG       GLN  54  24.647 -11.764   1.117
  424   1HE2  GLN  54          1HE2      GLN  54  26.487 -11.601  -0.173
  425   2HE2  GLN  54          2HE2      GLN  54  27.727 -12.792  -0.118
  426    H    GLY  55           H        GLY  55  25.713  -9.784   5.078
  427   1HA   GLY  55          2HA       GLY  55  26.113  -6.858   5.011
  428   2HA   GLY  55          1HA       GLY  55  25.564  -7.665   6.473
  429    H    THR  56           H        THR  56  27.775  -9.292   4.438
  430    HA   THR  56           HA       THR  56  30.081  -8.551   6.052
  431    HB   THR  56           HB       THR  56  30.614 -11.075   6.204
  432    HG1  THR  56           1HG      THR  56  28.979 -11.957   5.004
  433   1HG2  THR  56          1HG2      THR  56  28.419  -9.914   7.921
  434   2HG2  THR  56          2HG2      THR  56  30.150  -9.687   8.162
  435   3HG2  THR  56          3HG2      THR  56  29.437 -11.290   8.341
  436    H    THR  57           H        THR  57  31.047  -7.689   4.263
  437    HA   THR  57           HA       THR  57  31.216  -9.101   1.772
  438    HB   THR  57           HB       THR  57  32.789  -6.661   2.631
  439    HG1  THR  57           1HG      THR  57  31.027  -5.492   1.694
  440   1HG2  THR  57          1HG2      THR  57  31.935  -7.654  -0.097
  441   2HG2  THR  57          2HG2      THR  57  33.568  -7.746   0.567
  442   3HG2  THR  57          3HG2      THR  57  32.836  -6.176   0.230
  443    HA   PRO  58           HA       PRO  58  34.883 -11.405   3.059
  444   1HB   PRO  58          2HB       PRO  58  34.704 -12.549   0.370
  445   2HB   PRO  58          1HB       PRO  58  34.560 -13.352   1.935
  446   1HG   PRO  58          2HG       PRO  58  32.451 -13.021   0.277
  447   2HG   PRO  58          1HG       PRO  58  32.284 -13.024   2.042
  448   1HD   PRO  58          2HD       PRO  58  32.361 -10.703   0.148
  449   2HD   PRO  58          1HD       PRO  58  31.323 -10.965   1.565
  450    H    SER  59           H        SER  59  37.077 -11.368   2.432
  451    HA   SER  59           HA       SER  59  37.920  -8.965   1.255
  452   1HB   SER  59          2HB       SER  59  39.588 -11.456   1.638
  453   2HB   SER  59          1HB       SER  59  40.159  -9.789   1.561
  454    HG   SER  59           HG       SER  59  38.711 -11.087   3.610
  455    H    ALA  60           H        ALA  60  37.610 -12.217  -0.060
  456    HA   ALA  60           HA       ALA  60  38.961 -11.670  -2.505
  457   1HB   ALA  60          1HB       ALA  60  38.035 -13.802  -3.264
  458   2HB   ALA  60          2HB       ALA  60  36.978 -13.849  -1.854
  459   3HB   ALA  60          3HB       ALA  60  38.726 -13.944  -1.648
  460    H    ALA  61           H        ALA  61  35.830 -10.960  -1.330
  461    HA   ALA  61           HA       ALA  61  34.704 -10.684  -4.010
  462   1HB   ALA  61          1HB       ALA  61  33.391 -10.345  -1.314
  463   2HB   ALA  61          2HB       ALA  61  33.337 -11.790  -2.321
  464   3HB   ALA  61          3HB       ALA  61  32.573 -10.302  -2.876
  465    H    VAL  62           H        VAL  62  36.687  -8.854  -2.291
  466    HA   VAL  62           HA       VAL  62  35.349  -6.367  -2.113
  467    HB   VAL  62           HB       VAL  62  37.512  -7.045  -0.961
  468   1HG1  VAL  62          1HG1      VAL  62  39.605  -6.469  -2.077
  469   2HG1  VAL  62          2HG1      VAL  62  38.722  -6.178  -3.573
  470   3HG1  VAL  62          3HG1      VAL  62  38.773  -7.799  -2.879
  471   1HG2  VAL  62          1HG2      VAL  62  38.358  -4.735  -0.880
  472   2HG2  VAL  62          2HG2      VAL  62  36.600  -4.807  -0.760
  473   3HG2  VAL  62          3HG2      VAL  62  37.361  -4.341  -2.282
  474    H    SER  63           H        SER  63  37.227  -7.923  -4.602
  475    HA   SER  63           HA       SER  63  37.219  -5.771  -6.452
  476   1HB   SER  63          2HB       SER  63  37.461  -8.746  -6.976
  477   2HB   SER  63          1HB       SER  63  37.887  -7.459  -8.103
  478    HG   SER  63           HG       SER  63  39.783  -7.699  -7.203
  479    H    GLU  64           H        GLU  64  35.069  -8.456  -5.782
  480    HA   GLU  64           HA       GLU  64  33.378  -8.239  -8.016
  481   1HB   GLU  64          2HB       GLU  64  33.501 -10.157  -6.376
  482   2HB   GLU  64          1HB       GLU  64  32.619  -9.155  -5.235
  483   1HG   GLU  64          2HG       GLU  64  31.051 -10.601  -6.222
  484   2HG   GLU  64          1HG       GLU  64  30.785  -9.013  -6.941
  485    H    ALA  65           H        ALA  65  33.437  -6.675  -4.907
  486    HA   ALA  65           HA       ALA  65  30.911  -5.420  -5.047
  487   1HB   ALA  65          1HB       ALA  65  32.137  -5.761  -2.948
  488   2HB   ALA  65          2HB       ALA  65  31.663  -4.078  -3.176
  489   3HB   ALA  65          3HB       ALA  65  33.331  -4.569  -3.463
  490    H    GLU  66           H        GLU  66  33.988  -4.656  -6.427
  491    HA   GLU  66           HA       GLU  66  33.608  -1.880  -6.812
  492   1HB   GLU  66          2HB       GLU  66  35.772  -3.256  -7.026
  493   2HB   GLU  66          1HB       GLU  66  35.215  -3.647  -8.648
  494   1HG   GLU  66          2HG       GLU  66  36.726  -1.822  -8.811
  495   2HG   GLU  66          1HG       GLU  66  35.104  -1.202  -9.120
  496    H    GLN  67           H        GLN  67  32.826  -4.735  -8.765
  497    HA   GLN  67           HA       GLN  67  31.648  -3.132 -10.846
  498   1HB   GLN  67          2HB       GLN  67  31.602  -6.106 -10.339
  499   2HB   GLN  67          1HB       GLN  67  30.756  -5.345 -11.679
  500   1HG   GLN  67          2HG       GLN  67  32.691  -5.946 -12.707
  501   2HG   GLN  67          1HG       GLN  67  33.109  -4.317 -12.179
  502   1HE2  GLN  67          1HE2      GLN  67  32.873  -7.165 -10.145
  503   2HE2  GLN  67          2HE2      GLN  67  34.555  -7.240  -9.726
  504    H    ILE  68           H        ILE  68  30.566  -4.738  -7.947
  505    HA   ILE  68           HA       ILE  68  27.790  -4.698  -8.488
  506    HB   ILE  68           HB       ILE  68  29.284  -4.702  -5.857
  507   1HG1  ILE  68          2HG1      ILE  68  29.601  -6.714  -7.218
  508   2HG1  ILE  68          1HG1      ILE  68  28.628  -7.086  -5.802
  509   1HG2  ILE  68          1HG2      ILE  68  27.076  -3.730  -5.510
  510   2HG2  ILE  68          2HG2      ILE  68  27.168  -5.339  -4.787
  511   3HG2  ILE  68          3HG2      ILE  68  26.326  -5.106  -6.321
  512   1HD1  ILE  68          1HD1      ILE  68  26.611  -7.001  -7.174
  513   2HD1  ILE  68          2HD1      ILE  68  27.761  -8.201  -7.761
  514   3HD1  ILE  68          3HD1      ILE  68  27.599  -6.651  -8.591
  515    H    ARG  69           H        ARG  69  29.951  -2.288  -7.057
  516    HA   ARG  69           HA       ARG  69  27.828  -0.483  -6.415
  517   1HB   ARG  69          2HB       ARG  69  29.564   1.135  -5.946
  518   2HB   ARG  69          1HB       ARG  69  30.031  -0.422  -5.284
  519   1HG   ARG  69          2HG       ARG  69  31.342  -0.705  -7.490
  520   2HG   ARG  69          1HG       ARG  69  31.154   1.043  -7.633
  521   1HD   ARG  69          2HD       ARG  69  32.466  -0.471  -5.383
  522   2HD   ARG  69          1HD       ARG  69  33.262   0.547  -6.579
  523    HE   ARG  69           HE       ARG  69  31.291   1.728  -4.753
  524   1HH1  ARG  69          1HH1      ARG  69  34.581   1.482  -5.928
  525   2HH1  ARG  69          2HH1      ARG  69  35.143   2.852  -5.008
  526   1HH2  ARG  69          1HH2      ARG  69  32.015   3.507  -3.540
  527   2HH2  ARG  69          2HH2      ARG  69  33.678   4.015  -3.651
  528    H    GLN  70           H        GLN  70  29.860  -1.036  -9.210
  529    HA   GLN  70           HA       GLN  70  29.089   1.306 -10.639
  530   1HB   GLN  70          2HB       GLN  70  31.135  -0.322 -10.896
  531   2HB   GLN  70          1HB       GLN  70  30.047  -1.208 -11.946
  532   1HG   GLN  70          2HG       GLN  70  30.676   1.696 -12.338
  533   2HG   GLN  70          1HG       GLN  70  31.628   0.396 -13.043
  534   1HE2  GLN  70          1HE2      GLN  70  28.661   2.167 -13.170
  535   2HE2  GLN  70          2HE2      GLN  70  28.082   1.491 -14.650
  536    H    LEU  71           H        LEU  71  28.171  -2.116 -10.813
  537    HA   LEU  71           HA       LEU  71  26.456  -2.017 -12.979
  538   1HB   LEU  71          2HB       LEU  71  27.328  -4.060 -11.826
  539   2HB   LEU  71          1HB       LEU  71  26.158  -3.793 -10.553
  540    HG   LEU  71           HG       LEU  71  25.204  -4.112 -13.378
  541   1HD1  LEU  71          1HD1      LEU  71  25.075  -6.522 -13.047
  542   2HD1  LEU  71          2HD1      LEU  71  25.889  -6.366 -11.490
  543   3HD1  LEU  71          3HD1      LEU  71  26.751  -5.976 -12.981
  544   1HD2  LEU  71          1HD2      LEU  71  23.613  -3.447 -11.621
  545   2HD2  LEU  71          2HD2      LEU  71  24.041  -4.887 -10.699
  546   3HD2  LEU  71          3HD2      LEU  71  23.247  -5.049 -12.264
  547    H    LYS  72           H        LYS  72  25.753  -1.327  -9.579
  548    HA   LYS  72           HA       LYS  72  22.934  -1.014 -10.034
  549   1HB   LYS  72          2HB       LYS  72  24.582  -0.003  -7.714
  550   2HB   LYS  72          1HB       LYS  72  22.832  -0.132  -7.766
  551   1HG   LYS  72          2HG       LYS  72  23.127  -2.607  -8.050
  552   2HG   LYS  72          1HG       LYS  72  24.840  -2.364  -7.701
  553   1HD   LYS  72          2HD       LYS  72  22.482  -1.823  -5.907
  554   2HD   LYS  72          1HD       LYS  72  23.803  -2.959  -5.647
  555   1HE   LYS  72          2HE       LYS  72  24.106   0.038  -5.756
  556   2HE   LYS  72          1HE       LYS  72  23.982  -0.903  -4.273
  557   1HZ   LYS  72          1HZ       LYS  72  26.050  -1.825  -4.578
  558   2HZ   LYS  72          2HZ       LYS  72  26.289  -0.250  -5.177
  559   3HZ   LYS  72          3HZ       LYS  72  26.066  -1.542  -6.251
  560    H    LYS  73           H        LYS  73  25.699   1.054 -10.320
  561    HA   LYS  73           HA       LYS  73  26.028   3.287 -10.513
  562   1HB   LYS  73          2HB       LYS  73  23.284   3.067 -11.752
  563   2HB   LYS  73          1HB       LYS  73  24.118   4.607 -11.632
  564   1HG   LYS  73          2HG       LYS  73  24.593   3.901 -13.783
  565   2HG   LYS  73          1HG       LYS  73  26.033   3.432 -12.884
  566   1HD   LYS  73          2HD       LYS  73  25.417   1.630 -14.345
  567   2HD   LYS  73          1HD       LYS  73  25.094   1.142 -12.681
  568   1HE   LYS  73          2HE       LYS  73  22.731   1.623 -12.974
  569   2HE   LYS  73          1HE       LYS  73  23.029   2.194 -14.617
  570   1HZ   LYS  73          1HZ       LYS  73  23.757  -0.016 -15.234
  571   2HZ   LYS  73          2HZ       LYS  73  22.193  -0.092 -14.576
  572   3HZ   LYS  73          3HZ       LYS  73  23.526  -0.569 -13.648
  573    H    GLU  74           H        GLU  74  22.813   4.313 -10.242
  574    HA   GLU  74           HA       GLU  74  22.443   4.117  -7.454
  575   1HB   GLU  74          2HB       GLU  74  22.351   6.700  -7.161
  576   2HB   GLU  74          1HB       GLU  74  23.888   5.867  -7.007
  577   1HG   GLU  74          2HG       GLU  74  24.364   7.765  -8.260
  578   2HG   GLU  74          1HG       GLU  74  24.276   6.467  -9.445
  579    H    ASN  75           H        ASN  75  20.364   4.849  -6.817
  580    HA   ASN  75           HA       ASN  75  18.573   5.040  -9.132
  581   1HB   ASN  75          2HB       ASN  75  18.006   4.182  -6.288
  582   2HB   ASN  75          1HB       ASN  75  16.777   4.341  -7.533
  583   1HD2  ASN  75          1HD2      ASN  75  18.593   3.315  -9.622
  584   2HD2  ASN  75          2HD2      ASN  75  18.688   1.609  -9.351
  585    H    ALA  76           H        ALA  76  16.863   6.511  -9.164
  586    HA   ALA  76           HA       ALA  76  17.494   9.089  -8.229
  587   1HB   ALA  76          1HB       ALA  76  14.864   8.080  -9.308
  588   2HB   ALA  76          2HB       ALA  76  16.205   8.690 -10.277
  589   3HB   ALA  76          3HB       ALA  76  15.357   9.768  -9.171
  590    H    LEU  77           H        LEU  77  15.552   6.526  -6.961
  591    HA   LEU  77           HA       LEU  77  14.113   7.986  -5.019
  592   1HB   LEU  77          2HB       LEU  77  14.979   5.092  -5.001
  593   2HB   LEU  77          1HB       LEU  77  13.753   5.798  -3.973
  594    HG   LEU  77           HG       LEU  77  13.590   5.556  -6.975
  595   1HD1  LEU  77          1HD1      LEU  77  12.127   4.069  -4.797
  596   2HD1  LEU  77          2HD1      LEU  77  13.383   3.407  -5.842
  597   3HD1  LEU  77          3HD1      LEU  77  11.842   3.915  -6.531
  598   1HD2  LEU  77          1HD2      LEU  77  12.440   7.544  -6.088
  599   2HD2  LEU  77          2HD2      LEU  77  11.523   6.503  -4.997
  600   3HD2  LEU  77          3HD2      LEU  77  11.316   6.351  -6.743
  601    H    GLN  78           H        GLN  78  17.307   6.583  -5.113
  602    HA   GLN  78           HA       GLN  78  17.835   6.894  -2.310
  603   1HB   GLN  78          2HB       GLN  78  18.938   5.195  -3.773
  604   2HB   GLN  78          1HB       GLN  78  19.767   6.501  -4.605
  605   1HG   GLN  78          2HG       GLN  78  20.862   7.116  -2.487
  606   2HG   GLN  78          1HG       GLN  78  20.071   5.747  -1.706
  607   1HE2  GLN  78          1HE2      GLN  78  22.919   6.267  -2.015
  608   2HE2  GLN  78          2HE2      GLN  78  23.558   4.925  -2.896
  609    H    ARG  79           H        ARG  79  18.047   8.824  -5.161
  610    HA   ARG  79           HA       ARG  79  19.954  10.711  -4.248
  611   1HB   ARG  79          2HB       ARG  79  19.274  10.323  -6.649
  612   2HB   ARG  79          1HB       ARG  79  17.780  11.175  -6.285
  613   1HG   ARG  79          2HG       ARG  79  19.102  12.810  -7.246
  614   2HG   ARG  79          1HG       ARG  79  19.315  13.098  -5.518
  615   1HD   ARG  79          2HD       ARG  79  21.200  11.552  -7.294
  616   2HD   ARG  79          1HD       ARG  79  21.440  13.206  -6.742
  617    HE   ARG  79           HE       ARG  79  21.247  11.954  -4.421
  618   1HH1  ARG  79          1HH1      ARG  79  22.983  11.029  -7.320
  619   2HH1  ARG  79          2HH1      ARG  79  24.247  10.199  -6.452
  620   1HH2  ARG  79          1HH2      ARG  79  22.902  10.878  -3.272
  621   2HH2  ARG  79          2HH2      ARG  79  24.203  10.130  -4.152
  622    H    ALA  80           H        ALA  80  16.593  10.265  -3.719
  623    HA   ALA  80           HA       ALA  80  15.917  12.913  -2.962
  624   1HB   ALA  80          1HB       ALA  80  14.237  11.255  -3.615
  625   2HB   ALA  80          2HB       ALA  80  13.890  11.938  -2.027
  626   3HB   ALA  80          3HB       ALA  80  14.594  10.326  -2.160
  627    H    ARG  81           H        ARG  81  17.520  10.324  -1.386
  628    HA   ARG  81           HA       ARG  81  17.245  11.337   1.293
  629   1HB   ARG  81          2HB       ARG  81  18.658   9.102  -0.048
  630   2HB   ARG  81          1HB       ARG  81  19.361   9.688   1.452
  631   1HG   ARG  81          2HG       ARG  81  16.474   8.889   1.205
  632   2HG   ARG  81          1HG       ARG  81  17.756   7.762   1.659
  633   1HD   ARG  81          2HD       ARG  81  16.966  10.288   3.106
  634   2HD   ARG  81          1HD       ARG  81  16.688   8.634   3.649
  635    HE   ARG  81           HE       ARG  81  19.355   8.678   3.375
  636   1HH1  ARG  81          1HH1      ARG  81  17.151  10.868   5.005
  637   2HH1  ARG  81          2HH1      ARG  81  18.347  11.403   6.154
  638   1HH2  ARG  81          1HH2      ARG  81  20.910   9.379   4.858
  639   2HH2  ARG  81          2HH2      ARG  81  20.492  10.553   6.074
  640    H    THR  82           H        THR  82  19.006  12.209  -1.392
  641    HA   THR  82           HA       THR  82  21.315  13.192   0.083
  642    HB   THR  82           HB       THR  82  20.825  13.418  -2.883
  643    HG1  THR  82           1HG      THR  82  21.170  11.202  -1.467
  644   1HG2  THR  82          1HG2      THR  82  23.279  13.578  -2.977
  645   2HG2  THR  82          2HG2      THR  82  23.346  13.487  -1.217
  646   3HG2  THR  82          3HG2      THR  82  22.581  14.869  -2.000
  647    H    ARG  83           H        ARG  83  19.638  14.728  -2.613
  648    HA   ARG  83           HA       ARG  83  19.453  17.167  -0.997
  649   1HB   ARG  83          2HB       ARG  83  20.522  16.790  -3.770
  650   2HB   ARG  83          1HB       ARG  83  19.933  18.344  -3.226
  651   1HG   ARG  83          2HG       ARG  83  22.119  16.796  -1.860
  652   2HG   ARG  83          1HG       ARG  83  22.390  18.074  -3.048
  653   1HD   ARG  83          2HD       ARG  83  20.977  18.361  -0.399
  654   2HD   ARG  83          1HD       ARG  83  22.594  18.951  -0.791
  655    HE   ARG  83           HE       ARG  83  21.008  20.123  -2.666
  656   1HH1  ARG  83          1HH1      ARG  83  20.912  20.007   0.834
  657   2HH1  ARG  83          2HH1      ARG  83  20.159  21.563   0.981
  658   1HH2  ARG  83          1HH2      ARG  83  20.006  22.135  -2.483
  659   2HH2  ARG  83          2HH2      ARG  83  19.633  22.786  -0.909
  660    H    HIS  84           H        HIS  84  17.536  17.977  -0.911
  661    HA   HIS  84           HA       HIS  84  15.460  18.709  -1.386
  662   1HB   HIS  84          2HB       HIS  84  16.511  19.691  -3.366
  663   2HB   HIS  84          1HB       HIS  84  16.232  18.204  -4.261
  664    HD1  HIS  84           1HD      HIS  84  14.326  21.047  -2.653
  665    HD2  HIS  84           2HD      HIS  84  13.748  17.997  -5.426
  666    HE1  HIS  84           1HE      HIS  84  12.070  21.483  -3.683
  667    HE2  HIS  84           2HE      HIS  84  11.665  19.526  -5.216
  668    HA   PRO  85           HA       PRO  85  13.355  14.726  -1.647
  669   1HB   PRO  85          2HB       PRO  85  11.570  15.755   0.363
  670   2HB   PRO  85          1HB       PRO  85  12.768  14.472   0.520
  671   1HG   PRO  85          2HG       PRO  85  12.936  16.917   1.771
  672   2HG   PRO  85          1HG       PRO  85  14.322  15.870   1.417
  673   1HD   PRO  85          2HD       PRO  85  13.345  18.287  -0.051
  674   2HD   PRO  85          1HD       PRO  85  15.008  17.758   0.280
  675    H    ALA  86           H        ALA  86  10.651  14.675  -1.258
  676    HA   ALA  86           HA       ALA  86   9.708  15.990  -3.637
  677   1HB   ALA  86          1HB       ALA  86   8.200  14.285  -1.663
  678   2HB   ALA  86          2HB       ALA  86   9.042  13.692  -3.093
  679   3HB   ALA  86          3HB       ALA  86   7.648  14.756  -3.271
  680    H    GLU  87           H        GLU  87   9.755  18.192  -3.152
  681    HA   GLU  87           HA       GLU  87   8.627  19.295  -0.793
  682   1HB   GLU  87          2HB       GLU  87  10.421  20.356  -2.190
  683   2HB   GLU  87          1HB       GLU  87   9.197  20.715  -3.399
  684   1HG   GLU  87          2HG       GLU  87   8.023  22.140  -1.852
  685   2HG   GLU  87          1HG       GLU  87   9.139  21.704  -0.558
  686    H    SER  88           H        SER  88   7.351  18.521  -3.939
  687    HA   SER  88           HA       SER  88   5.046  20.164  -3.814
  688   1HB   SER  88          2HB       SER  88   6.052  19.041  -5.887
  689   2HB   SER  88          1HB       SER  88   5.218  17.577  -5.363
  690    HG   SER  88           HG       SER  88   3.869  20.048  -5.646
  691    H    CYS  89           H        CYS  89   5.841  17.068  -2.466
  692    HA   CYS  89           HA       CYS  89   3.149  16.333  -1.834
  693   1HB   CYS  89          2HB       CYS  89   5.760  15.334  -0.678
  694   2HB   CYS  89          1HB       CYS  89   4.185  14.586  -0.436
  695    HG   CYS  89           HG       CYS  89   4.718  12.906  -2.334
  696    H    LEU  90           H        LEU  90   5.582  18.311  -0.428
  697    HA   LEU  90           HA       LEU  90   4.404  18.494   2.180
  698   1HB   LEU  90          2HB       LEU  90   6.210  20.527   0.880
  699   2HB   LEU  90          1HB       LEU  90   5.963  20.254   2.595
  700    HG   LEU  90           HG       LEU  90   7.328  18.349   0.700
  701   1HD1  LEU  90          1HD1      LEU  90   8.465  20.131   2.854
  702   2HD1  LEU  90          2HD1      LEU  90   8.644  20.365   1.116
  703   3HD1  LEU  90          3HD1      LEU  90   9.369  18.960   1.896
  704   1HD2  LEU  90          1HD2      LEU  90   6.184  17.193   2.516
  705   2HD2  LEU  90          2HD2      LEU  90   6.978  18.238   3.695
  706   3HD2  LEU  90          3HD2      LEU  90   7.934  17.117   2.724
  707    H    GLU  91           H        GLU  91   4.278  20.281  -0.840
  708    HA   GLU  91           HA       GLU  91   2.581  22.385  -0.107
  709   1HB   GLU  91          2HB       GLU  91   2.405  20.858  -2.707
  710   2HB   GLU  91          1HB       GLU  91   1.909  22.514  -2.419
  711   1HG   GLU  91          2HG       GLU  91   4.254  23.133  -2.078
  712   2HG   GLU  91          1HG       GLU  91   4.725  21.470  -2.441
  713    H    HIS  92           H        HIS  92   1.997  19.017  -0.676
  714    HA   HIS  92           HA       HIS  92   0.170  17.684  -0.774
  715   1HB   HIS  92          2HB       HIS  92  -0.287  18.931   1.454
  716   2HB   HIS  92          1HB       HIS  92  -1.460  19.863   0.530
  717    HD1  HIS  92           1HD      HIS  92  -0.847  16.468   1.976
  718    HD2  HIS  92           2HD      HIS  92  -3.790  18.467  -0.190
  719    HE1  HIS  92           1HE      HIS  92  -2.884  14.997   2.070
  720    HE2  HIS  92           2HE      HIS  92  -4.631  16.183   0.694
  721    H    HIS  93           H        HIS  93   0.865  19.024  -2.943
  722    HA   HIS  93           HA       HIS  93  -0.840  20.789  -4.210
  723   1HB   HIS  93          2HB       HIS  93   1.501  19.633  -4.838
  724   2HB   HIS  93          1HB       HIS  93   0.442  18.656  -5.844
  725    HD1  HIS  93           1HD      HIS  93   2.453  21.571  -5.992
  726    HD2  HIS  93           2HD      HIS  93  -1.276  20.521  -7.533
  727    HE1  HIS  93           1HE      HIS  93   2.047  23.129  -7.928
  728    HE2  HIS  93           2HE      HIS  93  -0.240  22.532  -8.803
  729    H    HIS  94           H        HIS  94  -2.941  20.592  -4.668
  730    HA   HIS  94           HA       HIS  94  -4.158  17.959  -4.637
  731   1HB   HIS  94          2HB       HIS  94  -5.164  19.824  -3.371
  732   2HB   HIS  94          1HB       HIS  94  -5.424  20.697  -4.875
  733    HD1  HIS  94           1HD      HIS  94  -6.988  18.309  -2.609
  734    HD2  HIS  94           2HD      HIS  94  -7.398  19.382  -6.611
  735    HE1  HIS  94           1HE      HIS  94  -9.225  17.405  -3.335
  736    HE2  HIS  94           2HE      HIS  94  -9.420  17.999  -5.781
  737    H    HIS  95           H        HIS  95  -3.907  20.683  -6.923
  738    HA   HIS  95           HA       HIS  95  -5.601  19.403  -8.836
  739   1HB   HIS  95          2HB       HIS  95  -5.248  21.922  -8.544
  740   2HB   HIS  95          1HB       HIS  95  -3.743  21.696  -9.431
  741    HD1  HIS  95           1HD      HIS  95  -3.962  20.991 -11.975
  742    HD2  HIS  95           2HD      HIS  95  -7.554  21.890 -10.069
  743    HE1  HIS  95           1HE      HIS  95  -5.661  21.257 -13.807
  744    HE2  HIS  95           2HE      HIS  95  -7.782  21.969 -12.646
  745    H    HIS  96           H        HIS  96  -5.079  17.862 -10.169
  746    HA   HIS  96           HA       HIS  96  -2.534  17.948 -11.584
  747   1HB   HIS  96          2HB       HIS  96  -3.499  15.586  -9.973
  748   2HB   HIS  96          1HB       HIS  96  -2.422  15.384 -11.349
  749    HD1  HIS  96           1HD      HIS  96  -0.005  16.402 -11.117
  750    HD2  HIS  96           2HD      HIS  96  -2.296  16.429  -7.641
  751    HE1  HIS  96           1HE      HIS  96   1.612  16.814  -9.235
  752    HE2  HIS  96           2HE      HIS  96   0.236  16.592  -7.132
  753    H    HIS  97           H        HIS  97  -2.658  17.047 -13.651
  754    HA   HIS  97           HA       HIS  97  -4.870  15.472 -14.512
  755   1HB   HIS  97          2HB       HIS  97  -5.911  17.762 -14.448
  756   2HB   HIS  97          1HB       HIS  97  -4.719  18.284 -15.633
  757    HD1  HIS  97           1HD      HIS  97  -4.859  17.008 -18.010
  758    HD2  HIS  97           2HD      HIS  97  -8.150  16.625 -15.501
  759    HE1  HIS  97           1HE      HIS  97  -6.746  16.236 -19.483
  760    HE2  HIS  97           2HE      HIS  97  -8.771  16.174 -17.975
  Start of MODEL    4
    1   1H    MET   1          1HT       MET   1   7.279  21.943  -2.536
    2   2H    MET   1          2HT       MET   1   6.083  22.839  -3.337
    3   3H    MET   1          3HT       MET   1   6.373  21.230  -3.782
    4    HA   MET   1           HA       MET   1   5.337  22.131  -1.163
    5   1HB   MET   1          2HB       MET   1   3.706  22.396  -2.988
    6   2HB   MET   1          1HB       MET   1   3.954  20.722  -3.456
    7   1HG   MET   1          2HG       MET   1   3.105  20.006  -1.258
    8   2HG   MET   1          1HG       MET   1   2.784  21.694  -0.862
    9   1HE   MET   1          1HE       MET   1   0.566  19.400  -0.695
   10   2HE   MET   1          2HE       MET   1  -0.813  20.248  -1.398
   11   3HE   MET   1          3HE       MET   1   0.273  21.097  -0.298
   12    HA   PRO   2           HA       PRO   2   6.986  18.154   0.037
   13   1HB   PRO   2          2HB       PRO   2   5.560  18.592   2.554
   14   2HB   PRO   2          1HB       PRO   2   7.297  18.484   2.261
   15   1HG   PRO   2          2HG       PRO   2   6.079  20.799   2.937
   16   2HG   PRO   2          1HG       PRO   2   7.505  20.744   1.884
   17   1HD   PRO   2          2HD       PRO   2   4.615  21.058   1.149
   18   2HD   PRO   2          1HD       PRO   2   6.042  21.890   0.491
   19    H    THR   3           H        THR   3   6.196  16.100   0.089
   20    HA   THR   3           HA       THR   3   3.425  15.601   0.734
   21    HB   THR   3           HB       THR   3   3.253  16.226  -1.638
   22    HG1  THR   3           1HG      THR   3   2.228  14.263  -2.336
   23   1HG2  THR   3          1HG2      THR   3   5.121  13.909  -2.139
   24   2HG2  THR   3          2HG2      THR   3   5.514  15.613  -2.358
   25   3HG2  THR   3          3HG2      THR   3   4.292  14.851  -3.376
   26    H    LYS   4           H        LYS   4   2.950  13.193   0.451
   27    HA   LYS   4           HA       LYS   4   5.251  11.457   0.584
   28   1HB   LYS   4          2HB       LYS   4   5.234  12.194   2.872
   29   2HB   LYS   4          1HB       LYS   4   3.505  11.920   3.005
   30   1HG   LYS   4          2HG       LYS   4   4.930  10.205   4.121
   31   2HG   LYS   4          1HG       LYS   4   3.783   9.566   2.947
   32   1HD   LYS   4          2HD       LYS   4   5.541   9.322   1.301
   33   2HD   LYS   4          1HD       LYS   4   6.708  10.081   2.384
   34   1HE   LYS   4          2HE       LYS   4   6.860   7.601   2.328
   35   2HE   LYS   4          1HE       LYS   4   6.549   8.260   3.934
   36   1HZ   LYS   4          1HZ       LYS   4   4.402   7.239   2.157
   37   2HZ   LYS   4          2HZ       LYS   4   4.289   7.628   3.806
   38   3HZ   LYS   4          3HZ       LYS   4   5.186   6.279   3.315
   39    H    THR   5           H        THR   5   4.656   9.970  -0.785
   40    HA   THR   5           HA       THR   5   1.890   9.045  -0.870
   41    HB   THR   5           HB       THR   5   2.833   9.726  -3.001
   42    HG1  THR   5           1HG      THR   5   1.530   7.635  -2.746
   43   1HG2  THR   5          1HG2      THR   5   5.196   9.382  -2.503
   44   2HG2  THR   5          2HG2      THR   5   4.742   8.598  -4.016
   45   3HG2  THR   5          3HG2      THR   5   4.958   7.637  -2.551
   46    H    TYR   6           H        TYR   6   3.189   6.525  -2.161
   47    HA   TYR   6           HA       TYR   6   2.773   4.739  -0.101
   48   1HB   TYR   6          2HB       TYR   6   3.948   3.086  -1.487
   49   2HB   TYR   6          1HB       TYR   6   2.874   4.083  -2.460
   50    HD1  TYR   6           1HD      TYR   6   6.406   3.451  -1.597
   51    HD2  TYR   6           2HD      TYR   6   3.731   5.470  -4.215
   52    HE1  TYR   6           1HE      TYR   6   8.283   4.004  -3.076
   53    HE2  TYR   6           2HE      TYR   6   5.607   6.030  -5.705
   54    HH   TYR   6           HH       TYR   6   8.126   6.305  -5.478
   55    H    SER   7           H        SER   7   4.227   3.351   1.054
   56    HA   SER   7           HA       SER   7   6.752   4.664   1.794
   57   1HB   SER   7          2HB       SER   7   5.161   2.666   3.421
   58   2HB   SER   7          1HB       SER   7   6.537   3.627   3.967
   59    HG   SER   7           HG       SER   7   4.331   4.388   4.522
   60    H    GLU   8           H        GLU   8   8.556   3.203   2.361
   61    HA   GLU   8           HA       GLU   8   8.957   1.122   0.492
   62   1HB   GLU   8          2HB       GLU   8  10.394   1.666   3.100
   63   2HB   GLU   8          1HB       GLU   8  10.948   0.544   1.866
   64   1HG   GLU   8          2HG       GLU   8  11.009   2.484   0.274
   65   2HG   GLU   8          1HG       GLU   8  10.714   3.533   1.660
   66    H    GLU   9           H        GLU   9   7.847   1.183   3.809
   67    HA   GLU   9           HA       GLU   9   7.746  -1.542   4.377
   68   1HB   GLU   9          2HB       GLU   9   7.349   0.308   5.994
   69   2HB   GLU   9          1HB       GLU   9   5.795   0.607   5.233
   70   1HG   GLU   9          2HG       GLU   9   5.137  -1.721   5.834
   71   2HG   GLU   9          1HG       GLU   9   6.639  -1.847   6.749
   72    H    PHE  10           H        PHE  10   5.510   0.537   2.628
   73    HA   PHE  10           HA       PHE  10   3.389  -1.327   2.435
   74   1HB   PHE  10          2HB       PHE  10   3.097   1.117   2.126
   75   2HB   PHE  10          1HB       PHE  10   4.004   1.020   0.620
   76    HD1  PHE  10           1HD      PHE  10   2.967   0.353  -1.388
   77    HD2  PHE  10           2HD      PHE  10   0.894  -0.026   2.307
   78    HE1  PHE  10           1HE      PHE  10   0.885  -0.105  -2.608
   79    HE2  PHE  10           2HE      PHE  10  -1.195  -0.492   1.090
   80    HZ   PHE  10           HZ       PHE  10  -1.199  -0.530  -1.372
   81    H    LYS  11           H        LYS  11   5.932  -0.388   0.127
   82    HA   LYS  11           HA       LYS  11   5.260  -2.216  -1.889
   83   1HB   LYS  11          2HB       LYS  11   7.969  -1.065  -1.179
   84   2HB   LYS  11          1HB       LYS  11   7.566  -1.853  -2.699
   85   1HG   LYS  11          2HG       LYS  11   5.827  -0.085  -3.053
   86   2HG   LYS  11          1HG       LYS  11   6.478   0.745  -1.638
   87   1HD   LYS  11          2HD       LYS  11   8.176  -0.017  -4.007
   88   2HD   LYS  11          1HD       LYS  11   7.331   1.525  -3.896
   89   1HE   LYS  11          2HE       LYS  11   8.544   2.091  -1.901
   90   2HE   LYS  11          1HE       LYS  11   9.312   0.508  -1.885
   91   1HZ   LYS  11          1HZ       LYS  11  10.629   1.033  -3.694
   92   2HZ   LYS  11          2HZ       LYS  11  10.598   2.500  -2.845
   93   3HZ   LYS  11          3HZ       LYS  11   9.618   2.291  -4.214
   94    H    ARG  12           H        ARG  12   7.131  -2.533   1.033
   95    HA   ARG  12           HA       ARG  12   8.248  -5.092   0.475
   96   1HB   ARG  12          2HB       ARG  12   8.868  -3.279   2.261
   97   2HB   ARG  12          1HB       ARG  12   7.652  -4.086   3.239
   98   1HG   ARG  12          2HG       ARG  12   8.904  -6.200   2.976
   99   2HG   ARG  12          1HG       ARG  12  10.161  -5.305   2.112
  100   1HD   ARG  12          2HD       ARG  12  10.171  -3.767   4.176
  101   2HD   ARG  12          1HD       ARG  12   9.322  -5.086   4.981
  102    HE   ARG  12           HE       ARG  12  11.967  -5.446   3.714
  103   1HH1  ARG  12          1HH1      ARG  12   9.730  -5.965   6.376
  104   2HH1  ARG  12          2HH1      ARG  12  10.925  -6.744   7.378
  105   1HH2  ARG  12          1HH2      ARG  12  13.525  -6.473   5.055
  106   2HH2  ARG  12          2HH2      ARG  12  13.051  -7.031   6.636
  107    H    ASP  13           H        ASP  13   5.376  -3.931   2.161
  108    HA   ASP  13           HA       ASP  13   4.427  -6.411   3.106
  109   1HB   ASP  13          2HB       ASP  13   3.693  -4.136   3.882
  110   2HB   ASP  13          1HB       ASP  13   2.776  -3.979   2.391
  111    H    ALA  14           H        ALA  14   3.930  -4.661   0.094
  112    HA   ALA  14           HA       ALA  14   1.926  -6.245  -1.036
  113   1HB   ALA  14          1HB       ALA  14   2.704  -5.384  -3.186
  114   2HB   ALA  14          2HB       ALA  14   4.183  -4.805  -2.420
  115   3HB   ALA  14          3HB       ALA  14   2.625  -4.105  -1.975
  116    H    VAL  15           H        VAL  15   5.420  -6.673  -0.928
  117    HA   VAL  15           HA       VAL  15   5.530  -8.928  -2.625
  118    HB   VAL  15           HB       VAL  15   7.390  -8.288  -0.332
  119   1HG1  VAL  15          1HG1      VAL  15   7.815  -9.941  -2.821
  120   2HG1  VAL  15          2HG1      VAL  15   7.653 -10.562  -1.178
  121   3HG1  VAL  15          3HG1      VAL  15   9.045  -9.568  -1.613
  122   1HG2  VAL  15          1HG2      VAL  15   8.785  -7.178  -2.035
  123   2HG2  VAL  15          2HG2      VAL  15   7.228  -6.381  -1.811
  124   3HG2  VAL  15          3HG2      VAL  15   7.496  -7.413  -3.216
  125    H    ALA  16           H        ALA  16   5.157  -8.589   0.875
  126    HA   ALA  16           HA       ALA  16   5.172 -11.344   1.504
  127   1HB   ALA  16          1HB       ALA  16   3.912  -9.032   2.982
  128   2HB   ALA  16          2HB       ALA  16   5.557  -9.633   3.195
  129   3HB   ALA  16          3HB       ALA  16   4.183 -10.644   3.644
  130    H    LEU  17           H        LEU  17   2.630  -9.112   0.572
  131    HA   LEU  17           HA       LEU  17   0.443 -10.839   1.023
  132   1HB   LEU  17          2HB       LEU  17   0.238  -8.404   0.685
  133   2HB   LEU  17          1HB       LEU  17   0.747  -8.596  -0.979
  134    HG   LEU  17           HG       LEU  17  -1.277  -9.891  -1.465
  135   1HD1  LEU  17          1HD1      LEU  17  -1.638 -10.888   0.723
  136   2HD1  LEU  17          2HD1      LEU  17  -3.080 -10.031   0.177
  137   3HD1  LEU  17          3HD1      LEU  17  -2.029  -9.306   1.394
  138   1HD2  LEU  17          1HD2      LEU  17  -1.831  -7.248  -0.125
  139   2HD2  LEU  17          2HD2      LEU  17  -2.878  -8.059  -1.292
  140   3HD2  LEU  17          3HD2      LEU  17  -1.289  -7.477  -1.787
  141    H    TYR  18           H        TYR  18   2.481 -10.222  -1.807
  142    HA   TYR  18           HA       TYR  18   1.073 -11.900  -3.586
  143   1HB   TYR  18          2HB       TYR  18   2.517 -10.322  -4.577
  144   2HB   TYR  18          1HB       TYR  18   3.887 -10.836  -3.596
  145    HD1  TYR  18           1HD      TYR  18   5.387 -12.428  -4.412
  146    HD2  TYR  18           2HD      TYR  18   1.596 -12.005  -6.293
  147    HE1  TYR  18           1HE      TYR  18   6.101 -13.971  -6.184
  148    HE2  TYR  18           2HE      TYR  18   2.301 -13.551  -8.074
  149    HH   TYR  18           HH       TYR  18   5.061 -15.488  -7.835
  150    H    GLU  19           H        GLU  19   3.871 -12.544  -1.473
  151    HA   GLU  19           HA       GLU  19   4.428 -15.099  -2.547
  152   1HB   GLU  19          2HB       GLU  19   5.812 -15.480  -0.590
  153   2HB   GLU  19          1HB       GLU  19   6.066 -13.857  -1.214
  154   1HG   GLU  19          2HG       GLU  19   4.800 -12.896   0.545
  155   2HG   GLU  19          1HG       GLU  19   4.259 -14.481   1.103
  156    H    ASN  20           H        ASN  20   1.987 -13.998  -0.446
  157    HA   ASN  20           HA       ASN  20   1.291 -16.616   0.578
  158   1HB   ASN  20          2HB       ASN  20  -0.014 -13.901   0.703
  159   2HB   ASN  20          1HB       ASN  20  -0.847 -15.341   1.266
  160   1HD2  ASN  20          1HD2      ASN  20   2.607 -14.883   1.595
  161   2HD2  ASN  20          2HD2      ASN  20   2.615 -14.694   3.313
  162    H    SER  21           H        SER  21   1.587 -16.573  -2.168
  163    HA   SER  21           HA       SER  21  -0.750 -16.056  -3.649
  164   1HB   SER  21          2HB       SER  21   0.422 -17.409  -5.414
  165   2HB   SER  21          1HB       SER  21   1.378 -16.094  -4.740
  166    HG   SER  21           HG       SER  21   2.775 -17.685  -4.545
  167    H    ASP  22           H        ASP  22   0.059 -18.609  -1.578
  168    HA   ASP  22           HA       ASP  22  -1.323 -20.789  -2.573
  169   1HB   ASP  22          2HB       ASP  22  -0.053 -20.934  -0.513
  170   2HB   ASP  22          1HB       ASP  22  -1.147 -19.805   0.280
  171    H    GLY  23           H        GLY  23  -2.526 -17.804  -1.290
  172   1HA   GLY  23          2HA       GLY  23  -5.219 -18.609  -2.159
  173   2HA   GLY  23          1HA       GLY  23  -5.011 -17.858  -0.582
  174    H    ALA  24           H        ALA  24  -3.407 -17.111  -3.660
  175    HA   ALA  24           HA       ALA  24  -4.852 -14.677  -4.036
  176   1HB   ALA  24          1HB       ALA  24  -1.985 -14.460  -3.136
  177   2HB   ALA  24          2HB       ALA  24  -3.391 -14.049  -2.155
  178   3HB   ALA  24          3HB       ALA  24  -3.041 -13.134  -3.621
  179    H    SER  25           H        SER  25  -4.646 -13.973  -6.074
  180    HA   SER  25           HA       SER  25  -2.816 -15.408  -7.855
  181   1HB   SER  25          2HB       SER  25  -5.196 -15.366  -8.485
  182   2HB   SER  25          1HB       SER  25  -5.177 -13.605  -8.477
  183    HG   SER  25           HG       SER  25  -4.888 -14.187 -10.573
  184    H    LEU  26           H        LEU  26  -1.500 -14.236  -9.384
  185    HA   LEU  26           HA       LEU  26  -0.110 -12.064  -8.239
  186   1HB   LEU  26          2HB       LEU  26   0.552 -13.826 -10.085
  187   2HB   LEU  26          1HB       LEU  26  -0.041 -12.600 -11.187
  188    HG   LEU  26           HG       LEU  26   2.183 -12.177  -9.185
  189   1HD1  LEU  26          1HD1      LEU  26   2.843 -13.768 -10.892
  190   2HD1  LEU  26          2HD1      LEU  26   3.669 -12.229 -11.126
  191   3HD1  LEU  26          3HD1      LEU  26   2.305 -12.663 -12.158
  192   1HD2  LEU  26          1HD2      LEU  26   1.010 -10.117  -9.742
  193   2HD2  LEU  26          2HD2      LEU  26   1.228 -10.448 -11.461
  194   3HD2  LEU  26          3HD2      LEU  26   2.631 -10.135 -10.437
  195    H    GLN  27           H        GLN  27  -2.307 -12.171 -11.051
  196    HA   GLN  27           HA       GLN  27  -2.429  -9.425 -11.556
  197   1HB   GLN  27          2HB       GLN  27  -3.338 -11.249 -13.028
  198   2HB   GLN  27          1HB       GLN  27  -4.685 -11.409 -11.910
  199   1HG   GLN  27          2HG       GLN  27  -5.467 -10.082 -13.692
  200   2HG   GLN  27          1HG       GLN  27  -5.187  -8.981 -12.345
  201   1HE2  GLN  27          1HE2      GLN  27  -4.985  -7.214 -13.692
  202   2HE2  GLN  27          2HE2      GLN  27  -3.591  -6.963 -14.691
  203    H    GLN  28           H        GLN  28  -4.232 -11.452  -9.331
  204    HA   GLN  28           HA       GLN  28  -6.237  -9.675  -8.550
  205   1HB   GLN  28          2HB       GLN  28  -6.209 -12.086  -8.042
  206   2HB   GLN  28          1HB       GLN  28  -4.868 -11.838  -6.938
  207   1HG   GLN  28          2HG       GLN  28  -6.334 -10.418  -5.543
  208   2HG   GLN  28          1HG       GLN  28  -7.674 -10.796  -6.626
  209   1HE2  GLN  28          1HE2      GLN  28  -8.866 -11.835  -5.028
  210   2HE2  GLN  28          2HE2      GLN  28  -8.408 -13.390  -4.406
  211    H    ILE  29           H        ILE  29  -2.966 -10.165  -7.253
  212    HA   ILE  29           HA       ILE  29  -3.204  -8.387  -5.071
  213    HB   ILE  29           HB       ILE  29  -0.679  -9.094  -6.581
  214   1HG1  ILE  29          2HG1      ILE  29  -1.838 -11.112  -5.824
  215   2HG1  ILE  29          1HG1      ILE  29  -0.371 -10.852  -4.890
  216   1HG2  ILE  29          1HG2      ILE  29  -1.076  -8.096  -3.763
  217   2HG2  ILE  29          2HG2      ILE  29  -0.422  -7.165  -5.111
  218   3HG2  ILE  29          3HG2      ILE  29   0.464  -8.558  -4.490
  219   1HD1  ILE  29          1HD1      ILE  29  -2.123 -11.578  -3.440
  220   2HD1  ILE  29          2HD1      ILE  29  -3.193 -10.302  -4.019
  221   3HD1  ILE  29          3HD1      ILE  29  -1.756  -9.890  -3.082
  222    H    ALA  30           H        ALA  30  -1.749  -7.932  -8.292
  223    HA   ALA  30           HA       ALA  30  -1.057  -5.231  -7.961
  224   1HB   ALA  30          1HB       ALA  30  -0.838  -5.151 -10.376
  225   2HB   ALA  30          2HB       ALA  30  -1.737  -6.660 -10.527
  226   3HB   ALA  30          3HB       ALA  30  -0.153  -6.650  -9.749
  227    H    ASN  31           H        ASN  31  -3.969  -6.755  -9.199
  228    HA   ASN  31           HA       ASN  31  -5.305  -4.439 -10.079
  229   1HB   ASN  31          2HB       ASN  31  -5.843  -6.922 -10.513
  230   2HB   ASN  31          1HB       ASN  31  -6.668  -6.885  -8.961
  231   1HD2  ASN  31          1HD2      ASN  31  -7.744  -7.406 -11.574
  232   2HD2  ASN  31          2HD2      ASN  31  -8.957  -6.203 -11.874
  233    H    ASP  32           H        ASP  32  -5.383  -6.187  -7.001
  234    HA   ASP  32           HA       ASP  32  -7.431  -4.643  -5.815
  235   1HB   ASP  32          2HB       ASP  32  -6.783  -6.899  -5.043
  236   2HB   ASP  32          1HB       ASP  32  -5.259  -6.244  -4.450
  237    H    LEU  33           H        LEU  33  -3.899  -4.380  -5.710
  238    HA   LEU  33           HA       LEU  33  -3.885  -2.218  -3.853
  239   1HB   LEU  33          2HB       LEU  33  -1.875  -3.500  -5.635
  240   2HB   LEU  33          1HB       LEU  33  -1.522  -1.896  -5.028
  241    HG   LEU  33           HG       LEU  33  -1.754  -2.733  -2.712
  242   1HD1  LEU  33          1HD1      LEU  33  -1.863  -5.125  -2.279
  243   2HD1  LEU  33          2HD1      LEU  33  -2.025  -5.442  -4.006
  244   3HD1  LEU  33          3HD1      LEU  33  -3.298  -4.577  -3.147
  245   1HD2  LEU  33          1HD2      LEU  33   0.197  -4.284  -4.407
  246   2HD2  LEU  33          2HD2      LEU  33   0.322  -4.004  -2.670
  247   3HD2  LEU  33          3HD2      LEU  33   0.433  -2.649  -3.794
  248    H    GLY  34           H        GLY  34  -4.041  -2.460  -7.331
  249   1HA   GLY  34          2HA       GLY  34  -5.046  -0.802  -8.689
  250   2HA   GLY  34          1HA       GLY  34  -4.694   0.392  -7.448
  251    H    ILE  35           H        ILE  35  -2.409  -1.938  -8.755
  252    HA   ILE  35           HA       ILE  35  -0.968   0.264 -10.067
  253    HB   ILE  35           HB       ILE  35   1.158  -0.850  -9.400
  254   1HG1  ILE  35          2HG1      ILE  35  -0.647  -2.436  -7.559
  255   2HG1  ILE  35          1HG1      ILE  35   0.243  -3.080  -8.933
  256   1HG2  ILE  35          1HG2      ILE  35   0.369   1.118  -8.218
  257   2HG2  ILE  35          2HG2      ILE  35   1.187   0.014  -7.114
  258   3HG2  ILE  35          3HG2      ILE  35  -0.574   0.101  -7.127
  259   1HD1  ILE  35          1HD1      ILE  35   1.468  -1.871  -6.468
  260   2HD1  ILE  35          2HD1      ILE  35   2.346  -2.545  -7.842
  261   3HD1  ILE  35          3HD1      ILE  35   1.348  -3.592  -6.831
  262    H    ASN  36           H        ASN  36   0.839  -0.745 -11.519
  263    HA   ASN  36           HA       ASN  36  -0.413  -2.575 -13.321
  264   1HB   ASN  36          2HB       ASN  36   1.079  -0.680 -14.019
  265   2HB   ASN  36          1HB       ASN  36   2.439  -1.579 -13.360
  266   1HD2  ASN  36          1HD2      ASN  36   0.001  -1.479 -15.830
  267   2HD2  ASN  36          2HD2      ASN  36   0.745  -2.626 -16.874
  268    H    ARG  37           H        ARG  37   0.166  -4.655 -13.783
  269    HA   ARG  37           HA       ARG  37   0.978  -6.291 -11.661
  270   1HB   ARG  37          2HB       ARG  37  -0.406  -6.978 -13.646
  271   2HB   ARG  37          1HB       ARG  37   1.068  -6.990 -14.602
  272   1HG   ARG  37          2HG       ARG  37   1.996  -8.731 -13.168
  273   2HG   ARG  37          1HG       ARG  37   0.522  -8.720 -12.196
  274   1HD   ARG  37          2HD       ARG  37   0.411 -10.553 -13.745
  275   2HD   ARG  37          1HD       ARG  37  -0.758  -9.326 -14.236
  276    HE   ARG  37           HE       ARG  37   1.892  -9.506 -15.508
  277   1HH1  ARG  37          1HH1      ARG  37  -1.610  -9.482 -15.735
  278   2HH1  ARG  37          2HH1      ARG  37  -1.616  -9.449 -17.471
  279   1HH2  ARG  37          1HH2      ARG  37   1.889  -9.427 -17.770
  280   2HH2  ARG  37          2HH2      ARG  37   0.380  -9.408 -18.637
  281    H    VAL  38           H        VAL  38   2.788  -4.886 -14.324
  282    HA   VAL  38           HA       VAL  38   5.187  -6.368 -13.861
  283    HB   VAL  38           HB       VAL  38   4.857  -3.714 -15.278
  284   1HG1  VAL  38          1HG1      VAL  38   6.959  -4.300 -16.400
  285   2HG1  VAL  38          2HG1      VAL  38   7.083  -5.748 -15.402
  286   3HG1  VAL  38          3HG1      VAL  38   7.174  -4.152 -14.656
  287   1HG2  VAL  38          1HG2      VAL  38   4.853  -6.522 -16.384
  288   2HG2  VAL  38          2HG2      VAL  38   4.809  -5.039 -17.340
  289   3HG2  VAL  38          3HG2      VAL  38   3.460  -5.448 -16.279
  290    H    THR  39           H        THR  39   4.037  -3.142 -12.914
  291    HA   THR  39           HA       THR  39   6.319  -2.282 -11.557
  292    HB   THR  39           HB       THR  39   3.451  -1.677 -10.813
  293    HG1  THR  39           1HG      THR  39   4.591   0.265 -12.254
  294   1HG2  THR  39          1HG2      THR  39   4.385   0.454  -9.998
  295   2HG2  THR  39          2HG2      THR  39   6.008  -0.130 -10.365
  296   3HG2  THR  39          3HG2      THR  39   5.041  -0.927  -9.123
  297    H    LEU  40           H        LEU  40   3.574  -4.214 -10.443
  298    HA   LEU  40           HA       LEU  40   4.358  -4.483  -7.753
  299   1HB   LEU  40          2HB       LEU  40   2.126  -5.075  -8.511
  300   2HB   LEU  40          1HB       LEU  40   2.777  -6.342  -9.531
  301    HG   LEU  40           HG       LEU  40   3.603  -7.476  -7.437
  302   1HD1  LEU  40          1HD1      LEU  40   1.843  -5.419  -6.115
  303   2HD1  LEU  40          2HD1      LEU  40   3.593  -5.569  -5.946
  304   3HD1  LEU  40          3HD1      LEU  40   2.535  -6.837  -5.327
  305   1HD2  LEU  40          1HD2      LEU  40   1.402  -8.380  -6.863
  306   2HD2  LEU  40          2HD2      LEU  40   1.609  -8.221  -8.608
  307   3HD2  LEU  40          3HD2      LEU  40   0.634  -7.047  -7.725
  308    H    LYS  41           H        LYS  41   4.936  -6.523 -10.587
  309    HA   LYS  41           HA       LYS  41   6.348  -8.592  -9.371
  310   1HB   LYS  41          2HB       LYS  41   5.470  -8.433 -11.761
  311   2HB   LYS  41          1HB       LYS  41   6.927  -7.527 -12.134
  312   1HG   LYS  41          2HG       LYS  41   8.269  -9.462 -11.369
  313   2HG   LYS  41          1HG       LYS  41   6.768 -10.369 -11.157
  314   1HD   LYS  41          2HD       LYS  41   6.264  -9.896 -13.569
  315   2HD   LYS  41          1HD       LYS  41   7.899  -9.246 -13.714
  316   1HE   LYS  41          2HE       LYS  41   8.785 -11.426 -12.943
  317   2HE   LYS  41          1HE       LYS  41   7.138 -12.056 -12.931
  318   1HZ   LYS  41          1HZ       LYS  41   7.909 -12.718 -14.981
  319   2HZ   LYS  41          2HZ       LYS  41   8.819 -11.312 -15.232
  320   3HZ   LYS  41          3HZ       LYS  41   7.128 -11.262 -15.378
  321    H    ASN  42           H        ASN  42   7.483  -5.553 -10.738
  322    HA   ASN  42           HA       ASN  42  10.226  -5.866 -10.458
  323   1HB   ASN  42          2HB       ASN  42   8.425  -3.466 -10.389
  324   2HB   ASN  42          1HB       ASN  42  10.148  -3.286 -10.090
  325   1HD2  ASN  42          1HD2      ASN  42  10.297  -2.005 -11.956
  326   2HD2  ASN  42          2HD2      ASN  42  10.304  -2.711 -13.541
  327    H    TRP  43           H        TRP  43   7.888  -4.640  -8.078
  328    HA   TRP  43           HA       TRP  43   9.776  -4.137  -6.033
  329   1HB   TRP  43          2HB       TRP  43   6.812  -4.712  -5.912
  330   2HB   TRP  43          1HB       TRP  43   7.769  -4.282  -4.500
  331    HD1  TRP  43           HD       TRP  43   9.328  -2.142  -6.832
  332    HE1  TRP  43           1HE      TRP  43   8.228   0.188  -6.947
  333    HE3  TRP  43           3HE      TRP  43   4.865  -3.231  -4.579
  334    HZ2  TRP  43           2HZ      TRP  43   5.796   1.385  -6.197
  335    HZ3  TRP  43           3HZ      TRP  43   3.201  -1.443  -4.331
  336    HH2  TRP  43           HH       TRP  43   3.655   0.823  -5.125
  337    H    ILE  44           H        ILE  44   7.743  -6.940  -6.766
  338    HA   ILE  44           HA       ILE  44   8.305  -8.520  -4.551
  339    HB   ILE  44           HB       ILE  44   7.836  -9.457  -7.386
  340   1HG1  ILE  44          2HG1      ILE  44   5.828  -9.115  -5.151
  341   2HG1  ILE  44          1HG1      ILE  44   6.098  -7.912  -6.405
  342   1HG2  ILE  44          1HG2      ILE  44   8.723 -11.232  -6.003
  343   2HG2  ILE  44          2HG2      ILE  44   7.012 -11.524  -6.329
  344   3HG2  ILE  44          3HG2      ILE  44   7.521 -10.895  -4.761
  345   1HD1  ILE  44          1HD1      ILE  44   4.156  -9.294  -6.884
  346   2HD1  ILE  44          2HD1      ILE  44   5.175 -10.733  -6.862
  347   3HD1  ILE  44          3HD1      ILE  44   5.412  -9.504  -8.105
  348    H    ILE  45           H        ILE  45  10.012  -8.385  -7.666
  349    HA   ILE  45           HA       ILE  45  11.925 -10.376  -6.955
  350    HB   ILE  45           HB       ILE  45  12.072  -8.276  -9.125
  351   1HG1  ILE  45          2HG1      ILE  45  11.106 -11.140  -9.260
  352   2HG1  ILE  45          1HG1      ILE  45  10.071  -9.721  -9.304
  353   1HG2  ILE  45          1HG2      ILE  45  13.593 -10.854  -8.794
  354   2HG2  ILE  45          2HG2      ILE  45  14.249  -9.224  -8.645
  355   3HG2  ILE  45          3HG2      ILE  45  13.663  -9.801 -10.206
  356   1HD1  ILE  45          1HD1      ILE  45  12.147 -10.447 -11.348
  357   2HD1  ILE  45          2HD1      ILE  45  11.104  -9.025 -11.396
  358   3HD1  ILE  45          3HD1      ILE  45  10.403 -10.641 -11.521
  359    H    LYS  46           H        LYS  46  11.772  -6.903  -6.632
  360    HA   LYS  46           HA       LYS  46  14.599  -6.553  -6.270
  361   1HB   LYS  46          2HB       LYS  46  13.037  -4.837  -7.244
  362   2HB   LYS  46          1HB       LYS  46  12.383  -4.607  -5.631
  363   1HG   LYS  46          2HG       LYS  46  14.589  -3.897  -4.841
  364   2HG   LYS  46          1HG       LYS  46  15.229  -4.106  -6.473
  365   1HD   LYS  46          2HD       LYS  46  13.486  -2.468  -7.251
  366   2HD   LYS  46          1HD       LYS  46  13.125  -2.156  -5.553
  367   1HE   LYS  46          2HE       LYS  46  14.634  -0.468  -6.366
  368   2HE   LYS  46          1HE       LYS  46  15.479  -1.498  -5.213
  369   1HZ   LYS  46          1HZ       LYS  46  15.641  -1.974  -8.131
  370   2HZ   LYS  46          2HZ       LYS  46  16.678  -2.537  -6.909
  371   3HZ   LYS  46          3HZ       LYS  46  16.689  -0.899  -7.342
  372    H    TYR  47           H        TYR  47  11.754  -6.349  -4.123
  373    HA   TYR  47           HA       TYR  47  13.531  -5.987  -1.841
  374   1HB   TYR  47          2HB       TYR  47  10.512  -5.911  -1.982
  375   2HB   TYR  47          1HB       TYR  47  11.493  -5.456  -0.594
  376    HD1  TYR  47           1HD      TYR  47  10.052  -4.367  -3.695
  377    HD2  TYR  47           2HD      TYR  47  13.051  -3.462  -0.815
  378    HE1  TYR  47           1HE      TYR  47  10.198  -2.074  -4.572
  379    HE2  TYR  47           2HE      TYR  47  13.196  -1.168  -1.681
  380    HH   TYR  47           HH       TYR  47  12.735   0.049  -3.728
  381    H    GLY  48           H        GLY  48  11.622  -8.434  -3.330
  382   1HA   GLY  48          2HA       GLY  48  11.788 -10.107  -0.911
  383   2HA   GLY  48          1HA       GLY  48  10.695 -10.378  -2.261
  384    H    SER  49           H        SER  49  14.180  -9.766  -2.132
  385    HA   SER  49           HA       SER  49  14.793 -11.496  -4.248
  386   1HB   SER  49          2HB       SER  49  17.177 -11.229  -3.315
  387   2HB   SER  49          1HB       SER  49  16.330  -9.764  -3.811
  388    HG   SER  49           HG       SER  49  16.984 -10.667  -1.239
  389    H    ASN  50           H        ASN  50  14.723 -12.005  -0.766
  390    HA   ASN  50           HA       ASN  50  15.783 -14.708  -1.105
  391   1HB   ASN  50          2HB       ASN  50  15.037 -13.249   1.422
  392   2HB   ASN  50          1HB       ASN  50  15.838 -14.807   1.334
  393   1HD2  ASN  50          1HD2      ASN  50  17.981 -14.922   0.895
  394   2HD2  ASN  50          2HD2      ASN  50  19.018 -13.539   0.800
  395    H    HIS  51           H        HIS  51  14.463 -16.222  -1.539
  396    HA   HIS  51           HA       HIS  51  12.098 -16.705   0.019
  397   1HB   HIS  51          2HB       HIS  51  11.899 -15.886  -2.857
  398   2HB   HIS  51          1HB       HIS  51  10.783 -17.096  -2.233
  399    HD1  HIS  51           1HD      HIS  51  11.249 -13.496  -2.501
  400    HD2  HIS  51           2HD      HIS  51   9.237 -16.075   0.077
  401    HE1  HIS  51           1HE      HIS  51   9.573 -12.073  -1.281
  402    HE2  HIS  51           2HE      HIS  51   8.441 -13.624   0.353
  403    H    ASN  52           H        ASN  52  14.163 -17.577  -2.683
  404    HA   ASN  52           HA       ASN  52  14.421 -20.256  -1.641
  405   1HB   ASN  52          2HB       ASN  52  12.455 -20.515  -3.112
  406   2HB   ASN  52          1HB       ASN  52  13.367 -19.833  -4.454
  407   1HD2  ASN  52          1HD2      ASN  52  13.164 -21.667  -5.709
  408   2HD2  ASN  52          2HD2      ASN  52  14.005 -23.134  -5.360
  409    H    VAL  53           H        VAL  53  16.524 -19.290  -1.324
  410    HA   VAL  53           HA       VAL  53  18.037 -18.551  -3.660
  411    HB   VAL  53           HB       VAL  53  19.950 -18.283  -2.031
  412   1HG1  VAL  53          1HG1      VAL  53  17.412 -16.748  -1.472
  413   2HG1  VAL  53          2HG1      VAL  53  18.565 -16.406  -2.762
  414   3HG1  VAL  53          3HG1      VAL  53  19.047 -16.219  -1.075
  415   1HG2  VAL  53          1HG2      VAL  53  19.390 -18.189   0.359
  416   2HG2  VAL  53          2HG2      VAL  53  19.185 -19.817  -0.290
  417   3HG2  VAL  53          3HG2      VAL  53  17.774 -18.800  -0.000
  418    H    GLN  54           H        GLN  54  18.334 -21.133  -1.208
  419    HA   GLN  54           HA       GLN  54  19.901 -22.648  -3.174
  420   1HB   GLN  54          2HB       GLN  54  20.396 -22.513  -0.193
  421   2HB   GLN  54          1HB       GLN  54  21.275 -23.530  -1.325
  422   1HG   GLN  54          2HG       GLN  54  21.247 -20.520  -1.269
  423   2HG   GLN  54          1HG       GLN  54  22.573 -21.575  -0.782
  424   1HE2  GLN  54          1HE2      GLN  54  22.383 -19.478  -2.843
  425   2HE2  GLN  54          2HE2      GLN  54  22.861 -20.235  -4.316
  426    H    GLY  55           H        GLY  55  18.969 -24.460  -3.712
  427   1HA   GLY  55          2HA       GLY  55  17.653 -26.063  -1.609
  428   2HA   GLY  55          1HA       GLY  55  16.902 -25.862  -3.190
  429    H    THR  56           H        THR  56  20.292 -26.037  -2.757
  430    HA   THR  56           HA       THR  56  21.890 -27.203  -3.805
  431    HB   THR  56           HB       THR  56  21.869 -29.663  -3.426
  432    HG1  THR  56           1HG      THR  56  19.237 -29.203  -3.001
  433   1HG2  THR  56          1HG2      THR  56  21.221 -27.955  -1.028
  434   2HG2  THR  56          2HG2      THR  56  22.809 -28.140  -1.770
  435   3HG2  THR  56          3HG2      THR  56  22.036 -29.517  -0.986
  436    H    THR  57           H        THR  57  21.730 -26.653  -5.888
  437    HA   THR  57           HA       THR  57  19.843 -27.915  -7.661
  438    HB   THR  57           HB       THR  57  22.132 -26.077  -8.388
  439    HG1  THR  57           1HG      THR  57  20.711 -24.376  -8.043
  440   1HG2  THR  57          1HG2      THR  57  21.117 -27.236 -10.286
  441   2HG2  THR  57          2HG2      THR  57  20.702 -25.523 -10.315
  442   3HG2  THR  57          3HG2      THR  57  19.516 -26.706  -9.768
  443    HA   PRO  58           HA       PRO  58  22.549 -31.410  -8.433
  444   1HB   PRO  58          2HB       PRO  58  20.703 -31.763 -10.721
  445   2HB   PRO  58          1HB       PRO  58  21.162 -32.913  -9.461
  446   1HG   PRO  58          2HG       PRO  58  18.758 -31.762  -9.455
  447   2HG   PRO  58          1HG       PRO  58  19.636 -32.058  -7.943
  448   1HD   PRO  58          2HD       PRO  58  19.272 -29.502  -9.456
  449   2HD   PRO  58          1HD       PRO  58  19.283 -29.784  -7.702
  450    H    SER  59           H        SER  59  21.449 -29.221 -10.954
  451    HA   SER  59           HA       SER  59  23.476 -29.874 -12.834
  452   1HB   SER  59          2HB       SER  59  21.307 -28.792 -13.421
  453   2HB   SER  59          1HB       SER  59  21.862 -27.321 -12.630
  454    HG   SER  59           HG       SER  59  23.374 -28.536 -14.690
  455    H    ALA  60           H        ALA  60  23.357 -27.765 -10.079
  456    HA   ALA  60           HA       ALA  60  25.592 -26.144 -10.905
  457   1HB   ALA  60          1HB       ALA  60  23.807 -25.208  -9.508
  458   2HB   ALA  60          2HB       ALA  60  25.382 -25.080  -8.724
  459   3HB   ALA  60          3HB       ALA  60  24.239 -26.324  -8.215
  460    H    ALA  61           H        ALA  61  25.093 -29.090  -9.212
  461    HA   ALA  61           HA       ALA  61  27.496 -29.010  -7.670
  462   1HB   ALA  61          1HB       ALA  61  25.555 -30.322  -6.952
  463   2HB   ALA  61          2HB       ALA  61  26.998 -31.324  -7.111
  464   3HB   ALA  61          3HB       ALA  61  25.753 -31.368  -8.359
  465    H    VAL  62           H        VAL  62  26.951 -29.433 -10.898
  466    HA   VAL  62           HA       VAL  62  28.919 -31.396 -11.526
  467    HB   VAL  62           HB       VAL  62  27.821 -29.188 -13.280
  468   1HG1  VAL  62          1HG1      VAL  62  28.548 -30.564 -15.156
  469   2HG1  VAL  62          2HG1      VAL  62  29.220 -31.751 -14.039
  470   3HG1  VAL  62          3HG1      VAL  62  29.919 -30.135 -14.131
  471   1HG2  VAL  62          1HG2      VAL  62  26.932 -32.052 -12.967
  472   2HG2  VAL  62          2HG2      VAL  62  26.306 -30.905 -14.152
  473   3HG2  VAL  62          3HG2      VAL  62  26.049 -30.622 -12.429
  474    H    SER  63           H        SER  63  28.903 -27.960 -11.035
  475    HA   SER  63           HA       SER  63  31.444 -27.317 -12.038
  476   1HB   SER  63          2HB       SER  63  30.072 -26.004  -9.688
  477   2HB   SER  63          1HB       SER  63  31.233 -25.277 -10.793
  478    HG   SER  63           HG       SER  63  28.523 -25.691 -11.094
  479    H    GLU  64           H        GLU  64  30.361 -28.607  -8.971
  480    HA   GLU  64           HA       GLU  64  32.912 -28.346  -7.693
  481   1HB   GLU  64          2HB       GLU  64  30.349 -28.693  -6.795
  482   2HB   GLU  64          1HB       GLU  64  31.016 -30.306  -6.594
  483   1HG   GLU  64          2HG       GLU  64  31.291 -29.103  -4.553
  484   2HG   GLU  64          1HG       GLU  64  32.876 -29.328  -5.290
  485    H    ALA  65           H        ALA  65  31.136 -30.825  -9.375
  486    HA   ALA  65           HA       ALA  65  32.725 -33.041  -8.715
  487   1HB   ALA  65          1HB       ALA  65  30.495 -33.257  -9.677
  488   2HB   ALA  65          2HB       ALA  65  31.688 -34.147 -10.625
  489   3HB   ALA  65          3HB       ALA  65  31.083 -32.593 -11.202
  490    H    GLU  66           H        GLU  66  32.979 -30.635 -11.265
  491    HA   GLU  66           HA       GLU  66  35.014 -31.767 -12.805
  492   1HB   GLU  66          2HB       GLU  66  33.851 -29.811 -13.568
  493   2HB   GLU  66          1HB       GLU  66  34.368 -28.889 -12.166
  494   1HG   GLU  66          2HG       GLU  66  36.702 -29.070 -12.959
  495   2HG   GLU  66          1HG       GLU  66  36.108 -29.881 -14.408
  496    H    GLN  67           H        GLN  67  35.232 -29.544 -10.055
  497    HA   GLN  67           HA       GLN  67  38.057 -29.540  -9.888
  498   1HB   GLN  67          2HB       GLN  67  35.815 -28.680  -8.108
  499   2HB   GLN  67          1HB       GLN  67  37.433 -28.787  -7.433
  500   1HG   GLN  67          2HG       GLN  67  36.555 -26.538  -8.417
  501   2HG   GLN  67          1HG       GLN  67  38.225 -27.034  -8.675
  502   1HE2  GLN  67          1HE2      GLN  67  35.075 -26.682 -10.157
  503   2HE2  GLN  67          2HE2      GLN  67  35.632 -26.745 -11.800
  504    H    ILE  68           H        ILE  68  35.538 -31.487  -8.375
  505    HA   ILE  68           HA       ILE  68  37.095 -32.894  -6.537
  506    HB   ILE  68           HB       ILE  68  34.624 -33.710  -8.059
  507   1HG1  ILE  68          2HG1      ILE  68  34.326 -31.917  -6.436
  508   2HG1  ILE  68          1HG1      ILE  68  33.535 -33.386  -5.871
  509   1HG2  ILE  68          1HG2      ILE  68  34.393 -35.591  -6.498
  510   2HG2  ILE  68          2HG2      ILE  68  35.985 -35.228  -5.832
  511   3HG2  ILE  68          3HG2      ILE  68  35.828 -35.751  -7.509
  512   1HD1  ILE  68          1HD1      ILE  68  35.449 -33.810  -4.387
  513   2HD1  ILE  68          2HD1      ILE  68  34.654 -32.275  -4.047
  514   3HD1  ILE  68          3HD1      ILE  68  36.185 -32.299  -4.925
  515    H    ARG  69           H        ARG  69  36.346 -33.729  -9.929
  516    HA   ARG  69           HA       ARG  69  37.855 -36.083 -10.062
  517   1HB   ARG  69          2HB       ARG  69  37.342 -34.052 -12.243
  518   2HB   ARG  69          1HB       ARG  69  38.017 -35.649 -12.512
  519   1HG   ARG  69          2HG       ARG  69  35.899 -36.605 -11.572
  520   2HG   ARG  69          1HG       ARG  69  35.242 -34.965 -11.577
  521   1HD   ARG  69          2HD       ARG  69  35.759 -34.833 -14.006
  522   2HD   ARG  69          1HD       ARG  69  36.239 -36.527 -13.958
  523    HE   ARG  69           HE       ARG  69  33.508 -35.607 -13.325
  524   1HH1  ARG  69          1HH1      ARG  69  35.707 -37.863 -14.846
  525   2HH1  ARG  69          2HH1      ARG  69  34.444 -38.833 -15.533
  526   1HH2  ARG  69          1HH2      ARG  69  31.835 -36.869 -14.258
  527   2HH2  ARG  69          2HH2      ARG  69  32.250 -38.271 -15.207
  528    H    GLN  70           H        GLN  70  38.766 -32.742 -10.697
  529    HA   GLN  70           HA       GLN  70  41.366 -33.232 -11.629
  530   1HB   GLN  70          2HB       GLN  70  39.708 -31.084 -11.476
  531   2HB   GLN  70          1HB       GLN  70  40.857 -30.698 -10.210
  532   1HG   GLN  70          2HG       GLN  70  41.496 -31.226 -13.105
  533   2HG   GLN  70          1HG       GLN  70  41.503 -29.670 -12.286
  534   1HE2  GLN  70          1HE2      GLN  70  43.191 -32.651 -12.778
  535   2HE2  GLN  70          2HE2      GLN  70  44.662 -32.194 -11.988
  536    H    LEU  71           H        LEU  71  40.112 -32.487  -8.394
  537    HA   LEU  71           HA       LEU  71  42.673 -32.233  -7.185
  538   1HB   LEU  71          2HB       LEU  71  40.458 -31.289  -6.380
  539   2HB   LEU  71          1HB       LEU  71  40.067 -32.898  -5.816
  540    HG   LEU  71           HG       LEU  71  40.912 -31.255  -4.083
  541   1HD1  LEU  71          1HD1      LEU  71  42.277 -32.908  -2.914
  542   2HD1  LEU  71          2HD1      LEU  71  42.419 -33.841  -4.404
  543   3HD1  LEU  71          3HD1      LEU  71  40.843 -33.639  -3.638
  544   1HD2  LEU  71          1HD2      LEU  71  43.539 -31.789  -5.453
  545   2HD2  LEU  71          2HD2      LEU  71  43.322 -30.940  -3.921
  546   3HD2  LEU  71          3HD2      LEU  71  42.685 -30.247  -5.413
  547    H    LYS  72           H        LYS  72  40.316 -34.881  -7.381
  548    HA   LYS  72           HA       LYS  72  41.825 -36.555  -5.617
  549   1HB   LYS  72          2HB       LYS  72  39.357 -36.662  -5.805
  550   2HB   LYS  72          1HB       LYS  72  39.529 -37.290  -7.438
  551   1HG   LYS  72          2HG       LYS  72  40.664 -39.262  -6.577
  552   2HG   LYS  72          1HG       LYS  72  40.541 -38.630  -4.934
  553   1HD   LYS  72          2HD       LYS  72  38.100 -38.690  -5.096
  554   2HD   LYS  72          1HD       LYS  72  38.221 -39.311  -6.743
  555   1HE   LYS  72          2HE       LYS  72  39.375 -41.306  -5.896
  556   2HE   LYS  72          1HE       LYS  72  39.240 -40.681  -4.252
  557   1HZ   LYS  72          1HZ       LYS  72  37.517 -42.323  -4.796
  558   2HZ   LYS  72          2HZ       LYS  72  36.930 -41.304  -6.017
  559   3HZ   LYS  72          3HZ       LYS  72  36.858 -40.813  -4.398
  560    H    LYS  73           H        LYS  73  41.375 -36.431  -9.132
  561    HA   LYS  73           HA       LYS  73  43.178 -38.735  -9.365
  562   1HB   LYS  73          2HB       LYS  73  41.322 -37.518 -11.414
  563   2HB   LYS  73          1HB       LYS  73  42.357 -38.910 -11.694
  564   1HG   LYS  73          2HG       LYS  73  41.134 -40.008  -9.751
  565   2HG   LYS  73          1HG       LYS  73  39.965 -38.696  -9.896
  566   1HD   LYS  73          2HD       LYS  73  39.165 -40.594 -11.142
  567   2HD   LYS  73          1HD       LYS  73  39.633 -39.327 -12.280
  568   1HE   LYS  73          2HE       LYS  73  41.725 -40.446 -12.731
  569   2HE   LYS  73          1HE       LYS  73  41.383 -41.652 -11.491
  570   1HZ   LYS  73          1HZ       LYS  73  39.462 -42.373 -12.801
  571   2HZ   LYS  73          2HZ       LYS  73  40.917 -42.539 -13.660
  572   3HZ   LYS  73          3HZ       LYS  73  39.866 -41.258 -14.019
  573    H    GLU  74           H        GLU  74  43.985 -35.897  -8.863
  574    HA   GLU  74           HA       GLU  74  45.251 -34.862 -11.156
  575   1HB   GLU  74          2HB       GLU  74  44.933 -33.493  -9.174
  576   2HB   GLU  74          1HB       GLU  74  45.957 -34.563  -8.227
  577   1HG   GLU  74          2HG       GLU  74  47.243 -32.649  -8.738
  578   2HG   GLU  74          1HG       GLU  74  47.850 -33.956  -9.748
  579    H    ASN  75           H        ASN  75  46.643 -36.710  -8.448
  580    HA   ASN  75           HA       ASN  75  48.476 -38.061 -10.238
  581   1HB   ASN  75          2HB       ASN  75  49.493 -35.790  -9.562
  582   2HB   ASN  75          1HB       ASN  75  49.645 -36.474  -7.950
  583   1HD2  ASN  75          1HD2      ASN  75  50.778 -36.603 -11.247
  584   2HD2  ASN  75          2HD2      ASN  75  52.187 -37.572 -10.931
  585    H    ALA  76           H        ALA  76  50.172 -39.194  -8.435
  586    HA   ALA  76           HA       ALA  76  48.417 -41.056  -7.150
  587   1HB   ALA  76          1HB       ALA  76  50.394 -42.386  -6.768
  588   2HB   ALA  76          2HB       ALA  76  51.423 -41.033  -7.237
  589   3HB   ALA  76          3HB       ALA  76  50.377 -41.797  -8.432
  590    H    LEU  77           H        LEU  77  49.844 -38.207  -6.179
  591    HA   LEU  77           HA       LEU  77  51.134 -38.551  -3.828
  592   1HB   LEU  77          2HB       LEU  77  49.121 -36.398  -4.460
  593   2HB   LEU  77          1HB       LEU  77  50.355 -36.309  -3.222
  594    HG   LEU  77           HG       LEU  77  50.896 -36.525  -6.184
  595   1HD1  LEU  77          1HD1      LEU  77  51.635 -34.189  -5.982
  596   2HD1  LEU  77          2HD1      LEU  77  51.076 -34.169  -4.310
  597   3HD1  LEU  77          3HD1      LEU  77  49.917 -34.376  -5.624
  598   1HD2  LEU  77          1HD2      LEU  77  52.666 -37.522  -4.820
  599   2HD2  LEU  77          2HD2      LEU  77  52.760 -36.052  -3.853
  600   3HD2  LEU  77          3HD2      LEU  77  53.212 -36.016  -5.556
  601    H    GLN  78           H        GLN  78  47.583 -38.094  -4.067
  602    HA   GLN  78           HA       GLN  78  47.240 -38.566  -1.253
  603   1HB   GLN  78          2HB       GLN  78  45.710 -37.091  -2.451
  604   2HB   GLN  78          1HB       GLN  78  45.224 -38.410  -3.505
  605   1HG   GLN  78          2HG       GLN  78  43.529 -37.991  -1.845
  606   2HG   GLN  78          1HG       GLN  78  44.249 -39.578  -1.596
  607   1HE2  GLN  78          1HE2      GLN  78  45.524 -39.940   0.210
  608   2HE2  GLN  78          2HE2      GLN  78  45.516 -38.870   1.572
  609    H    ARG  79           H        ARG  79  46.899 -40.475  -4.177
  610    HA   ARG  79           HA       ARG  79  45.484 -42.645  -3.049
  611   1HB   ARG  79          2HB       ARG  79  45.990 -41.912  -5.565
  612   2HB   ARG  79          1HB       ARG  79  47.294 -43.072  -5.379
  613   1HG   ARG  79          2HG       ARG  79  44.401 -43.719  -4.862
  614   2HG   ARG  79          1HG       ARG  79  45.205 -43.972  -6.410
  615   1HD   ARG  79          2HD       ARG  79  46.742 -45.530  -5.414
  616   2HD   ARG  79          1HD       ARG  79  46.111 -45.185  -3.803
  617    HE   ARG  79           HE       ARG  79  44.384 -46.360  -5.882
  618   1HH1  ARG  79          1HH1      ARG  79  45.930 -46.543  -2.739
  619   2HH1  ARG  79          2HH1      ARG  79  44.965 -47.886  -2.205
  620   1HH2  ARG  79          1HH2      ARG  79  43.143 -48.132  -5.185
  621   2HH2  ARG  79          2HH2      ARG  79  43.406 -48.809  -3.606
  622    H    ALA  80           H        ALA  80  48.794 -41.739  -3.093
  623    HA   ALA  80           HA       ALA  80  50.025 -44.229  -2.693
  624   1HB   ALA  80          1HB       ALA  80  51.947 -42.970  -1.891
  625   2HB   ALA  80          2HB       ALA  80  50.948 -41.525  -1.741
  626   3HB   ALA  80          3HB       ALA  80  51.262 -42.221  -3.332
  627    H    ARG  81           H        ARG  81  48.493 -42.011  -0.482
  628    HA   ARG  81           HA       ARG  81  49.369 -43.441   1.864
  629   1HB   ARG  81          2HB       ARG  81  47.501 -41.133   1.420
  630   2HB   ARG  81          1HB       ARG  81  47.613 -41.925   2.984
  631   1HG   ARG  81          2HG       ARG  81  50.038 -41.438   3.006
  632   2HG   ARG  81          1HG       ARG  81  49.829 -40.539   1.500
  633   1HD   ARG  81          2HD       ARG  81  48.408 -38.951   2.551
  634   2HD   ARG  81          1HD       ARG  81  48.291 -39.928   4.014
  635    HE   ARG  81           HE       ARG  81  50.977 -39.108   3.356
  636   1HH1  ARG  81          1HH1      ARG  81  48.013 -38.221   4.993
  637   2HH1  ARG  81          2HH1      ARG  81  48.801 -37.145   6.112
  638   1HH2  ARG  81          1HH2      ARG  81  52.013 -37.675   4.806
  639   2HH2  ARG  81          2HH2      ARG  81  51.071 -36.836   5.999
  640    H    THR  82           H        THR  82  46.738 -43.536  -0.317
  641    HA   THR  82           HA       THR  82  44.896 -44.935   1.355
  642    HB   THR  82           HB       THR  82  44.926 -45.074  -1.656
  643    HG1  THR  82           1HG      THR  82  44.081 -42.897   0.001
  644   1HG2  THR  82          1HG2      THR  82  43.219 -46.390  -0.491
  645   2HG2  THR  82          2HG2      THR  82  42.485 -45.055  -1.376
  646   3HG2  THR  82          3HG2      THR  82  42.683 -44.946   0.372
  647    H    ARG  83           H        ARG  83  47.729 -45.773  -0.302
  648    HA   ARG  83           HA       ARG  83  47.085 -48.620  -0.457
  649   1HB   ARG  83          2HB       ARG  83  48.349 -47.465  -2.303
  650   2HB   ARG  83          1HB       ARG  83  49.668 -47.210  -1.170
  651   1HG   ARG  83          2HG       ARG  83  49.829 -49.673  -0.888
  652   2HG   ARG  83          1HG       ARG  83  48.613 -49.849  -2.155
  653   1HD   ARG  83          2HD       ARG  83  50.116 -48.550  -3.669
  654   2HD   ARG  83          1HD       ARG  83  51.348 -48.611  -2.408
  655    HE   ARG  83           HE       ARG  83  50.249 -51.154  -3.311
  656   1HH1  ARG  83          1HH1      ARG  83  52.906 -48.862  -3.369
  657   2HH1  ARG  83          2HH1      ARG  83  54.011 -49.988  -4.100
  658   1HH2  ARG  83          1HH2      ARG  83  51.718 -52.635  -4.221
  659   2HH2  ARG  83          2HH2      ARG  83  53.347 -52.121  -4.586
  660    H    HIS  84           H        HIS  84  48.156 -50.176   0.796
  661    HA   HIS  84           HA       HIS  84  49.772 -49.111   3.017
  662   1HB   HIS  84          2HB       HIS  84  47.378 -49.661   3.665
  663   2HB   HIS  84          1HB       HIS  84  47.751 -51.344   3.305
  664    HD1  HIS  84           1HD      HIS  84  48.244 -48.675   5.819
  665    HD2  HIS  84           2HD      HIS  84  49.495 -52.588   5.169
  666    HE1  HIS  84           1HE      HIS  84  49.231 -49.443   8.000
  667    HE2  HIS  84           2HE      HIS  84  50.017 -51.804   7.585
  668    HA   PRO  85           HA       PRO  85  52.208 -52.525   1.215
  669   1HB   PRO  85          2HB       PRO  85  54.610 -51.368   1.495
  670   2HB   PRO  85          1HB       PRO  85  53.513 -50.909   0.187
  671   1HG   PRO  85          2HG       PRO  85  54.069 -49.514   2.775
  672   2HG   PRO  85          1HG       PRO  85  53.851 -48.826   1.156
  673   1HD   PRO  85          2HD       PRO  85  51.894 -48.911   3.094
  674   2HD   PRO  85          1HD       PRO  85  51.581 -48.794   1.353
  675    H    ALA  86           H        ALA  86  54.318 -53.548   2.186
  676    HA   ALA  86           HA       ALA  86  54.718 -53.282   5.009
  677   1HB   ALA  86          1HB       ALA  86  53.306 -55.792   4.093
  678   2HB   ALA  86          2HB       ALA  86  52.559 -54.482   5.009
  679   3HB   ALA  86          3HB       ALA  86  53.861 -55.430   5.729
  680    H    GLU  87           H        GLU  87  56.810 -53.676   5.255
  681    HA   GLU  87           HA       GLU  87  58.271 -55.343   3.407
  682   1HB   GLU  87          2HB       GLU  87  60.232 -54.817   4.813
  683   2HB   GLU  87          1HB       GLU  87  59.369 -53.367   4.325
  684   1HG   GLU  87          2HG       GLU  87  58.911 -54.657   6.991
  685   2HG   GLU  87          1HG       GLU  87  60.222 -53.511   6.725
  686    H    SER  88           H        SER  88  56.603 -55.723   6.365
  687    HA   SER  88           HA       SER  88  58.068 -57.868   7.484
  688   1HB   SER  88          2HB       SER  88  55.854 -58.184   8.777
  689   2HB   SER  88          1HB       SER  88  56.720 -56.658   8.975
  690    HG   SER  88           HG       SER  88  55.059 -55.662   8.175
  691    H    CYS  89           H        CYS  89  55.402 -57.738   5.181
  692    HA   CYS  89           HA       CYS  89  54.904 -60.557   5.333
  693   1HB   CYS  89          2HB       CYS  89  53.451 -60.184   3.355
  694   2HB   CYS  89          1HB       CYS  89  53.073 -59.127   4.710
  695    HG   CYS  89           HG       CYS  89  54.168 -58.349   1.627
  696    H    LEU  90           H        LEU  90  56.984 -58.502   3.518
  697    HA   LEU  90           HA       LEU  90  57.649 -60.330   1.451
  698   1HB   LEU  90          2HB       LEU  90  58.147 -57.912   1.345
  699   2HB   LEU  90          1HB       LEU  90  59.307 -58.101   2.646
  700    HG   LEU  90           HG       LEU  90  60.657 -59.587   1.189
  701   1HD1  LEU  90          1HD1      LEU  90  58.657 -58.798  -0.926
  702   2HD1  LEU  90          2HD1      LEU  90  58.893 -60.413  -0.260
  703   3HD1  LEU  90          3HD1      LEU  90  60.170 -59.659  -1.214
  704   1HD2  LEU  90          1HD2      LEU  90  61.504 -57.817  -0.275
  705   2HD2  LEU  90          2HD2      LEU  90  61.179 -57.214   1.350
  706   3HD2  LEU  90          3HD2      LEU  90  60.053 -56.862   0.039
  707    H    GLU  91           H        GLU  91  58.961 -59.636   4.640
  708    HA   GLU  91           HA       GLU  91  61.038 -61.576   4.586
  709   1HB   GLU  91          2HB       GLU  91  60.657 -59.552   6.179
  710   2HB   GLU  91          1HB       GLU  91  59.619 -60.645   7.078
  711   1HG   GLU  91          2HG       GLU  91  62.495 -61.260   6.466
  712   2HG   GLU  91          1HG       GLU  91  61.981 -60.399   7.914
  713    H    HIS  92           H        HIS  92  57.814 -61.537   6.058
  714    HA   HIS  92           HA       HIS  92  56.389 -63.129   6.775
  715   1HB   HIS  92          2HB       HIS  92  55.739 -64.799   5.173
  716   2HB   HIS  92          1HB       HIS  92  56.120 -63.310   4.327
  717    HD1  HIS  92           1HD      HIS  92  58.097 -63.368   2.673
  718    HD2  HIS  92           2HD      HIS  92  57.448 -66.971   4.640
  719    HE1  HIS  92           1HE      HIS  92  59.438 -65.079   1.414
  720    HE2  HIS  92           2HE      HIS  92  58.793 -67.278   2.460
  721    H    HIS  93           H        HIS  93  59.195 -63.418   7.686
  722    HA   HIS  93           HA       HIS  93  60.276 -64.654   9.199
  723   1HB   HIS  93          2HB       HIS  93  57.670 -66.157   9.326
  724   2HB   HIS  93          1HB       HIS  93  59.029 -66.459  10.407
  725    HD1  HIS  93           1HD      HIS  93  59.353 -63.035  10.092
  726    HD2  HIS  93           2HD      HIS  93  56.461 -65.417  11.916
  727    HE1  HIS  93           1HE      HIS  93  58.194 -61.545  11.761
  728    HE2  HIS  93           2HE      HIS  93  56.317 -62.951  12.699
  729    H    HIS  94           H        HIS  94  61.870 -65.349   7.911
  730    HA   HIS  94           HA       HIS  94  61.718 -67.861   6.512
  731   1HB   HIS  94          2HB       HIS  94  64.056 -66.089   7.258
  732   2HB   HIS  94          1HB       HIS  94  64.226 -67.581   6.340
  733    HD1  HIS  94           1HD      HIS  94  62.637 -64.156   6.092
  734    HD2  HIS  94           2HD      HIS  94  63.744 -67.342   3.652
  735    HE1  HIS  94           1HE      HIS  94  62.378 -63.331   3.731
  736    HE2  HIS  94           2HE      HIS  94  62.820 -65.345   2.282
  737    H    HIS  95           H        HIS  95  62.438 -66.797   9.700
  738    HA   HIS  95           HA       HIS  95  63.540 -69.321  10.579
  739   1HB   HIS  95          2HB       HIS  95  64.228 -67.241  11.695
  740   2HB   HIS  95          1HB       HIS  95  62.556 -66.906  12.131
  741    HD1  HIS  95           1HD      HIS  95  61.678 -67.930  14.263
  742    HD2  HIS  95           2HD      HIS  95  65.388 -69.465  13.151
  743    HE1  HIS  95           1HE      HIS  95  62.460 -69.310  16.217
  744    HE2  HIS  95           2HE      HIS  95  64.698 -70.239  15.529
  745    H    HIS  96           H        HIS  96  62.428 -70.781  11.991
  746    HA   HIS  96           HA       HIS  96  60.679 -72.003  12.756
  747   1HB   HIS  96          2HB       HIS  96  59.590 -70.217  13.825
  748   2HB   HIS  96          1HB       HIS  96  59.210 -69.412  12.310
  749    HD1  HIS  96           1HD      HIS  96  58.274 -72.783  13.881
  750    HD2  HIS  96           2HD      HIS  96  56.599 -69.611  11.768
  751    HE1  HIS  96           1HE      HIS  96  55.835 -73.348  13.616
  752    HE2  HIS  96           2HE      HIS  96  54.861 -71.465  12.247
  753    H    HIS  97           H        HIS  97  60.750 -73.559  11.328
  754    HA   HIS  97           HA       HIS  97  59.054 -73.329   8.940
  755   1HB   HIS  97          2HB       HIS  97  61.422 -73.149   8.288
  756   2HB   HIS  97          1HB       HIS  97  61.763 -74.669   9.105
  757    HD1  HIS  97           1HD      HIS  97  60.880 -76.864   7.948
  758    HD2  HIS  97           2HD      HIS  97  60.320 -73.368   5.758
  759    HE1  HIS  97           1HE      HIS  97  60.355 -77.605   5.605
  760    HE2  HIS  97           2HE      HIS  97  60.300 -75.478   4.258
  Start of MODEL    5
    1   1H    MET   1          1HT       MET   1 -10.009  10.044  -1.632
    2   2H    MET   1          2HT       MET   1  -9.479  11.168  -0.478
    3   3H    MET   1          3HT       MET   1  -8.911   9.567  -0.432
    4    HA   MET   1           HA       MET   1  -8.432  11.449  -2.666
    5   1HB   MET   1          2HB       MET   1  -6.141  11.657  -1.814
    6   2HB   MET   1          1HB       MET   1  -7.305  12.240  -0.632
    7   1HG   MET   1          2HG       MET   1  -7.104  10.130   0.598
    8   2HG   MET   1          1HG       MET   1  -5.930   9.558  -0.585
    9   1HE   MET   1          1HE       MET   1  -5.203  13.127   2.242
   10   2HE   MET   1          2HE       MET   1  -6.674  12.151   2.267
   11   3HE   MET   1          3HE       MET   1  -6.320  13.183   0.882
   12    HA   PRO   2           HA       PRO   2  -7.347   7.716  -4.782
   13   1HB   PRO   2          2HB       PRO   2  -5.630   9.325  -6.518
   14   2HB   PRO   2          1HB       PRO   2  -7.114   8.454  -6.911
   15   1HG   PRO   2          2HG       PRO   2  -6.989  11.141  -6.840
   16   2HG   PRO   2          1HG       PRO   2  -8.456  10.250  -6.412
   17   1HD   PRO   2          2HD       PRO   2  -6.412  11.515  -4.622
   18   2HD   PRO   2          1HD       PRO   2  -8.181  11.480  -4.465
   19    H    THR   3           H        THR   3  -5.889   6.268  -4.270
   20    HA   THR   3           HA       THR   3  -3.530   6.990  -2.840
   21    HB   THR   3           HB       THR   3  -3.163   4.385  -3.130
   22    HG1  THR   3           1HG      THR   3  -4.779   3.898  -4.554
   23   1HG2  THR   3          1HG2      THR   3  -4.570   4.035  -1.147
   24   2HG2  THR   3          2HG2      THR   3  -5.341   5.597  -1.425
   25   3HG2  THR   3          3HG2      THR   3  -3.627   5.520  -1.017
   26    H    LYS   4           H        LYS   4  -1.795   7.718  -3.808
   27    HA   LYS   4           HA       LYS   4  -0.440   6.088  -5.758
   28   1HB   LYS   4          2HB       LYS   4  -1.866   7.537  -7.187
   29   2HB   LYS   4          1HB       LYS   4  -1.142   8.955  -6.447
   30   1HG   LYS   4          2HG       LYS   4  -0.160   8.546  -8.617
   31   2HG   LYS   4          1HG       LYS   4   1.043   8.298  -7.350
   32   1HD   LYS   4          2HD       LYS   4   0.780   5.904  -7.514
   33   2HD   LYS   4          1HD       LYS   4  -0.539   6.094  -8.669
   34   1HE   LYS   4          2HE       LYS   4   1.521   5.505  -9.819
   35   2HE   LYS   4          1HE       LYS   4   1.013   7.136 -10.257
   36   1HZ   LYS   4          1HZ       LYS   4   3.157   6.402  -8.344
   37   2HZ   LYS   4          2HZ       LYS   4   2.619   7.987  -8.604
   38   3HZ   LYS   4          3HZ       LYS   4   3.359   7.123  -9.861
   39    H    THR   5           H        THR   5   0.993   5.877  -4.024
   40    HA   THR   5           HA       THR   5   2.918   8.040  -3.782
   41    HB   THR   5           HB       THR   5   1.797   6.911  -1.223
   42    HG1  THR   5           1HG      THR   5   0.753   8.965  -2.831
   43   1HG2  THR   5          1HG2      THR   5   3.970   8.018  -1.098
   44   2HG2  THR   5          2HG2      THR   5   2.741   8.958  -0.253
   45   3HG2  THR   5          3HG2      THR   5   3.288   9.460  -1.852
   46    H    TYR   6           H        TYR   6   4.860   7.283  -2.555
   47    HA   TYR   6           HA       TYR   6   5.130   4.358  -2.645
   48   1HB   TYR   6          2HB       TYR   6   7.167   6.420  -3.475
   49   2HB   TYR   6          1HB       TYR   6   7.448   4.689  -3.414
   50    HD1  TYR   6           1HD      TYR   6   6.248   7.419  -5.396
   51    HD2  TYR   6           2HD      TYR   6   6.046   3.197  -4.917
   52    HE1  TYR   6           1HE      TYR   6   5.410   7.201  -7.698
   53    HE2  TYR   6           2HE      TYR   6   5.218   2.963  -7.212
   54    HH   TYR   6           HH       TYR   6   5.378   5.414  -9.487
   55    H    SER   7           H        SER   7   5.882   3.466  -0.870
   56    HA   SER   7           HA       SER   7   7.733   4.870   0.847
   57   1HB   SER   7          2HB       SER   7   5.091   3.812   1.892
   58   2HB   SER   7          1HB       SER   7   6.399   4.467   2.876
   59    HG   SER   7           HG       SER   7   5.785   6.217   0.944
   60    H    GLU   8           H        GLU   8   8.604   3.316   2.535
   61    HA   GLU   8           HA       GLU   8   9.513   1.088   1.022
   62   1HB   GLU   8          2HB       GLU   8  10.047   1.807   3.906
   63   2HB   GLU   8          1HB       GLU   8  10.933   0.608   2.971
   64   1HG   GLU   8          2HG       GLU   8  10.771   3.540   2.318
   65   2HG   GLU   8          1HG       GLU   8  12.117   2.750   3.135
   66    H    GLU   9           H        GLU   9   7.651   1.249   4.081
   67    HA   GLU   9           HA       GLU   9   7.385  -1.533   4.323
   68   1HB   GLU   9          2HB       GLU   9   5.813  -1.078   6.034
   69   2HB   GLU   9          1HB       GLU   9   7.067   0.122   6.154
   70   1HG   GLU   9          2HG       GLU   9   4.338   0.535   4.967
   71   2HG   GLU   9          1HG       GLU   9   4.868   1.060   6.564
   72    H    PHE  10           H        PHE  10   5.521   0.897   2.684
   73    HA   PHE  10           HA       PHE  10   3.268  -0.466   1.883
   74   1HB   PHE  10          2HB       PHE  10   3.881   1.928   1.329
   75   2HB   PHE  10          1HB       PHE  10   4.943   1.296   0.081
   76    HD1  PHE  10           1HD      PHE  10   4.133   0.901  -2.059
   77    HD2  PHE  10           2HD      PHE  10   1.391   1.304   1.175
   78    HE1  PHE  10           1HE      PHE  10   2.255   0.899  -3.651
   79    HE2  PHE  10           2HE      PHE  10  -0.489   1.298  -0.413
   80    HZ   PHE  10           HZ       PHE  10  -0.055   1.094  -2.830
   81    H    LYS  11           H        LYS  11   6.476  -0.508   0.352
   82    HA   LYS  11           HA       LYS  11   5.781  -2.406  -1.650
   83   1HB   LYS  11          2HB       LYS  11   8.561  -1.815  -0.642
   84   2HB   LYS  11          1HB       LYS  11   8.088  -2.387  -2.236
   85   1HG   LYS  11          2HG       LYS  11   7.137  -0.277  -2.795
   86   2HG   LYS  11          1HG       LYS  11   7.351   0.314  -1.144
   87   1HD   LYS  11          2HD       LYS  11   9.827  -0.065  -1.463
   88   2HD   LYS  11          1HD       LYS  11   9.479  -0.333  -3.170
   89   1HE   LYS  11          2HE       LYS  11   8.719   1.871  -3.471
   90   2HE   LYS  11          1HE       LYS  11   8.603   2.150  -1.732
   91   1HZ   LYS  11          1HZ       LYS  11  10.978   2.092  -1.553
   92   2HZ   LYS  11          2HZ       LYS  11  10.550   3.214  -2.755
   93   3HZ   LYS  11          3HZ       LYS  11  11.144   1.688  -3.196
   94    H    ARG  12           H        ARG  12   7.261  -2.615   1.558
   95    HA   ARG  12           HA       ARG  12   8.124  -5.272   1.511
   96   1HB   ARG  12          2HB       ARG  12   6.922  -3.809   3.871
   97   2HB   ARG  12          1HB       ARG  12   7.889  -5.269   3.955
   98   1HG   ARG  12          2HG       ARG  12   9.788  -3.949   2.976
   99   2HG   ARG  12          1HG       ARG  12   8.789  -2.506   3.188
  100   1HD   ARG  12          2HD       ARG  12   8.524  -3.307   5.617
  101   2HD   ARG  12          1HD       ARG  12   9.903  -4.347   5.277
  102    HE   ARG  12           HE       ARG  12  10.182  -1.479   4.779
  103   1HH1  ARG  12          1HH1      ARG  12  11.025  -4.307   6.672
  104   2HH1  ARG  12          2HH1      ARG  12  12.226  -3.472   7.618
  105   1HH2  ARG  12          1HH2      ARG  12  11.744  -0.361   6.060
  106   2HH2  ARG  12          2HH2      ARG  12  12.602  -1.238   7.298
  107    H    ASP  13           H        ASP  13   4.970  -3.914   2.367
  108    HA   ASP  13           HA       ASP  13   3.740  -6.337   3.101
  109   1HB   ASP  13          2HB       ASP  13   2.759  -4.215   3.730
  110   2HB   ASP  13          1HB       ASP  13   2.544  -3.770   2.041
  111    H    ALA  14           H        ALA  14   4.102  -4.728  -0.005
  112    HA   ALA  14           HA       ALA  14   2.340  -6.349  -1.495
  113   1HB   ALA  14          1HB       ALA  14   3.205  -4.211  -2.316
  114   2HB   ALA  14          2HB       ALA  14   3.520  -5.517  -3.457
  115   3HB   ALA  14          3HB       ALA  14   4.822  -4.910  -2.434
  116    H    VAL  15           H        VAL  15   5.766  -6.699  -0.691
  117    HA   VAL  15           HA       VAL  15   6.177  -9.042  -2.241
  118    HB   VAL  15           HB       VAL  15   7.687  -8.117   0.217
  119   1HG1  VAL  15          1HG1      VAL  15   9.510  -9.500  -0.626
  120   2HG1  VAL  15          2HG1      VAL  15   8.477 -10.064  -1.941
  121   3HG1  VAL  15          3HG1      VAL  15   8.078 -10.467  -0.270
  122   1HG2  VAL  15          1HG2      VAL  15   9.297  -7.174  -1.379
  123   2HG2  VAL  15          2HG2      VAL  15   7.708  -6.427  -1.535
  124   3HG2  VAL  15          3HG2      VAL  15   8.234  -7.630  -2.711
  125    H    ALA  16           H        ALA  16   5.219  -8.458   1.109
  126    HA   ALA  16           HA       ALA  16   5.124 -11.180   1.891
  127   1HB   ALA  16          1HB       ALA  16   3.813 -10.397   3.795
  128   2HB   ALA  16          2HB       ALA  16   3.599  -8.830   3.015
  129   3HB   ALA  16          3HB       ALA  16   5.207  -9.349   3.516
  130    H    LEU  17           H        LEU  17   2.913  -9.082   0.204
  131    HA   LEU  17           HA       LEU  17   0.601 -10.689   0.360
  132   1HB   LEU  17          2HB       LEU  17   1.561  -8.703  -1.692
  133   2HB   LEU  17          1HB       LEU  17   0.029  -9.539  -1.852
  134    HG   LEU  17           HG       LEU  17   0.781  -7.739   0.453
  135   1HD1  LEU  17          1HD1      LEU  17  -0.804  -6.159  -0.523
  136   2HD1  LEU  17          2HD1      LEU  17  -1.041  -7.238  -1.899
  137   3HD1  LEU  17          3HD1      LEU  17   0.533  -6.489  -1.625
  138   1HD2  LEU  17          1HD2      LEU  17  -0.803  -9.463   1.099
  139   2HD2  LEU  17          2HD2      LEU  17  -1.832  -9.059  -0.275
  140   3HD2  LEU  17          3HD2      LEU  17  -1.598  -7.891   1.025
  141    H    TYR  18           H        TYR  18   3.458 -10.800  -1.654
  142    HA   TYR  18           HA       TYR  18   2.458 -12.694  -3.529
  143   1HB   TYR  18          2HB       TYR  18   4.458 -11.196  -3.888
  144   2HB   TYR  18          1HB       TYR  18   5.351 -12.224  -2.771
  145    HD1  TYR  18           1HD      TYR  18   3.588 -12.182  -6.023
  146    HD2  TYR  18           2HD      TYR  18   6.312 -14.274  -3.508
  147    HE1  TYR  18           1HE      TYR  18   4.161 -13.672  -7.891
  148    HE2  TYR  18           2HE      TYR  18   6.888 -15.770  -5.372
  149    HH   TYR  18           HH       TYR  18   5.752 -16.572  -7.500
  150    H    GLU  19           H        GLU  19   3.886 -12.905  -0.354
  151    HA   GLU  19           HA       GLU  19   4.430 -15.702  -0.411
  152   1HB   GLU  19          2HB       GLU  19   3.893 -13.912   1.971
  153   2HB   GLU  19          1HB       GLU  19   4.595 -15.523   2.034
  154   1HG   GLU  19          2HG       GLU  19   6.491 -14.699   0.677
  155   2HG   GLU  19          1HG       GLU  19   5.807 -13.076   0.782
  156    H    ASN  20           H        ASN  20   1.602 -13.819  -0.093
  157    HA   ASN  20           HA       ASN  20   0.059 -16.039   1.036
  158   1HB   ASN  20          2HB       ASN  20  -0.507 -13.092   0.737
  159   2HB   ASN  20          1HB       ASN  20  -1.774 -14.247   1.136
  160   1HD2  ASN  20          1HD2      ASN  20   1.125 -12.676   2.244
  161   2HD2  ASN  20          2HD2      ASN  20   0.947 -13.102   3.911
  162    H    SER  21           H        SER  21   1.113 -15.719  -1.772
  163    HA   SER  21           HA       SER  21  -1.040 -15.239  -3.527
  164   1HB   SER  21          2HB       SER  21   0.421 -16.479  -5.184
  165   2HB   SER  21          1HB       SER  21   1.156 -15.092  -4.387
  166    HG   SER  21           HG       SER  21   2.521 -16.349  -3.379
  167    H    ASP  22           H        ASP  22  -0.462 -17.785  -1.445
  168    HA   ASP  22           HA       ASP  22  -1.203 -20.122  -2.587
  169   1HB   ASP  22          2HB       ASP  22  -0.679 -19.922  -0.219
  170   2HB   ASP  22          1HB       ASP  22  -2.182 -19.049   0.059
  171    H    GLY  23           H        GLY  23  -3.420 -17.555  -1.614
  172   1HA   GLY  23          2HA       GLY  23  -5.522 -18.931  -3.172
  173   2HA   GLY  23          1HA       GLY  23  -5.863 -18.103  -1.658
  174    H    ALA  24           H        ALA  24  -3.655 -16.897  -4.122
  175    HA   ALA  24           HA       ALA  24  -5.595 -15.059  -5.195
  176   1HB   ALA  24          1HB       ALA  24  -3.354 -13.979  -3.485
  177   2HB   ALA  24          2HB       ALA  24  -5.073 -13.942  -3.090
  178   3HB   ALA  24          3HB       ALA  24  -4.461 -13.014  -4.461
  179    H    SER  25           H        SER  25  -5.093 -14.666  -7.230
  180    HA   SER  25           HA       SER  25  -2.630 -15.490  -8.395
  181   1HB   SER  25          2HB       SER  25  -4.677 -15.551  -9.693
  182   2HB   SER  25          1HB       SER  25  -4.909 -13.816  -9.484
  183    HG   SER  25           HG       SER  25  -3.949 -14.575 -11.541
  184    H    LEU  26           H        LEU  26  -1.078 -14.140  -9.489
  185    HA   LEU  26           HA       LEU  26  -0.157 -11.953  -7.984
  186   1HB   LEU  26          2HB       LEU  26   1.204 -13.392  -9.542
  187   2HB   LEU  26          1HB       LEU  26   0.480 -12.533 -10.883
  188    HG   LEU  26           HG       LEU  26   1.992 -11.030  -8.762
  189   1HD1  LEU  26          1HD1      LEU  26   3.455 -12.842  -9.526
  190   2HD1  LEU  26          2HD1      LEU  26   4.014 -11.273 -10.107
  191   3HD1  LEU  26          3HD1      LEU  26   3.165 -12.369 -11.199
  192   1HD2  LEU  26          1HD2      LEU  26   0.702  -9.718 -10.349
  193   2HD2  LEU  26          2HD2      LEU  26   1.469 -10.556 -11.696
  194   3HD2  LEU  26          3HD2      LEU  26   2.426  -9.507 -10.651
  195    H    GLN  27           H        GLN  27  -2.109 -12.161 -10.909
  196    HA   GLN  27           HA       GLN  27  -2.270  -9.429 -11.514
  197   1HB   GLN  27          2HB       GLN  27  -3.102 -11.274 -12.985
  198   2HB   GLN  27          1HB       GLN  27  -4.455 -11.493 -11.883
  199   1HG   GLN  27          2HG       GLN  27  -5.256 -10.176 -13.679
  200   2HG   GLN  27          1HG       GLN  27  -5.058  -9.095 -12.306
  201   1HE2  GLN  27          1HE2      GLN  27  -4.924  -7.311 -13.650
  202   2HE2  GLN  27          2HE2      GLN  27  -3.511  -6.963 -14.583
  203    H    GLN  28           H        GLN  28  -4.197 -11.470  -9.366
  204    HA   GLN  28           HA       GLN  28  -6.122  -9.536  -8.673
  205   1HB   GLN  28          2HB       GLN  28  -6.452 -11.930  -8.285
  206   2HB   GLN  28          1HB       GLN  28  -5.145 -11.939  -7.111
  207   1HG   GLN  28          2HG       GLN  28  -7.315 -11.943  -6.015
  208   2HG   GLN  28          1HG       GLN  28  -6.426 -10.463  -5.655
  209   1HE2  GLN  28          1HE2      GLN  28  -7.160  -8.509  -6.477
  210   2HE2  GLN  28          2HE2      GLN  28  -8.745  -8.329  -7.150
  211    H    ILE  29           H        ILE  29  -2.984 -10.363  -7.264
  212    HA   ILE  29           HA       ILE  29  -3.171  -8.749  -4.971
  213    HB   ILE  29           HB       ILE  29  -0.695  -9.475  -6.544
  214   1HG1  ILE  29          2HG1      ILE  29  -1.948 -11.438  -5.768
  215   2HG1  ILE  29          1HG1      ILE  29  -0.433 -11.268  -4.887
  216   1HG2  ILE  29          1HG2      ILE  29  -0.300  -7.578  -5.073
  217   2HG2  ILE  29          2HG2      ILE  29   0.518  -9.017  -4.465
  218   3HG2  ILE  29          3HG2      ILE  29  -0.981  -8.471  -3.711
  219   1HD1  ILE  29          1HD1      ILE  29  -2.242 -11.916  -3.408
  220   2HD1  ILE  29          2HD1      ILE  29  -3.164 -10.489  -3.882
  221   3HD1  ILE  29          3HD1      ILE  29  -1.648 -10.307  -2.996
  222    H    ALA  30           H        ALA  30  -1.725  -8.047  -8.149
  223    HA   ALA  30           HA       ALA  30  -1.141  -5.331  -7.592
  224   1HB   ALA  30          1HB       ALA  30  -1.591  -6.652 -10.266
  225   2HB   ALA  30          2HB       ALA  30  -0.059  -6.596  -9.392
  226   3HB   ALA  30          3HB       ALA  30  -0.790  -5.105  -9.988
  227    H    ASN  31           H        ASN  31  -3.928  -6.973  -8.880
  228    HA   ASN  31           HA       ASN  31  -5.364  -4.731  -9.843
  229   1HB   ASN  31          2HB       ASN  31  -5.738  -7.209 -10.342
  230   2HB   ASN  31          1HB       ASN  31  -6.561  -7.297  -8.792
  231   1HD2  ASN  31          1HD2      ASN  31  -6.695  -6.186 -12.052
  232   2HD2  ASN  31          2HD2      ASN  31  -8.366  -5.765 -12.052
  233    H    ASP  32           H        ASP  32  -5.151  -6.311  -6.718
  234    HA   ASP  32           HA       ASP  32  -7.350  -4.890  -5.542
  235   1HB   ASP  32          2HB       ASP  32  -6.575  -7.130  -4.762
  236   2HB   ASP  32          1HB       ASP  32  -5.098  -6.377  -4.173
  237    H    LEU  33           H        LEU  33  -3.878  -4.465  -5.706
  238    HA   LEU  33           HA       LEU  33  -3.861  -2.263  -3.861
  239   1HB   LEU  33          2HB       LEU  33  -1.962  -3.862  -4.151
  240   2HB   LEU  33          1HB       LEU  33  -1.702  -3.203  -5.755
  241    HG   LEU  33           HG       LEU  33  -1.204  -1.018  -4.777
  242   1HD1  LEU  33          1HD1      LEU  33  -0.879  -0.814  -2.350
  243   2HD1  LEU  33          2HD1      LEU  33  -1.530  -2.440  -2.142
  244   3HD1  LEU  33          3HD1      LEU  33  -2.558  -1.153  -2.771
  245   1HD2  LEU  33          1HD2      LEU  33   0.406  -3.284  -3.614
  246   2HD2  LEU  33          2HD2      LEU  33   0.949  -1.613  -3.765
  247   3HD2  LEU  33          3HD2      LEU  33   0.618  -2.567  -5.212
  248    H    GLY  34           H        GLY  34  -4.175  -2.759  -7.280
  249   1HA   GLY  34          2HA       GLY  34  -5.307  -1.193  -8.642
  250   2HA   GLY  34          1HA       GLY  34  -4.816   0.086  -7.542
  251    H    ILE  35           H        ILE  35  -2.259  -2.008  -8.312
  252    HA   ILE  35           HA       ILE  35  -1.224   0.031 -10.167
  253    HB   ILE  35           HB       ILE  35   1.035  -0.663  -9.510
  254   1HG1  ILE  35          2HG1      ILE  35  -0.321  -2.372  -7.412
  255   2HG1  ILE  35          1HG1      ILE  35   0.421  -3.002  -8.882
  256   1HG2  ILE  35          1HG2      ILE  35  -0.732   0.093  -7.190
  257   2HG2  ILE  35          2HG2      ILE  35  -0.021   1.197  -8.365
  258   3HG2  ILE  35          3HG2      ILE  35   1.018   0.299  -7.259
  259   1HD1  ILE  35          1HD1      ILE  35   2.581  -2.117  -8.150
  260   2HD1  ILE  35          2HD1      ILE  35   1.901  -3.254  -6.987
  261   3HD1  ILE  35          3HD1      ILE  35   1.829  -1.520  -6.670
  262    H    ASN  36           H        ASN  36   0.522  -0.855 -11.658
  263    HA   ASN  36           HA       ASN  36  -0.584  -2.847 -13.313
  264   1HB   ASN  36          2HB       ASN  36   0.760  -1.053 -14.214
  265   2HB   ASN  36          1HB       ASN  36   2.132  -1.527 -13.230
  266   1HD2  ASN  36          1HD2      ASN  36   3.465  -1.751 -14.954
  267   2HD2  ASN  36          2HD2      ASN  36   3.323  -3.042 -16.085
  268    H    ARG  37           H        ARG  37   0.041  -4.955 -13.679
  269    HA   ARG  37           HA       ARG  37   0.908  -6.463 -11.502
  270   1HB   ARG  37          2HB       ARG  37   0.969  -8.330 -13.091
  271   2HB   ARG  37          1HB       ARG  37  -0.496  -7.386 -13.257
  272   1HG   ARG  37          2HG       ARG  37   0.408  -6.301 -15.232
  273   2HG   ARG  37          1HG       ARG  37   1.915  -7.204 -15.052
  274   1HD   ARG  37          2HD       ARG  37   0.634  -9.304 -15.294
  275   2HD   ARG  37          1HD       ARG  37  -0.821  -8.350 -15.580
  276    HE   ARG  37           HE       ARG  37   0.867  -7.404 -17.461
  277   1HH1  ARG  37          1HH1      ARG  37  -0.120 -10.651 -16.569
  278   2HH1  ARG  37          2HH1      ARG  37   0.145 -11.304 -18.163
  279   1HH2  ARG  37          1HH2      ARG  37   1.196  -8.242 -19.550
  280   2HH2  ARG  37          2HH2      ARG  37   0.890  -9.923 -19.871
  281    H    VAL  38           H        VAL  38   2.635  -5.128 -14.247
  282    HA   VAL  38           HA       VAL  38   5.058  -6.562 -13.764
  283    HB   VAL  38           HB       VAL  38   4.661  -4.019 -15.354
  284   1HG1  VAL  38          1HG1      VAL  38   6.724  -4.655 -16.496
  285   2HG1  VAL  38          2HG1      VAL  38   6.881  -6.057 -15.437
  286   3HG1  VAL  38          3HG1      VAL  38   6.992  -4.431 -14.765
  287   1HG2  VAL  38          1HG2      VAL  38   4.516  -5.473 -17.313
  288   2HG2  VAL  38          2HG2      VAL  38   3.227  -5.827 -16.163
  289   3HG2  VAL  38          3HG2      VAL  38   4.628  -6.893 -16.274
  290    H    THR  39           H        THR  39   3.836  -3.345 -12.939
  291    HA   THR  39           HA       THR  39   6.185  -2.356 -11.747
  292    HB   THR  39           HB       THR  39   3.337  -1.681 -10.972
  293    HG1  THR  39           1HG      THR  39   4.965  -0.842 -13.160
  294   1HG2  THR  39          1HG2      THR  39   5.050  -0.753  -9.480
  295   2HG2  THR  39          2HG2      THR  39   4.278   0.519 -10.426
  296   3HG2  THR  39          3HG2      THR  39   5.886  -0.054 -10.868
  297    H    LEU  40           H        LEU  40   3.439  -4.179 -10.423
  298    HA   LEU  40           HA       LEU  40   4.291  -4.292  -7.747
  299   1HB   LEU  40          2HB       LEU  40   2.058  -4.990  -8.435
  300   2HB   LEU  40          1HB       LEU  40   2.729  -6.307  -9.378
  301    HG   LEU  40           HG       LEU  40   3.646  -7.227  -7.192
  302   1HD1  LEU  40          1HD1      LEU  40   2.464  -6.505  -5.157
  303   2HD1  LEU  40          2HD1      LEU  40   1.734  -5.188  -6.074
  304   3HD1  LEU  40          3HD1      LEU  40   3.480  -5.235  -5.838
  305   1HD2  LEU  40          1HD2      LEU  40   1.511  -8.251  -6.595
  306   2HD2  LEU  40          2HD2      LEU  40   1.728  -8.185  -8.345
  307   3HD2  LEU  40          3HD2      LEU  40   0.662  -7.032  -7.544
  308    H    LYS  41           H        LYS  41   4.866  -6.431 -10.494
  309    HA   LYS  41           HA       LYS  41   6.357  -8.416  -9.236
  310   1HB   LYS  41          2HB       LYS  41   5.410  -8.397 -11.593
  311   2HB   LYS  41          1HB       LYS  41   6.809  -7.443 -12.054
  312   1HG   LYS  41          2HG       LYS  41   8.270  -9.277 -11.265
  313   2HG   LYS  41          1HG       LYS  41   6.823 -10.239 -10.948
  314   1HD   LYS  41          2HD       LYS  41   6.202 -10.031 -13.323
  315   2HD   LYS  41          1HD       LYS  41   7.698  -9.141 -13.618
  316   1HE   LYS  41          2HE       LYS  41   8.978 -11.098 -12.833
  317   2HE   LYS  41          1HE       LYS  41   7.466 -11.980 -12.631
  318   1HZ   LYS  41          1HZ       LYS  41   7.066 -11.610 -15.041
  319   2HZ   LYS  41          2HZ       LYS  41   8.411 -12.588 -14.706
  320   3HZ   LYS  41          3HZ       LYS  41   8.634 -10.972 -15.167
  321    H    ASN  42           H        ASN  42   7.361  -5.381 -10.706
  322    HA   ASN  42           HA       ASN  42  10.116  -5.679 -10.607
  323   1HB   ASN  42          2HB       ASN  42   8.358  -3.246 -10.419
  324   2HB   ASN  42          1HB       ASN  42  10.110  -3.109 -10.354
  325   1HD2  ASN  42          1HD2      ASN  42   8.276  -2.081 -12.344
  326   2HD2  ASN  42          2HD2      ASN  42   8.751  -2.776 -13.853
  327    H    TRP  43           H        TRP  43   7.960  -4.413  -8.055
  328    HA   TRP  43           HA       TRP  43  10.033  -3.932  -6.185
  329   1HB   TRP  43          2HB       TRP  43   7.083  -4.448  -5.789
  330   2HB   TRP  43          1HB       TRP  43   8.179  -4.089  -4.462
  331    HD1  TRP  43           HD       TRP  43   9.650  -1.878  -6.698
  332    HE1  TRP  43           1HE      TRP  43   8.563   0.456  -6.740
  333    HE3  TRP  43           3HE      TRP  43   5.203  -3.009  -4.443
  334    HZ2  TRP  43           2HZ      TRP  43   6.139   1.655  -5.923
  335    HZ3  TRP  43           3HZ      TRP  43   3.556  -1.214  -4.107
  336    HH2  TRP  43           HH       TRP  43   4.019   1.071  -4.829
  337    H    ILE  44           H        ILE  44   7.967  -6.724  -6.809
  338    HA   ILE  44           HA       ILE  44   8.768  -8.275  -4.615
  339    HB   ILE  44           HB       ILE  44   7.784  -9.213  -7.316
  340   1HG1  ILE  44          2HG1      ILE  44   6.262  -8.718  -4.742
  341   2HG1  ILE  44          1HG1      ILE  44   6.242  -7.661  -6.155
  342   1HG2  ILE  44          1HG2      ILE  44   8.876 -11.010  -6.120
  343   2HG2  ILE  44          2HG2      ILE  44   7.133 -11.265  -6.136
  344   3HG2  ILE  44          3HG2      ILE  44   7.923 -10.671  -4.675
  345   1HD1  ILE  44          1HD1      ILE  44   5.280 -10.515  -6.092
  346   2HD1  ILE  44          2HD1      ILE  44   5.209  -9.408  -7.464
  347   3HD1  ILE  44          3HD1      ILE  44   4.266  -9.075  -6.015
  348    H    ILE  45           H        ILE  45  10.088  -7.986  -7.892
  349    HA   ILE  45           HA       ILE  45  11.951 -10.121  -7.586
  350    HB   ILE  45           HB       ILE  45  11.879  -7.865  -9.597
  351   1HG1  ILE  45          2HG1      ILE  45  11.045 -10.767  -9.784
  352   2HG1  ILE  45          1HG1      ILE  45   9.954  -9.389  -9.678
  353   1HG2  ILE  45          1HG2      ILE  45  14.153  -8.753  -9.378
  354   2HG2  ILE  45          2HG2      ILE  45  13.440  -9.180 -10.932
  355   3HG2  ILE  45          3HG2      ILE  45  13.544 -10.387  -9.650
  356   1HD1  ILE  45          1HD1      ILE  45  11.855  -9.980 -11.937
  357   2HD1  ILE  45          2HD1      ILE  45  10.790  -8.578 -11.831
  358   3HD1  ILE  45          3HD1      ILE  45  10.105 -10.198 -11.950
  359    H    LYS  46           H        LYS  46  12.092  -6.669  -6.951
  360    HA   LYS  46           HA       LYS  46  14.974  -6.705  -6.699
  361   1HB   LYS  46          2HB       LYS  46  13.777  -4.723  -7.593
  362   2HB   LYS  46          1HB       LYS  46  13.044  -4.486  -6.012
  363   1HG   LYS  46          2HG       LYS  46  15.279  -4.193  -5.033
  364   2HG   LYS  46          1HG       LYS  46  15.989  -4.378  -6.635
  365   1HD   LYS  46          2HD       LYS  46  14.771  -2.393  -7.396
  366   2HD   LYS  46          1HD       LYS  46  14.071  -2.212  -5.785
  367   1HE   LYS  46          2HE       LYS  46  16.316  -1.936  -4.843
  368   2HE   LYS  46          1HE       LYS  46  17.013  -2.107  -6.454
  369   1HZ   LYS  46          1HZ       LYS  46  15.188   0.059  -5.551
  370   2HZ   LYS  46          2HZ       LYS  46  15.786  -0.117  -7.130
  371   3HZ   LYS  46          3HZ       LYS  46  16.851   0.208  -5.853
  372    H    TYR  47           H        TYR  47  12.211  -6.319  -4.495
  373    HA   TYR  47           HA       TYR  47  13.988  -6.192  -2.206
  374   1HB   TYR  47          2HB       TYR  47  10.979  -6.067  -2.447
  375   2HB   TYR  47          1HB       TYR  47  11.835  -5.982  -0.912
  376    HD1  TYR  47           1HD      TYR  47  11.406  -4.265  -4.176
  377    HD2  TYR  47           2HD      TYR  47  12.754  -3.950  -0.150
  378    HE1  TYR  47           1HE      TYR  47  11.662  -1.836  -4.458
  379    HE2  TYR  47           2HE      TYR  47  13.009  -1.521  -0.419
  380    HH   TYR  47           HH       TYR  47  13.267   0.129  -2.098
  381    H    GLY  48           H        GLY  48  11.671  -8.458  -3.604
  382   1HA   GLY  48          2HA       GLY  48  12.513 -10.454  -1.597
  383   2HA   GLY  48          1HA       GLY  48  11.015 -10.523  -2.516
  384    H    SER  49           H        SER  49  14.433 -10.089  -3.306
  385    HA   SER  49           HA       SER  49  14.329 -11.110  -5.874
  386   1HB   SER  49          2HB       SER  49  16.185  -9.765  -5.019
  387   2HB   SER  49          1HB       SER  49  16.675 -11.088  -3.963
  388    HG   SER  49           HG       SER  49  16.798 -10.907  -6.786
  389    H    ASN  50           H        ASN  50  14.406 -12.841  -2.889
  390    HA   ASN  50           HA       ASN  50  14.234 -15.063  -2.403
  391   1HB   ASN  50          2HB       ASN  50  12.865 -15.454  -4.360
  392   2HB   ASN  50          1HB       ASN  50  14.274 -15.419  -5.412
  393   1HD2  ASN  50          1HD2      ASN  50  12.452 -17.286  -3.125
  394   2HD2  ASN  50          2HD2      ASN  50  13.230 -18.799  -3.438
  395    H    HIS  51           H        HIS  51  16.624 -14.036  -4.723
  396    HA   HIS  51           HA       HIS  51  18.561 -16.039  -4.035
  397   1HB   HIS  51          2HB       HIS  51  19.071 -13.353  -5.329
  398   2HB   HIS  51          1HB       HIS  51  20.080 -14.791  -5.424
  399    HD1  HIS  51           1HD      HIS  51  17.407 -13.018  -7.136
  400    HD2  HIS  51           2HD      HIS  51  18.821 -16.929  -7.011
  401    HE1  HIS  51           1HE      HIS  51  16.474 -14.143  -9.185
  402    HE2  HIS  51           2HE      HIS  51  17.249 -16.540  -9.033
  403    H    ASN  52           H        ASN  52  18.904 -15.991  -1.820
  404    HA   ASN  52           HA       ASN  52  19.458 -13.504  -0.497
  405   1HB   ASN  52          2HB       ASN  52  19.691 -14.902   1.523
  406   2HB   ASN  52          1HB       ASN  52  18.158 -15.147   0.709
  407   1HD2  ASN  52          1HD2      ASN  52  19.553 -16.848   2.585
  408   2HD2  ASN  52          2HD2      ASN  52  19.816 -18.359   1.784
  409    H    VAL  53           H        VAL  53  21.270 -13.105  -1.961
  410    HA   VAL  53           HA       VAL  53  23.663 -14.619  -1.721
  411    HB   VAL  53           HB       VAL  53  23.162 -13.282  -3.706
  412   1HG1  VAL  53          1HG1      VAL  53  23.536 -10.885  -1.934
  413   2HG1  VAL  53          2HG1      VAL  53  22.056 -11.380  -2.757
  414   3HG1  VAL  53          3HG1      VAL  53  23.447 -10.837  -3.696
  415   1HG2  VAL  53          1HG2      VAL  53  25.663 -12.364  -2.312
  416   2HG2  VAL  53          2HG2      VAL  53  25.361 -12.297  -4.048
  417   3HG2  VAL  53          3HG2      VAL  53  25.475 -13.857  -3.232
  418    H    GLN  54           H        GLN  54  22.562 -11.552  -0.329
  419    HA   GLN  54           HA       GLN  54  24.522 -11.972   1.833
  420   1HB   GLN  54          2HB       GLN  54  23.399  -9.422   0.698
  421   2HB   GLN  54          1HB       GLN  54  24.000  -9.475   2.347
  422   1HG   GLN  54          2HG       GLN  54  25.907  -8.821   1.368
  423   2HG   GLN  54          1HG       GLN  54  26.099 -10.549   1.072
  424   1HE2  GLN  54          1HE2      GLN  54  25.284  -7.467  -0.322
  425   2HE2  GLN  54          2HE2      GLN  54  25.428  -7.952  -1.982
  426    H    GLY  55           H        GLY  55  23.462 -13.073   3.356
  427   1HA   GLY  55          2HA       GLY  55  20.639 -12.752   3.812
  428   2HA   GLY  55          1HA       GLY  55  21.730 -13.775   4.726
  429    H    THR  56           H        THR  56  22.759 -12.969   6.511
  430    HA   THR  56           HA       THR  56  22.935 -11.873   8.456
  431    HB   THR  56           HB       THR  56  23.314  -9.422   8.349
  432    HG1  THR  56           1HG      THR  56  21.950  -9.565   6.127
  433   1HG2  THR  56          1HG2      THR  56  25.142 -11.013   8.018
  434   2HG2  THR  56          2HG2      THR  56  25.373  -9.555   7.052
  435   3HG2  THR  56          3HG2      THR  56  24.802 -11.040   6.288
  436    H    THR  57           H        THR  57  21.228 -12.266   9.687
  437    HA   THR  57           HA       THR  57  18.661 -11.137   9.420
  438    HB   THR  57           HB       THR  57  19.986 -12.026  11.993
  439    HG1  THR  57           1HG      THR  57  18.424 -13.619  10.205
  440   1HG2  THR  57          1HG2      THR  57  17.685 -12.578  12.674
  441   2HG2  THR  57          2HG2      THR  57  17.088 -11.917  11.153
  442   3HG2  THR  57          3HG2      THR  57  17.868 -10.858  12.327
  443    HA   PRO  58           HA       PRO  58  19.658  -6.892  10.333
  444   1HB   PRO  58          2HB       PRO  58  17.059  -6.168  11.020
  445   2HB   PRO  58          1HB       PRO  58  17.734  -6.145   9.389
  446   1HG   PRO  58          2HG       PRO  58  16.033  -8.210  10.712
  447   2HG   PRO  58          1HG       PRO  58  16.011  -7.643   9.030
  448   1HD   PRO  58          2HD       PRO  58  17.117  -9.991   9.698
  449   2HD   PRO  58          1HD       PRO  58  17.827  -8.964   8.435
  450    H    SER  59           H        SER  59  20.494  -6.093  12.125
  451    HA   SER  59           HA       SER  59  20.217  -7.323  14.632
  452   1HB   SER  59          2HB       SER  59  21.275  -4.538  14.104
  453   2HB   SER  59          1HB       SER  59  21.697  -5.612  15.442
  454    HG   SER  59           HG       SER  59  22.596  -7.049  13.874
  455    H    ALA  60           H        ALA  60  18.374  -4.840  13.111
  456    HA   ALA  60           HA       ALA  60  17.333  -3.620  15.460
  457   1HB   ALA  60          1HB       ALA  60  16.214  -3.666  12.658
  458   2HB   ALA  60          2HB       ALA  60  17.329  -2.467  13.316
  459   3HB   ALA  60          3HB       ALA  60  15.693  -2.599  13.959
  460    H    ALA  61           H        ALA  61  16.703  -6.591  13.899
  461    HA   ALA  61           HA       ALA  61  13.926  -6.756  14.524
  462   1HB   ALA  61          1HB       ALA  61  14.061  -9.045  13.731
  463   2HB   ALA  61          2HB       ALA  61  15.822  -8.958  13.739
  464   3HB   ALA  61          3HB       ALA  61  14.893  -7.955  12.626
  465    H    VAL  62           H        VAL  62  16.592  -6.959  16.455
  466    HA   VAL  62           HA       VAL  62  15.808  -9.032  18.236
  467    HB   VAL  62           HB       VAL  62  17.534  -6.609  18.786
  468   1HG1  VAL  62          1HG1      VAL  62  18.415  -7.875  20.663
  469   2HG1  VAL  62          2HG1      VAL  62  17.330  -9.215  20.290
  470   3HG1  VAL  62          3HG1      VAL  62  16.671  -7.669  20.825
  471   1HG2  VAL  62          1HG2      VAL  62  18.290  -9.401  17.930
  472   2HG2  VAL  62          2HG2      VAL  62  19.425  -8.142  18.417
  473   3HG2  VAL  62          3HG2      VAL  62  18.441  -7.928  16.969
  474    H    SER  63           H        SER  63  15.391  -5.536  18.207
  475    HA   SER  63           HA       SER  63  13.598  -5.611  20.487
  476   1HB   SER  63          2HB       SER  63  14.357  -3.276  18.708
  477   2HB   SER  63          1HB       SER  63  13.589  -3.188  20.295
  478    HG   SER  63           HG       SER  63  15.514  -4.248  21.123
  479    H    GLU  64           H        GLU  64  13.514  -5.287  17.017
  480    HA   GLU  64           HA       GLU  64  10.931  -4.302  16.654
  481   1HB   GLU  64          2HB       GLU  64  12.881  -4.693  14.964
  482   2HB   GLU  64          1HB       GLU  64  12.159  -6.282  14.760
  483   1HG   GLU  64          2HG       GLU  64  11.248  -5.014  13.034
  484   2HG   GLU  64          1HG       GLU  64   9.985  -5.028  14.268
  485    H    ALA  65           H        ALA  65  12.083  -7.500  17.330
  486    HA   ALA  65           HA       ALA  65   9.987  -9.078  16.432
  487   1HB   ALA  65          1HB       ALA  65  11.738  -9.563  18.839
  488   2HB   ALA  65          2HB       ALA  65  12.143  -9.952  17.167
  489   3HB   ALA  65          3HB       ALA  65  10.804 -10.780  17.963
  490    H    GLU  66           H        GLU  66  10.120  -7.003  19.207
  491    HA   GLU  66           HA       GLU  66   8.073  -8.296  20.710
  492   1HB   GLU  66          2HB       GLU  66   9.897  -6.403  21.314
  493   2HB   GLU  66          1HB       GLU  66   8.502  -5.373  21.038
  494   1HG   GLU  66          2HG       GLU  66   8.650  -7.652  23.003
  495   2HG   GLU  66          1HG       GLU  66   8.751  -5.937  23.389
  496    H    GLN  67           H        GLN  67   8.103  -5.359  18.695
  497    HA   GLN  67           HA       GLN  67   5.272  -5.035  18.838
  498   1HB   GLN  67          2HB       GLN  67   5.705  -3.392  16.894
  499   2HB   GLN  67          1HB       GLN  67   6.379  -3.018  18.473
  500   1HG   GLN  67          2HG       GLN  67   8.095  -4.530  16.600
  501   2HG   GLN  67          1HG       GLN  67   7.776  -2.838  16.220
  502   1HE2  GLN  67          1HE2      GLN  67   9.941  -2.333  16.548
  503   2HE2  GLN  67          2HE2      GLN  67  10.617  -2.205  18.147
  504    H    ILE  68           H        ILE  68   7.458  -6.602  16.583
  505    HA   ILE  68           HA       ILE  68   5.614  -7.069  14.515
  506    HB   ILE  68           HB       ILE  68   7.997  -8.689  15.413
  507   1HG1  ILE  68          2HG1      ILE  68   7.576  -6.792  13.093
  508   2HG1  ILE  68          1HG1      ILE  68   8.510  -6.451  14.547
  509   1HG2  ILE  68          1HG2      ILE  68   7.864  -9.823  13.228
  510   2HG2  ILE  68          2HG2      ILE  68   6.316  -9.034  12.930
  511   3HG2  ILE  68          3HG2      ILE  68   6.479 -10.184  14.259
  512   1HD1  ILE  68          1HD1      ILE  68  10.108  -8.182  13.930
  513   2HD1  ILE  68          2HD1      ILE  68   9.937  -6.985  12.646
  514   3HD1  ILE  68          3HD1      ILE  68   9.156  -8.558  12.493
  515    H    ARG  69           H        ARG  69   6.353  -8.912  17.450
  516    HA   ARG  69           HA       ARG  69   4.637 -11.085  16.916
  517   1HB   ARG  69          2HB       ARG  69   6.458 -11.097  18.598
  518   2HB   ARG  69          1HB       ARG  69   5.529  -9.985  19.589
  519   1HG   ARG  69          2HG       ARG  69   4.147 -12.473  18.848
  520   2HG   ARG  69          1HG       ARG  69   5.546 -12.655  19.906
  521   1HD   ARG  69          2HD       ARG  69   3.101 -10.960  20.381
  522   2HD   ARG  69          1HD       ARG  69   3.583 -12.406  21.263
  523    HE   ARG  69           HE       ARG  69   4.796  -9.747  21.468
  524   1HH1  ARG  69          1HH1      ARG  69   4.638 -13.080  22.555
  525   2HH1  ARG  69          2HH1      ARG  69   5.578 -12.783  23.988
  526   1HH2  ARG  69          1HH2      ARG  69   6.062  -9.365  23.325
  527   2HH2  ARG  69          2HH2      ARG  69   6.380 -10.675  24.424
  528    H    GLN  70           H        GLN  70   4.102  -7.918  18.289
  529    HA   GLN  70           HA       GLN  70   1.489  -8.336  19.284
  530   1HB   GLN  70          2HB       GLN  70   3.192  -6.368  19.597
  531   2HB   GLN  70          1HB       GLN  70   2.429  -5.722  18.157
  532   1HG   GLN  70          2HG       GLN  70   0.830  -6.499  20.564
  533   2HG   GLN  70          1HG       GLN  70   1.609  -4.930  20.431
  534   1HE2  GLN  70          1HE2      GLN  70  -0.988  -6.939  19.348
  535   2HE2  GLN  70          2HE2      GLN  70  -1.809  -5.732  18.415
  536    H    LEU  71           H        LEU  71   2.715  -7.023  16.218
  537    HA   LEU  71           HA       LEU  71   0.232  -6.661  14.952
  538   1HB   LEU  71          2HB       LEU  71   2.520  -5.759  14.280
  539   2HB   LEU  71          1HB       LEU  71   2.838  -7.332  13.578
  540    HG   LEU  71           HG       LEU  71   2.100  -5.481  11.993
  541   1HD1  LEU  71          1HD1      LEU  71   0.755  -6.964  10.624
  542   2HD1  LEU  71          2HD1      LEU  71   0.471  -8.012  12.014
  543   3HD1  LEU  71          3HD1      LEU  71   2.100  -7.840  11.360
  544   1HD2  LEU  71          1HD2      LEU  71  -0.563  -6.039  13.290
  545   2HD2  LEU  71          2HD2      LEU  71  -0.318  -5.099  11.819
  546   3HD2  LEU  71          3HD2      LEU  71   0.334  -4.525  13.353
  547    H    LYS  72           H        LYS  72   2.430  -9.417  15.084
  548    HA   LYS  72           HA       LYS  72   1.013 -11.128  13.350
  549   1HB   LYS  72          2HB       LYS  72   2.915 -11.627  15.623
  550   2HB   LYS  72          1HB       LYS  72   2.179 -12.948  14.732
  551   1HG   LYS  72          2HG       LYS  72   3.871 -10.780  13.509
  552   2HG   LYS  72          1HG       LYS  72   4.438 -12.393  13.949
  553   1HD   LYS  72          2HD       LYS  72   2.631 -13.301  12.429
  554   2HD   LYS  72          1HD       LYS  72   2.413 -11.650  11.846
  555   1HE   LYS  72          2HE       LYS  72   3.896 -12.903  10.372
  556   2HE   LYS  72          1HE       LYS  72   4.765 -11.587  11.161
  557   1HZ   LYS  72          1HZ       LYS  72   5.741 -13.124  12.688
  558   2HZ   LYS  72          2HZ       LYS  72   5.993 -13.725  11.121
  559   3HZ   LYS  72          3HZ       LYS  72   4.792 -14.403  12.107
  560    H    LYS  73           H        LYS  73   0.503 -10.185  16.637
  561    HA   LYS  73           HA       LYS  73  -1.155 -10.577  18.128
  562   1HB   LYS  73          2HB       LYS  73  -2.453 -11.776  15.685
  563   2HB   LYS  73          1HB       LYS  73  -3.258 -11.733  17.249
  564   1HG   LYS  73          2HG       LYS  73  -3.439  -9.419  17.235
  565   2HG   LYS  73          1HG       LYS  73  -2.147  -9.230  16.050
  566   1HD   LYS  73          2HD       LYS  73  -4.762 -10.562  15.383
  567   2HD   LYS  73          1HD       LYS  73  -4.524  -8.820  15.238
  568   1HE   LYS  73          2HE       LYS  73  -2.602  -9.251  13.739
  569   2HE   LYS  73          1HE       LYS  73  -2.957 -10.974  13.822
  570   1HZ   LYS  73          1HZ       LYS  73  -5.010  -9.044  12.945
  571   2HZ   LYS  73          2HZ       LYS  73  -4.915 -10.708  12.633
  572   3HZ   LYS  73          3HZ       LYS  73  -3.858  -9.636  11.854
  573    H    GLU  74           H        GLU  74   1.062 -12.475  17.588
  574    HA   GLU  74           HA       GLU  74   0.044 -15.103  18.142
  575   1HB   GLU  74          2HB       GLU  74   2.835 -13.964  18.134
  576   2HB   GLU  74          1HB       GLU  74   2.481 -15.648  18.487
  577   1HG   GLU  74          2HG       GLU  74   1.470 -15.877  16.258
  578   2HG   GLU  74          1HG       GLU  74   1.912 -14.206  15.909
  579    H    ASN  75           H        ASN  75  -0.749 -15.610  20.063
  580    HA   ASN  75           HA       ASN  75   0.704 -14.676  22.445
  581   1HB   ASN  75          2HB       ASN  75  -1.374 -15.149  23.724
  582   2HB   ASN  75          1HB       ASN  75  -1.589 -13.898  22.509
  583   1HD2  ASN  75          1HD2      ASN  75  -3.818 -14.245  22.577
  584   2HD2  ASN  75          2HD2      ASN  75  -4.553 -15.614  21.801
  585    H    ALA  76           H        ALA  76   0.240 -16.373  24.333
  586    HA   ALA  76           HA       ALA  76   1.536 -18.763  23.512
  587   1HB   ALA  76          1HB       ALA  76   1.436 -19.399  25.854
  588   2HB   ALA  76          2HB       ALA  76   0.298 -18.090  26.173
  589   3HB   ALA  76          3HB       ALA  76   1.955 -17.722  25.689
  590    H    LEU  77           H        LEU  77  -1.750 -17.854  24.058
  591    HA   LEU  77           HA       LEU  77  -2.875 -20.370  24.571
  592   1HB   LEU  77          2HB       LEU  77  -4.063 -17.854  23.418
  593   2HB   LEU  77          1HB       LEU  77  -5.006 -19.269  23.827
  594    HG   LEU  77           HG       LEU  77  -3.411 -17.590  25.760
  595   1HD1  LEU  77          1HD1      LEU  77  -5.614 -17.021  26.674
  596   2HD1  LEU  77          2HD1      LEU  77  -6.385 -17.936  25.377
  597   3HD1  LEU  77          3HD1      LEU  77  -5.442 -16.493  25.001
  598   1HD2  LEU  77          1HD2      LEU  77  -5.139 -20.017  26.241
  599   2HD2  LEU  77          2HD2      LEU  77  -4.437 -18.995  27.493
  600   3HD2  LEU  77          3HD2      LEU  77  -3.386 -19.927  26.427
  601    H    GLN  78           H        GLN  78  -1.881 -18.864  21.613
  602    HA   GLN  78           HA       GLN  78  -3.434 -20.091  19.703
  603   1HB   GLN  78          2HB       GLN  78  -1.547 -18.382  19.436
  604   2HB   GLN  78          1HB       GLN  78  -0.447 -19.749  19.419
  605   1HG   GLN  78          2HG       GLN  78  -2.733 -19.525  17.487
  606   2HG   GLN  78          1HG       GLN  78  -1.177 -18.763  17.184
  607   1HE2  GLN  78          1HE2      GLN  78  -2.949 -21.719  17.251
  608   2HE2  GLN  78          2HE2      GLN  78  -1.706 -22.721  16.594
  609    H    ARG  79           H        ARG  79  -0.368 -21.362  21.016
  610    HA   ARG  79           HA       ARG  79  -0.831 -23.897  19.690
  611   1HB   ARG  79          2HB       ARG  79   1.427 -22.969  21.467
  612   2HB   ARG  79          1HB       ARG  79   1.379 -24.502  20.608
  613   1HG   ARG  79          2HG       ARG  79   1.325 -23.318  18.477
  614   2HG   ARG  79          1HG       ARG  79   1.342 -21.776  19.331
  615   1HD   ARG  79          2HD       ARG  79   3.520 -22.455  20.345
  616   2HD   ARG  79          1HD       ARG  79   3.510 -23.864  19.283
  617    HE   ARG  79           HE       ARG  79   3.343 -22.109  17.429
  618   1HH1  ARG  79          1HH1      ARG  79   5.071 -21.651  20.443
  619   2HH1  ARG  79          2HH1      ARG  79   6.162 -20.470  19.771
  620   1HH2  ARG  79          1HH2      ARG  79   4.777 -20.582  16.556
  621   2HH2  ARG  79          2HH2      ARG  79   5.986 -19.852  17.574
  622    H    ALA  80           H        ALA  80  -1.464 -22.491  22.694
  623    HA   ALA  80           HA       ALA  80  -1.509 -24.831  24.302
  624   1HB   ALA  80          1HB       ALA  80  -1.442 -22.556  25.256
  625   2HB   ALA  80          2HB       ALA  80  -2.773 -23.519  25.896
  626   3HB   ALA  80          3HB       ALA  80  -3.086 -22.287  24.675
  627    H    ARG  81           H        ARG  81  -3.576 -23.558  21.895
  628    HA   ARG  81           HA       ARG  81  -5.970 -24.924  22.655
  629   1HB   ARG  81          2HB       ARG  81  -5.034 -23.540  20.166
  630   2HB   ARG  81          1HB       ARG  81  -6.522 -24.471  20.165
  631   1HG   ARG  81          2HG       ARG  81  -7.357 -23.050  22.013
  632   2HG   ARG  81          1HG       ARG  81  -5.891 -22.075  21.875
  633   1HD   ARG  81          2HD       ARG  81  -7.793 -22.565  19.589
  634   2HD   ARG  81          1HD       ARG  81  -7.913 -21.177  20.670
  635    HE   ARG  81           HE       ARG  81  -5.752 -20.447  19.844
  636   1HH1  ARG  81          1HH1      ARG  81  -7.285 -23.010  18.008
  637   2HH1  ARG  81          2HH1      ARG  81  -6.492 -22.589  16.516
  638   1HH2  ARG  81          1HH2      ARG  81  -4.729 -19.877  17.901
  639   2HH2  ARG  81          2HH2      ARG  81  -5.037 -20.789  16.448
  640    H    THR  82           H        THR  82  -3.084 -25.901  21.203
  641    HA   THR  82           HA       THR  82  -4.221 -27.894  19.460
  642    HB   THR  82           HB       THR  82  -1.300 -27.671  20.128
  643    HG1  THR  82           1HG      THR  82  -2.936 -25.909  18.632
  644   1HG2  THR  82          1HG2      THR  82  -1.034 -28.343  17.791
  645   2HG2  THR  82          2HG2      THR  82  -2.784 -28.333  17.579
  646   3HG2  THR  82          3HG2      THR  82  -2.035 -29.506  18.662
  647    H    ARG  83           H        ARG  83  -3.688 -27.869  22.742
  648    HA   ARG  83           HA       ARG  83  -2.932 -30.691  22.821
  649   1HB   ARG  83          2HB       ARG  83  -2.525 -30.348  25.203
  650   2HB   ARG  83          1HB       ARG  83  -1.618 -29.201  24.241
  651   1HG   ARG  83          2HG       ARG  83  -2.380 -27.848  25.910
  652   2HG   ARG  83          1HG       ARG  83  -3.671 -27.644  24.726
  653   1HD   ARG  83          2HD       ARG  83  -4.947 -29.427  25.911
  654   2HD   ARG  83          1HD       ARG  83  -3.686 -29.450  27.143
  655    HE   ARG  83           HE       ARG  83  -4.756 -26.830  26.725
  656   1HH1  ARG  83          1HH1      ARG  83  -5.282 -29.871  28.375
  657   2HH1  ARG  83          2HH1      ARG  83  -6.268 -29.166  29.624
  658   1HH2  ARG  83          1HH2      ARG  83  -6.047 -25.908  28.347
  659   2HH2  ARG  83          2HH2      ARG  83  -6.696 -26.914  29.604
  660    H    HIS  84           H        HIS  84  -4.160 -32.205  24.017
  661    HA   HIS  84           HA       HIS  84  -7.011 -31.560  24.101
  662   1HB   HIS  84          2HB       HIS  84  -5.517 -34.187  24.204
  663   2HB   HIS  84          1HB       HIS  84  -7.255 -34.059  24.432
  664    HD1  HIS  84           1HD      HIS  84  -4.591 -33.788  21.818
  665    HD2  HIS  84           2HD      HIS  84  -8.740 -33.622  22.102
  666    HE1  HIS  84           1HE      HIS  84  -5.442 -33.879  19.448
  667    HE2  HIS  84           2HE      HIS  84  -7.946 -33.653  19.635
  668    HA   PRO  85           HA       PRO  85  -7.014 -31.474  28.518
  669   1HB   PRO  85          2HB       PRO  85  -9.584 -31.979  29.074
  670   2HB   PRO  85          1HB       PRO  85  -9.095 -30.501  28.235
  671   1HG   PRO  85          2HG       PRO  85 -10.242 -33.024  27.107
  672   2HG   PRO  85          1HG       PRO  85 -10.629 -31.340  26.706
  673   1HD   PRO  85          2HD       PRO  85  -8.935 -32.916  25.219
  674   2HD   PRO  85          1HD       PRO  85  -8.854 -31.146  25.275
  675    H    ALA  86           H        ALA  86  -7.728 -32.747  30.463
  676    HA   ALA  86           HA       ALA  86  -7.733 -35.644  29.954
  677   1HB   ALA  86          1HB       ALA  86  -6.301 -35.959  31.924
  678   2HB   ALA  86          2HB       ALA  86  -6.194 -34.210  32.123
  679   3HB   ALA  86          3HB       ALA  86  -5.500 -34.981  30.695
  680    H    GLU  87           H        GLU  87 -10.074 -35.092  30.119
  681    HA   GLU  87           HA       GLU  87 -11.258 -34.073  32.443
  682   1HB   GLU  87          2HB       GLU  87 -12.444 -35.956  30.396
  683   2HB   GLU  87          1HB       GLU  87 -13.357 -34.991  31.549
  684   1HG   GLU  87          2HG       GLU  87 -12.439 -32.944  30.493
  685   2HG   GLU  87          1HG       GLU  87 -11.642 -33.960  29.294
  686    H    SER  88           H        SER  88 -10.401 -37.358  31.534
  687    HA   SER  88           HA       SER  88 -11.799 -38.642  33.638
  688   1HB   SER  88          2HB       SER  88 -11.024 -39.779  31.559
  689   2HB   SER  88          1HB       SER  88  -9.363 -39.631  32.131
  690    HG   SER  88           HG       SER  88  -9.662 -41.282  33.389
  691    H    CYS  89           H        CYS  89  -8.514 -37.391  33.318
  692    HA   CYS  89           HA       CYS  89  -7.580 -38.488  35.776
  693   1HB   CYS  89          2HB       CYS  89  -6.386 -36.143  34.312
  694   2HB   CYS  89          1HB       CYS  89  -5.565 -37.323  35.330
  695    HG   CYS  89           HG       CYS  89  -4.879 -38.883  33.420
  696    H    LEU  90           H        LEU  90  -9.213 -35.604  34.843
  697    HA   LEU  90           HA       LEU  90  -8.683 -34.072  37.183
  698   1HB   LEU  90          2HB       LEU  90  -9.453 -33.053  35.095
  699   2HB   LEU  90          1HB       LEU  90 -10.968 -33.927  35.206
  700    HG   LEU  90           HG       LEU  90 -11.499 -32.682  37.279
  701   1HD1  LEU  90          1HD1      LEU  90  -9.019 -31.100  36.615
  702   2HD1  LEU  90          2HD1      LEU  90  -9.204 -32.194  37.985
  703   3HD1  LEU  90          3HD1      LEU  90 -10.181 -30.728  37.889
  704   1HD2  LEU  90          1HD2      LEU  90 -11.926 -30.512  36.172
  705   2HD2  LEU  90          2HD2      LEU  90 -12.386 -31.895  35.178
  706   3HD2  LEU  90          3HD2      LEU  90 -10.892 -31.021  34.837
  707    H    GLU  91           H        GLU  91 -11.132 -36.388  36.236
  708    HA   GLU  91           HA       GLU  91 -12.716 -36.045  38.602
  709   1HB   GLU  91          2HB       GLU  91 -13.367 -36.941  36.216
  710   2HB   GLU  91          1HB       GLU  91 -12.838 -38.485  36.865
  711   1HG   GLU  91          2HG       GLU  91 -14.922 -36.761  38.180
  712   2HG   GLU  91          1HG       GLU  91 -15.300 -38.019  37.008
  713    H    HIS  92           H        HIS  92 -10.457 -38.541  37.409
  714    HA   HIS  92           HA       HIS  92  -9.774 -39.138  40.181
  715   1HB   HIS  92          2HB       HIS  92 -11.138 -41.022  38.352
  716   2HB   HIS  92          1HB       HIS  92  -9.778 -41.674  39.258
  717    HD1  HIS  92           1HD      HIS  92 -13.312 -40.669  39.592
  718    HD2  HIS  92           2HD      HIS  92 -10.129 -41.598  42.107
  719    HE1  HIS  92           1HE      HIS  92 -14.331 -41.135  41.840
  720    HE2  HIS  92           2HE      HIS  92 -12.383 -41.561  43.383
  721    H    HIS  93           H        HIS  93  -7.684 -39.439  40.467
  722    HA   HIS  93           HA       HIS  93  -6.018 -40.146  38.153
  723   1HB   HIS  93          2HB       HIS  93  -4.326 -38.516  38.820
  724   2HB   HIS  93          1HB       HIS  93  -5.855 -37.702  38.522
  725    HD1  HIS  93           1HD      HIS  93  -3.198 -37.987  40.957
  726    HD2  HIS  93           2HD      HIS  93  -7.243 -37.022  41.041
  727    HE1  HIS  93           1HE      HIS  93  -3.574 -36.819  43.152
  728    HE2  HIS  93           2HE      HIS  93  -5.964 -36.017  43.055
  729    H    HIS  94           H        HIS  94  -3.717 -40.748  38.994
  730    HA   HIS  94           HA       HIS  94  -4.224 -42.905  40.854
  731   1HB   HIS  94          2HB       HIS  94  -2.875 -43.117  38.715
  732   2HB   HIS  94          1HB       HIS  94  -1.601 -42.218  39.527
  733    HD1  HIS  94           1HD      HIS  94  -3.312 -45.537  39.475
  734    HD2  HIS  94           2HD      HIS  94  -0.164 -43.675  41.467
  735    HE1  HIS  94           1HE      HIS  94  -2.085 -47.374  40.680
  736    HE2  HIS  94           2HE      HIS  94  -0.090 -46.258  41.739
  737    H    HIS  95           H        HIS  95  -3.853 -42.840  42.945
  738    HA   HIS  95           HA       HIS  95  -1.759 -41.041  43.984
  739   1HB   HIS  95          2HB       HIS  95  -4.048 -40.119  44.420
  740   2HB   HIS  95          1HB       HIS  95  -4.418 -41.576  45.332
  741    HD1  HIS  95           1HD      HIS  95  -3.753 -41.596  47.760
  742    HD2  HIS  95           2HD      HIS  95  -1.968 -38.489  45.652
  743    HE1  HIS  95           1HE      HIS  95  -2.616 -40.175  49.488
  744    HE2  HIS  95           2HE      HIS  95  -1.703 -38.198  48.215
  745    H    HIS  96           H        HIS  96  -0.308 -42.061  45.205
  746    HA   HIS  96           HA       HIS  96  -0.683 -44.915  45.600
  747   1HB   HIS  96          2HB       HIS  96   1.416 -43.925  44.612
  748   2HB   HIS  96          1HB       HIS  96   1.774 -43.263  46.204
  749    HD1  HIS  96           1HD      HIS  96   3.568 -44.641  47.212
  750    HD2  HIS  96           2HD      HIS  96   0.791 -46.964  45.166
  751    HE1  HIS  96           1HE      HIS  96   4.269 -47.023  47.587
  752    HE2  HIS  96           2HE      HIS  96   2.453 -48.410  46.515
  753    H    HIS  97           H        HIS  97  -0.996 -45.915  47.472
  754    HA   HIS  97           HA       HIS  97  -0.482 -44.521  49.989
  755   1HB   HIS  97          2HB       HIS  97  -2.843 -44.087  49.572
  756   2HB   HIS  97          1HB       HIS  97  -3.134 -45.795  49.258
  757    HD1  HIS  97           1HD      HIS  97  -3.496 -47.323  51.255
  758    HD2  HIS  97           2HD      HIS  97  -2.453 -43.442  52.330
  759    HE1  HIS  97           1HE      HIS  97  -3.887 -47.175  53.735
  760    HE2  HIS  97           2HE      HIS  97  -3.443 -44.767  54.325
  Start of MODEL    6
    1   1H    MET   1          1HT       MET   1   7.557  19.682  -8.856
    2   2H    MET   1          2HT       MET   1   9.108  20.007  -8.263
    3   3H    MET   1          3HT       MET   1   7.830  19.752  -7.183
    4    HA   MET   1           HA       MET   1   8.945  17.742  -9.048
    5   1HB   MET   1          2HB       MET   1   9.168  18.013  -6.041
    6   2HB   MET   1          1HB       MET   1   9.700  16.611  -6.957
    7   1HG   MET   1          2HG       MET   1  11.604  17.939  -6.439
    8   2HG   MET   1          1HG       MET   1  11.295  18.080  -8.169
    9   1HE   MET   1          1HE       MET   1  13.181  20.054  -6.436
   10   2HE   MET   1          2HE       MET   1  12.744  21.606  -7.154
   11   3HE   MET   1          3HE       MET   1  12.960  20.185  -8.176
   12    HA   PRO   2           HA       PRO   2   4.764  16.291  -8.125
   13   1HB   PRO   2          2HB       PRO   2   4.582  14.982 -10.585
   14   2HB   PRO   2          1HB       PRO   2   4.041  16.627 -10.252
   15   1HG   PRO   2          2HG       PRO   2   6.183  15.811 -11.931
   16   2HG   PRO   2          1HG       PRO   2   5.713  17.463 -11.512
   17   1HD   PRO   2          2HD       PRO   2   7.891  15.788 -10.425
   18   2HD   PRO   2          1HD       PRO   2   7.739  17.556 -10.475
   19    H    THR   3           H        THR   3   6.934  14.946  -6.979
   20    HA   THR   3           HA       THR   3   7.036  12.255  -7.997
   21    HB   THR   3           HB       THR   3   8.492  11.861  -5.956
   22    HG1  THR   3           1HG      THR   3   8.917  13.496  -4.638
   23   1HG2  THR   3          1HG2      THR   3   9.280  14.032  -7.901
   24   2HG2  THR   3          2HG2      THR   3   9.442  12.293  -8.155
   25   3HG2  THR   3          3HG2      THR   3  10.397  13.097  -6.908
   26    H    LYS   4           H        LYS   4   5.348  11.022  -7.696
   27    HA   LYS   4           HA       LYS   4   4.091  10.916  -5.045
   28   1HB   LYS   4          2HB       LYS   4   2.567  11.515  -6.907
   29   2HB   LYS   4          1HB       LYS   4   2.980  10.012  -7.713
   30   1HG   LYS   4          2HG       LYS   4   2.010   9.630  -4.989
   31   2HG   LYS   4          1HG       LYS   4   0.841  10.411  -6.055
   32   1HD   LYS   4          2HD       LYS   4   1.324   8.562  -7.717
   33   2HD   LYS   4          1HD       LYS   4   2.197   7.747  -6.423
   34   1HE   LYS   4          2HE       LYS   4   0.223   7.587  -5.088
   35   2HE   LYS   4          1HE       LYS   4  -0.673   8.635  -6.187
   36   1HZ   LYS   4          1HZ       LYS   4  -1.273   6.332  -6.528
   37   2HZ   LYS   4          2HZ       LYS   4   0.341   5.908  -6.814
   38   3HZ   LYS   4          3HZ       LYS   4  -0.472   6.922  -7.903
   39    H    THR   5           H        THR   5   5.392   9.514  -4.033
   40    HA   THR   5           HA       THR   5   5.827   6.887  -5.298
   41    HB   THR   5           HB       THR   5   7.660   8.027  -3.207
   42    HG1  THR   5           1HG      THR   5   7.337   8.853  -5.831
   43   1HG2  THR   5          1HG2      THR   5   8.082   6.085  -5.491
   44   2HG2  THR   5          2HG2      THR   5   7.906   5.658  -3.787
   45   3HG2  THR   5          3HG2      THR   5   9.308   6.583  -4.329
   46    H    TYR   6           H        TYR   6   6.141   5.106  -3.739
   47    HA   TYR   6           HA       TYR   6   4.305   5.401  -1.465
   48   1HB   TYR   6          2HB       TYR   6   5.150   2.809  -2.766
   49   2HB   TYR   6          1HB       TYR   6   3.779   3.088  -1.699
   50    HD1  TYR   6           1HD      TYR   6   4.971   3.111  -5.095
   51    HD2  TYR   6           2HD      TYR   6   1.814   4.397  -2.552
   52    HE1  TYR   6           1HE      TYR   6   3.547   3.480  -7.062
   53    HE2  TYR   6           2HE      TYR   6   0.377   4.762  -4.512
   54    HH   TYR   6           HH       TYR   6   1.153   3.605  -7.609
   55    H    SER   7           H        SER   7   4.872   4.339   0.516
   56    HA   SER   7           HA       SER   7   7.562   4.542   1.281
   57   1HB   SER   7          2HB       SER   7   5.392   2.891   2.601
   58   2HB   SER   7          1HB       SER   7   6.859   3.503   3.365
   59    HG   SER   7           HG       SER   7   5.301   4.945   3.895
   60    H    GLU   8           H        GLU   8   9.208   3.055   1.430
   61    HA   GLU   8           HA       GLU   8   9.156   0.834  -0.292
   62   1HB   GLU   8          2HB       GLU   8  11.307   0.198   1.097
   63   2HB   GLU   8          1HB       GLU   8  11.308   1.532  -0.038
   64   1HG   GLU   8          2HG       GLU   8  12.452   2.228   1.913
   65   2HG   GLU   8          1HG       GLU   8  10.912   3.074   1.878
   66    H    GLU   9           H        GLU   9   8.595   1.097   3.148
   67    HA   GLU   9           HA       GLU   9   8.335  -1.632   3.779
   68   1HB   GLU   9          2HB       GLU   9   8.429   0.147   5.450
   69   2HB   GLU   9          1HB       GLU   9   6.908   0.804   4.874
   70   1HG   GLU   9          2HG       GLU   9   5.801  -1.304   5.563
   71   2HG   GLU   9          1HG       GLU   9   7.336  -1.829   6.260
   72    H    PHE  10           H        PHE  10   6.035   0.722   2.517
   73    HA   PHE  10           HA       PHE  10   3.730  -0.863   2.537
   74   1HB   PHE  10          2HB       PHE  10   3.788   1.595   2.156
   75   2HB   PHE  10          1HB       PHE  10   4.493   1.311   0.570
   76    HD1  PHE  10           1HD      PHE  10   3.140   0.888  -1.287
   77    HD2  PHE  10           2HD      PHE  10   1.473   0.727   2.625
   78    HE1  PHE  10           1HE      PHE  10   0.885   0.754  -2.261
   79    HE2  PHE  10           2HE      PHE  10  -0.787   0.593   1.664
   80    HZ   PHE  10           HZ       PHE  10  -1.084   0.606  -0.783
   81    H    LYS  11           H        LYS  11   6.366  -0.598   0.227
   82    HA   LYS  11           HA       LYS  11   5.160  -2.244  -1.770
   83   1HB   LYS  11          2HB       LYS  11   8.106  -1.667  -1.411
   84   2HB   LYS  11          1HB       LYS  11   7.291  -2.183  -2.881
   85   1HG   LYS  11          2HG       LYS  11   6.098  -0.054  -2.973
   86   2HG   LYS  11          1HG       LYS  11   6.929   0.467  -1.502
   87   1HD   LYS  11          2HD       LYS  11   9.097   0.068  -2.720
   88   2HD   LYS  11          1HD       LYS  11   8.144  -0.155  -4.187
   89   1HE   LYS  11          2HE       LYS  11   7.278   2.100  -4.000
   90   2HE   LYS  11          1HE       LYS  11   8.135   2.326  -2.476
   91   1HZ   LYS  11          1HZ       LYS  11   9.503   3.324  -4.044
   92   2HZ   LYS  11          2HZ       LYS  11   9.248   2.114  -5.203
   93   3HZ   LYS  11          3HZ       LYS  11  10.210   1.794  -3.843
   94    H    ARG  12           H        ARG  12   7.413  -2.801   0.912
   95    HA   ARG  12           HA       ARG  12   7.938  -5.497   0.149
   96   1HB   ARG  12          2HB       ARG  12   9.097  -5.730   2.271
   97   2HB   ARG  12          1HB       ARG  12   9.549  -4.235   1.488
   98   1HG   ARG  12          2HG       ARG  12   9.343  -3.548   3.642
   99   2HG   ARG  12          1HG       ARG  12   7.709  -3.230   3.055
  100   1HD   ARG  12          2HD       ARG  12   6.849  -5.156   4.105
  101   2HD   ARG  12          1HD       ARG  12   8.458  -5.819   4.389
  102    HE   ARG  12           HE       ARG  12   8.623  -3.625   5.841
  103   1HH1  ARG  12          1HH1      ARG  12   5.928  -5.852   5.569
  104   2HH1  ARG  12          2HH1      ARG  12   5.373  -5.572   7.188
  105   1HH2  ARG  12          1HH2      ARG  12   7.888  -3.281   7.985
  106   2HH2  ARG  12          2HH2      ARG  12   6.487  -4.142   8.552
  107    H    ASP  13           H        ASP  13   5.440  -3.957   1.966
  108    HA   ASP  13           HA       ASP  13   4.312  -6.285   3.122
  109   1HB   ASP  13          2HB       ASP  13   3.352  -3.548   2.481
  110   2HB   ASP  13          1HB       ASP  13   2.124  -4.792   2.669
  111    H    ALA  14           H        ALA  14   4.020  -4.783  -0.044
  112    HA   ALA  14           HA       ALA  14   1.990  -6.487  -1.051
  113   1HB   ALA  14          1HB       ALA  14   2.528  -4.353  -2.104
  114   2HB   ALA  14          2HB       ALA  14   2.666  -5.679  -3.257
  115   3HB   ALA  14          3HB       ALA  14   4.119  -4.966  -2.557
  116    H    VAL  15           H        VAL  15   5.490  -6.735  -0.916
  117    HA   VAL  15           HA       VAL  15   5.756  -9.057  -2.507
  118    HB   VAL  15           HB       VAL  15   7.498  -8.197  -0.180
  119   1HG1  VAL  15          1HG1      VAL  15   8.102  -9.997  -2.520
  120   2HG1  VAL  15          2HG1      VAL  15   7.864 -10.517  -0.850
  121   3HG1  VAL  15          3HG1      VAL  15   9.243  -9.499  -1.271
  122   1HG2  VAL  15          1HG2      VAL  15   8.902  -7.118  -1.854
  123   2HG2  VAL  15          2HG2      VAL  15   7.276  -6.429  -1.853
  124   3HG2  VAL  15          3HG2      VAL  15   7.754  -7.565  -3.116
  125    H    ALA  16           H        ALA  16   5.054  -8.543   0.905
  126    HA   ALA  16           HA       ALA  16   5.083 -11.279   1.674
  127   1HB   ALA  16          1HB       ALA  16   5.272  -9.485   3.317
  128   2HB   ALA  16          2HB       ALA  16   3.887 -10.517   3.673
  129   3HB   ALA  16          3HB       ALA  16   3.643  -8.939   2.925
  130    H    LEU  17           H        LEU  17   2.627  -9.128   0.366
  131    HA   LEU  17           HA       LEU  17   0.413 -10.855   0.579
  132   1HB   LEU  17          2HB       LEU  17   1.082  -8.743  -1.475
  133   2HB   LEU  17          1HB       LEU  17  -0.464  -9.559  -1.391
  134    HG   LEU  17           HG       LEU  17   0.682  -7.862   0.831
  135   1HD1  LEU  17          1HD1      LEU  17   0.185  -6.526  -1.152
  136   2HD1  LEU  17          2HD1      LEU  17  -0.947  -6.187   0.156
  137   3HD1  LEU  17          3HD1      LEU  17  -1.444  -7.200  -1.201
  138   1HD2  LEU  17          1HD2      LEU  17  -0.874  -9.596   1.582
  139   2HD2  LEU  17          2HD2      LEU  17  -2.072  -9.028   0.420
  140   3HD2  LEU  17          3HD2      LEU  17  -1.572  -7.987   1.754
  141    H    TYR  18           H        TYR  18   3.002 -10.588  -1.780
  142    HA   TYR  18           HA       TYR  18   1.922 -12.387  -3.682
  143   1HB   TYR  18          2HB       TYR  18   3.741 -10.706  -4.112
  144   2HB   TYR  18          1HB       TYR  18   4.839 -11.758  -3.226
  145    HD1  TYR  18           1HD      TYR  18   5.956 -13.498  -4.327
  146    HD2  TYR  18           2HD      TYR  18   2.592 -11.663  -6.179
  147    HE1  TYR  18           1HE      TYR  18   6.429 -14.733  -6.402
  148    HE2  TYR  18           2HE      TYR  18   3.055 -12.893  -8.255
  149    HH   TYR  18           HH       TYR  18   5.033 -13.961  -9.362
  150    H    GLU  19           H        GLU  19   3.797 -12.805  -0.767
  151    HA   GLU  19           HA       GLU  19   4.606 -15.469  -1.088
  152   1HB   GLU  19          2HB       GLU  19   3.789 -14.006   1.427
  153   2HB   GLU  19          1HB       GLU  19   4.563 -15.580   1.405
  154   1HG   GLU  19          2HG       GLU  19   6.520 -14.549   0.293
  155   2HG   GLU  19          1HG       GLU  19   5.740 -12.975   0.470
  156    H    ASN  20           H        ASN  20   1.519 -14.066  -0.519
  157    HA   ASN  20           HA       ASN  20   0.383 -16.592   0.432
  158   1HB   ASN  20          2HB       ASN  20  -0.555 -13.735   0.521
  159   2HB   ASN  20          1HB       ASN  20  -1.641 -15.072   0.871
  160   1HD2  ASN  20          1HD2      ASN  20   1.119 -13.254   1.946
  161   2HD2  ASN  20          2HD2      ASN  20   1.151 -13.878   3.563
  162    H    SER  21           H        SER  21   1.131 -16.243  -2.338
  163    HA   SER  21           HA       SER  21  -1.081 -15.614  -3.969
  164   1HB   SER  21          2HB       SER  21   0.187 -16.831  -5.737
  165   2HB   SER  21          1HB       SER  21   1.162 -15.641  -4.873
  166    HG   SER  21           HG       SER  21   2.200 -17.713  -5.182
  167    H    ASP  22           H        ASP  22  -0.462 -18.284  -1.991
  168    HA   ASP  22           HA       ASP  22  -1.552 -20.468  -3.224
  169   1HB   ASP  22          2HB       ASP  22  -0.628 -20.603  -0.995
  170   2HB   ASP  22          1HB       ASP  22  -1.917 -19.588  -0.360
  171    H    GLY  23           H        GLY  23  -3.290 -17.799  -1.732
  172   1HA   GLY  23          2HA       GLY  23  -5.752 -18.874  -2.959
  173   2HA   GLY  23          1HA       GLY  23  -5.745 -18.084  -1.388
  174    H    ALA  24           H        ALA  24  -3.757 -16.911  -4.021
  175    HA   ALA  24           HA       ALA  24  -5.659 -14.821  -4.687
  176   1HB   ALA  24          1HB       ALA  24  -4.573 -13.952  -2.678
  177   2HB   ALA  24          2HB       ALA  24  -4.143 -13.001  -4.101
  178   3HB   ALA  24          3HB       ALA  24  -2.997 -14.168  -3.438
  179    H    SER  25           H        SER  25  -5.505 -14.383  -6.769
  180    HA   SER  25           HA       SER  25  -3.409 -15.408  -8.404
  181   1HB   SER  25          2HB       SER  25  -5.705 -15.185  -9.267
  182   2HB   SER  25          1HB       SER  25  -5.623 -13.435  -9.063
  183    HG   SER  25           HG       SER  25  -3.800 -14.888 -10.686
  184    H    LEU  26           H        LEU  26  -1.805 -14.269  -9.531
  185    HA   LEU  26           HA       LEU  26  -0.533 -12.128  -8.265
  186   1HB   LEU  26          2HB       LEU  26   0.350 -13.786 -10.043
  187   2HB   LEU  26          1HB       LEU  26  -0.320 -12.680 -11.223
  188    HG   LEU  26           HG       LEU  26   1.719 -11.810  -9.176
  189   1HD1  LEU  26          1HD1      LEU  26   2.207 -12.813 -11.974
  190   2HD1  LEU  26          2HD1      LEU  26   2.631 -13.659 -10.485
  191   3HD1  LEU  26          3HD1      LEU  26   3.414 -12.130 -10.884
  192   1HD2  LEU  26          1HD2      LEU  26   0.443 -10.024 -10.275
  193   2HD2  LEU  26          2HD2      LEU  26   0.916 -10.662 -11.851
  194   3HD2  LEU  26          3HD2      LEU  26   2.141 -10.007 -10.762
  195    H    GLN  27           H        GLN  27  -2.911 -12.233 -10.845
  196    HA   GLN  27           HA       GLN  27  -3.049  -9.542 -11.559
  197   1HB   GLN  27          2HB       GLN  27  -4.285 -11.204 -12.792
  198   2HB   GLN  27          1HB       GLN  27  -5.201 -11.667 -11.367
  199   1HG   GLN  27          2HG       GLN  27  -6.618 -10.374 -12.797
  200   2HG   GLN  27          1HG       GLN  27  -6.247  -9.422 -11.365
  201   1HE2  GLN  27          1HE2      GLN  27  -6.830  -7.571 -12.524
  202   2HE2  GLN  27          2HE2      GLN  27  -5.763  -6.852 -13.687
  203    H    GLN  28           H        GLN  28  -4.816 -11.301  -9.023
  204    HA   GLN  28           HA       GLN  28  -6.423  -9.162  -8.187
  205   1HB   GLN  28          2HB       GLN  28  -6.895 -11.541  -7.688
  206   2HB   GLN  28          1HB       GLN  28  -5.530 -11.570  -6.580
  207   1HG   GLN  28          2HG       GLN  28  -7.596 -11.343  -5.354
  208   2HG   GLN  28          1HG       GLN  28  -6.633  -9.875  -5.192
  209   1HE2  GLN  28          1HE2      GLN  28  -8.409  -8.615  -4.686
  210   2HE2  GLN  28          2HE2      GLN  28  -9.609  -8.184  -5.855
  211    H    ILE  29           H        ILE  29  -3.270 -10.291  -6.996
  212    HA   ILE  29           HA       ILE  29  -3.108  -8.668  -4.726
  213    HB   ILE  29           HB       ILE  29  -0.838  -9.582  -6.505
  214   1HG1  ILE  29          2HG1      ILE  29  -2.191 -11.436  -5.616
  215   2HG1  ILE  29          1HG1      ILE  29  -0.594 -11.409  -4.875
  216   1HG2  ILE  29          1HG2      ILE  29  -0.160  -7.724  -5.069
  217   2HG2  ILE  29          2HG2      ILE  29   0.599  -9.228  -4.553
  218   3HG2  ILE  29          3HG2      ILE  29  -0.773  -8.581  -3.654
  219   1HD1  ILE  29          1HD1      ILE  29  -1.535 -10.359  -2.883
  220   2HD1  ILE  29          2HD1      ILE  29  -2.319 -11.900  -3.237
  221   3HD1  ILE  29          3HD1      ILE  29  -3.134 -10.384  -3.627
  222    H    ALA  30           H        ALA  30  -1.890  -8.032  -8.003
  223    HA   ALA  30           HA       ALA  30  -1.065  -5.369  -7.436
  224   1HB   ALA  30          1HB       ALA  30  -0.091  -6.672  -9.254
  225   2HB   ALA  30          2HB       ALA  30  -0.799  -5.178  -9.870
  226   3HB   ALA  30          3HB       ALA  30  -1.650  -6.709 -10.080
  227    H    ASN  31           H        ASN  31  -3.987  -6.854  -8.621
  228    HA   ASN  31           HA       ASN  31  -5.281  -4.577  -9.653
  229   1HB   ASN  31          2HB       ASN  31  -5.892  -6.972 -10.102
  230   2HB   ASN  31          1HB       ASN  31  -6.588  -7.041  -8.486
  231   1HD2  ASN  31          1HD2      ASN  31  -6.911  -5.782 -11.697
  232   2HD2  ASN  31          2HD2      ASN  31  -8.555  -5.276 -11.550
  233    H    ASP  32           H        ASP  32  -5.399  -6.112  -6.465
  234    HA   ASP  32           HA       ASP  32  -7.420  -4.437  -5.393
  235   1HB   ASP  32          2HB       ASP  32  -6.792  -6.663  -4.454
  236   2HB   ASP  32          1HB       ASP  32  -5.270  -5.972  -3.909
  237    H    LEU  33           H        LEU  33  -3.960  -4.146  -5.680
  238    HA   LEU  33           HA       LEU  33  -3.825  -1.903  -3.867
  239   1HB   LEU  33          2HB       LEU  33  -2.026  -3.618  -4.051
  240   2HB   LEU  33          1HB       LEU  33  -1.700  -3.046  -5.678
  241    HG   LEU  33           HG       LEU  33  -1.109  -0.845  -4.778
  242   1HD1  LEU  33          1HD1      LEU  33  -0.806  -0.566  -2.356
  243   2HD1  LEU  33          2HD1      LEU  33  -1.531  -2.153  -2.097
  244   3HD1  LEU  33          3HD1      LEU  33  -2.493  -0.845  -2.787
  245   1HD2  LEU  33          1HD2      LEU  33   1.004  -1.499  -3.730
  246   2HD2  LEU  33          2HD2      LEU  33   0.636  -2.502  -5.135
  247   3HD2  LEU  33          3HD2      LEU  33   0.382  -3.134  -3.508
  248    H    GLY  34           H        GLY  34  -4.065  -2.503  -7.278
  249   1HA   GLY  34          2HA       GLY  34  -4.972  -0.896  -8.763
  250   2HA   GLY  34          1HA       GLY  34  -4.396   0.379  -7.701
  251    H    ILE  35           H        ILE  35  -2.250  -2.213  -8.497
  252    HA   ILE  35           HA       ILE  35  -0.799  -0.386 -10.294
  253    HB   ILE  35           HB       ILE  35   1.282  -1.534  -9.602
  254   1HG1  ILE  35          2HG1      ILE  35  -0.437  -2.780  -7.448
  255   2HG1  ILE  35          1HG1      ILE  35   0.201  -3.644  -8.839
  256   1HG2  ILE  35          1HG2      ILE  35   0.638   0.583  -8.585
  257   2HG2  ILE  35          2HG2      ILE  35   1.490  -0.440  -7.429
  258   3HG2  ILE  35          3HG2      ILE  35  -0.264  -0.281  -7.339
  259   1HD1  ILE  35          1HD1      ILE  35   1.801  -2.367  -6.643
  260   2HD1  ILE  35          2HD1      ILE  35   2.484  -3.147  -8.071
  261   3HD1  ILE  35          3HD1      ILE  35   1.551  -4.091  -6.909
  262    H    ASN  36           H        ASN  36   0.762  -1.636 -11.754
  263    HA   ASN  36           HA       ASN  36  -0.727  -3.638 -13.176
  264   1HB   ASN  36          2HB       ASN  36   0.607  -1.772 -14.239
  265   2HB   ASN  36          1HB       ASN  36   2.063  -2.623 -13.730
  266   1HD2  ASN  36          1HD2      ASN  36  -0.713  -2.680 -15.807
  267   2HD2  ASN  36          2HD2      ASN  36  -0.136  -3.922 -16.868
  268    H    ARG  37           H        ARG  37   0.117  -5.732 -13.735
  269    HA   ARG  37           HA       ARG  37   1.127  -7.264 -11.665
  270   1HB   ARG  37          2HB       ARG  37   1.240  -7.712 -14.645
  271   2HB   ARG  37          1HB       ARG  37   1.659  -8.924 -13.461
  272   1HG   ARG  37          2HG       ARG  37  -0.632  -8.862 -12.600
  273   2HG   ARG  37          1HG       ARG  37  -1.041  -7.660 -13.828
  274   1HD   ARG  37          2HD       ARG  37  -0.442  -9.242 -15.586
  275   2HD   ARG  37          1HD       ARG  37  -0.003 -10.439 -14.372
  276    HE   ARG  37           HE       ARG  37  -2.743  -9.435 -14.335
  277   1HH1  ARG  37          1HH1      ARG  37  -0.519 -12.009 -15.197
  278   2HH1  ARG  37          2HH1      ARG  37  -1.773 -13.197 -15.380
  279   1HH2  ARG  37          1HH2      ARG  37  -4.384 -11.005 -14.603
  280   2HH2  ARG  37          2HH2      ARG  37  -3.952 -12.633 -15.024
  281    H    VAL  38           H        VAL  38   2.763  -5.553 -14.257
  282    HA   VAL  38           HA       VAL  38   5.339  -6.680 -13.782
  283    HB   VAL  38           HB       VAL  38   4.650  -4.078 -15.167
  284   1HG1  VAL  38          1HG1      VAL  38   7.146  -5.771 -15.266
  285   2HG1  VAL  38          2HG1      VAL  38   6.996  -4.167 -14.545
  286   3HG1  VAL  38          3HG1      VAL  38   6.822  -4.373 -16.289
  287   1HG2  VAL  38          1HG2      VAL  38   5.079  -6.835 -16.314
  288   2HG2  VAL  38          2HG2      VAL  38   4.793  -5.361 -17.239
  289   3HG2  VAL  38          3HG2      VAL  38   3.530  -6.000 -16.187
  290    H    THR  39           H        THR  39   3.723  -3.716 -12.735
  291    HA   THR  39           HA       THR  39   5.838  -2.473 -11.415
  292    HB   THR  39           HB       THR  39   2.993  -2.452 -10.407
  293    HG1  THR  39           1HG      THR  39   4.115  -1.152 -12.692
  294   1HG2  THR  39          1HG2      THR  39   4.624  -1.215  -9.073
  295   2HG2  THR  39          2HG2      THR  39   3.516  -0.107  -9.879
  296   3HG2  THR  39          3HG2      THR  39   5.148  -0.332 -10.509
  297    H    LEU  40           H        LEU  40   3.493  -4.856 -10.258
  298    HA   LEU  40           HA       LEU  40   4.340  -5.014  -7.595
  299   1HB   LEU  40          2HB       LEU  40   2.244  -5.976  -8.385
  300   2HB   LEU  40          1HB       LEU  40   3.121  -7.131  -9.371
  301    HG   LEU  40           HG       LEU  40   4.069  -8.110  -7.278
  302   1HD1  LEU  40          1HD1      LEU  40   2.061  -6.308  -5.926
  303   2HD1  LEU  40          2HD1      LEU  40   3.817  -6.161  -5.828
  304   3HD1  LEU  40          3HD1      LEU  40   3.011  -7.575  -5.148
  305   1HD2  LEU  40          1HD2      LEU  40   1.060  -8.069  -7.510
  306   2HD2  LEU  40          2HD2      LEU  40   2.007  -9.275  -6.640
  307   3HD2  LEU  40          3HD2      LEU  40   2.162  -9.129  -8.389
  308    H    LYS  41           H        LYS  41   5.283  -6.945 -10.421
  309    HA   LYS  41           HA       LYS  41   7.055  -8.675  -9.117
  310   1HB   LYS  41          2HB       LYS  41   6.135  -8.905 -11.454
  311   2HB   LYS  41          1HB       LYS  41   7.311  -7.707 -11.965
  312   1HG   LYS  41          2HG       LYS  41   9.128  -9.152 -11.255
  313   2HG   LYS  41          1HG       LYS  41   7.965 -10.356 -10.694
  314   1HD   LYS  41          2HD       LYS  41   7.117 -10.565 -12.999
  315   2HD   LYS  41          1HD       LYS  41   8.345  -9.416 -13.537
  316   1HE   LYS  41          2HE       LYS  41  10.105 -10.930 -12.787
  317   2HE   LYS  41          1HE       LYS  41   8.894 -12.067 -12.198
  318   1HZ   LYS  41          1HZ       LYS  41   9.749 -12.733 -14.345
  319   2HZ   LYS  41          2HZ       LYS  41   9.282 -11.260 -15.033
  320   3HZ   LYS  41          3HZ       LYS  41   8.104 -12.345 -14.467
  321    H    ASN  42           H        ASN  42   7.571  -5.567 -10.686
  322    HA   ASN  42           HA       ASN  42  10.331  -5.370 -10.507
  323   1HB   ASN  42          2HB       ASN  42   8.190  -3.256 -10.355
  324   2HB   ASN  42          1HB       ASN  42   9.900  -2.852 -10.326
  325   1HD2  ASN  42          1HD2      ASN  42   7.929  -2.108 -12.297
  326   2HD2  ASN  42          2HD2      ASN  42   8.474  -2.761 -13.812
  327    H    TRP  43           H        TRP  43   7.900  -4.530  -8.056
  328    HA   TRP  43           HA       TRP  43   9.799  -3.601  -6.149
  329   1HB   TRP  43          2HB       TRP  43   6.951  -4.558  -5.812
  330   2HB   TRP  43          1HB       TRP  43   7.912  -3.870  -4.509
  331    HD1  TRP  43           HD       TRP  43   9.007  -1.783  -7.139
  332    HE1  TRP  43           1HE      TRP  43   7.588   0.352  -7.386
  333    HE3  TRP  43           3HE      TRP  43   4.908  -3.222  -4.449
  334    HZ2  TRP  43           2HZ      TRP  43   5.051   1.291  -6.559
  335    HZ3  TRP  43           3HZ      TRP  43   3.027  -1.655  -4.227
  336    HH2  TRP  43           HH       TRP  43   3.102   0.553  -5.257
  337    H    ILE  44           H        ILE  44   8.238  -6.699  -6.750
  338    HA   ILE  44           HA       ILE  44   9.067  -8.069  -4.462
  339    HB   ILE  44           HB       ILE  44   8.642  -9.184  -7.239
  340   1HG1  ILE  44          2HG1      ILE  44   6.772  -9.113  -4.869
  341   2HG1  ILE  44          1HG1      ILE  44   6.712  -7.965  -6.205
  342   1HG2  ILE  44          1HG2      ILE  44   8.316 -11.337  -6.135
  343   2HG2  ILE  44          2HG2      ILE  44   8.697 -10.607  -4.576
  344   3HG2  ILE  44          3HG2      ILE  44   9.937 -10.714  -5.826
  345   1HD1  ILE  44          1HD1      ILE  44   6.227  -9.789  -7.742
  346   2HD1  ILE  44          2HD1      ILE  44   5.040  -9.705  -6.441
  347   3HD1  ILE  44          3HD1      ILE  44   6.300 -10.938  -6.407
  348    H    ILE  45           H        ILE  45  10.683  -7.748  -7.610
  349    HA   ILE  45           HA       ILE  45  12.890  -9.395  -6.945
  350    HB   ILE  45           HB       ILE  45  12.716  -7.204  -9.020
  351   1HG1  ILE  45          2HG1      ILE  45  12.331 -10.192  -9.311
  352   2HG1  ILE  45          1HG1      ILE  45  11.025  -9.014  -9.261
  353   1HG2  ILE  45          1HG2      ILE  45  14.580  -8.360 -10.112
  354   2HG2  ILE  45          2HG2      ILE  45  14.682  -9.478  -8.753
  355   3HG2  ILE  45          3HG2      ILE  45  15.024  -7.764  -8.516
  356   1HD1  ILE  45          1HD1      ILE  45  11.918  -7.973 -11.299
  357   2HD1  ILE  45          2HD1      ILE  45  11.468  -9.661 -11.532
  358   3HD1  ILE  45          3HD1      ILE  45  13.168  -9.217 -11.366
  359    H    LYS  46           H        LYS  46  12.319  -5.923  -6.707
  360    HA   LYS  46           HA       LYS  46  15.012  -5.268  -6.092
  361   1HB   LYS  46          2HB       LYS  46  12.412  -3.785  -6.035
  362   2HB   LYS  46          1HB       LYS  46  13.871  -3.062  -5.384
  363   1HG   LYS  46          2HG       LYS  46  14.972  -3.284  -7.537
  364   2HG   LYS  46          1HG       LYS  46  13.536  -4.067  -8.201
  365   1HD   LYS  46          2HD       LYS  46  12.251  -2.077  -7.985
  366   2HD   LYS  46          1HD       LYS  46  13.506  -1.299  -7.018
  367   1HE   LYS  46          2HE       LYS  46  13.530  -0.435  -9.290
  368   2HE   LYS  46          1HE       LYS  46  15.010  -1.330  -8.953
  369   1HZ   LYS  46          1HZ       LYS  46  13.818  -3.281 -10.045
  370   2HZ   LYS  46          2HZ       LYS  46  14.368  -2.041 -11.054
  371   3HZ   LYS  46          3HZ       LYS  46  12.721  -2.132 -10.647
  372    H    TYR  47           H        TYR  47  12.122  -5.781  -4.109
  373    HA   TYR  47           HA       TYR  47  13.688  -5.087  -1.736
  374   1HB   TYR  47          2HB       TYR  47  10.711  -5.418  -2.115
  375   2HB   TYR  47          1HB       TYR  47  11.484  -5.026  -0.583
  376    HD1  TYR  47           1HD      TYR  47  10.503  -3.765  -3.862
  377    HD2  TYR  47           2HD      TYR  47  12.539  -2.827  -0.247
  378    HE1  TYR  47           1HE      TYR  47  10.460  -1.382  -4.462
  379    HE2  TYR  47           2HE      TYR  47  12.493  -0.441  -0.836
  380    HH   TYR  47           HH       TYR  47  12.314   0.960  -2.832
  381    H    GLY  48           H        GLY  48  12.087  -7.804  -3.239
  382   1HA   GLY  48          2HA       GLY  48  12.863  -9.469  -0.923
  383   2HA   GLY  48          1HA       GLY  48  11.527  -9.841  -2.003
  384    H    SER  49           H        SER  49  14.979  -9.057  -2.332
  385    HA   SER  49           HA       SER  49  15.245 -10.539  -4.736
  386   1HB   SER  49          2HB       SER  49  17.476  -9.650  -2.906
  387   2HB   SER  49          1HB       SER  49  17.553  -9.923  -4.646
  388    HG   SER  49           HG       SER  49  15.805  -8.175  -4.638
  389    H    ASN  50           H        ASN  50  15.504 -11.365  -1.386
  390    HA   ASN  50           HA       ASN  50  17.302 -13.524  -1.564
  391   1HB   ASN  50          2HB       ASN  50  15.126 -12.887   0.428
  392   2HB   ASN  50          1HB       ASN  50  16.227 -14.253   0.611
  393   1HD2  ASN  50          1HD2      ASN  50  18.359 -13.894   1.141
  394   2HD2  ASN  50          2HD2      ASN  50  18.948 -12.341   1.655
  395    H    HIS  51           H        HIS  51  13.736 -13.607  -1.290
  396    HA   HIS  51           HA       HIS  51  12.186 -15.081  -2.084
  397   1HB   HIS  51          2HB       HIS  51  13.351 -14.458  -4.230
  398   2HB   HIS  51          1HB       HIS  51  14.319 -15.913  -4.066
  399    HD1  HIS  51           1HD      HIS  51  10.622 -14.987  -4.294
  400    HD2  HIS  51           2HD      HIS  51  13.250 -18.040  -5.342
  401    HE1  HIS  51           1HE      HIS  51   9.259 -16.635  -5.621
  402    HE2  HIS  51           2HE      HIS  51  10.919 -18.369  -6.410
  403    H    ASN  52           H        ASN  52  14.100 -15.824  -0.039
  404    HA   ASN  52           HA       ASN  52  14.790 -18.587  -0.419
  405   1HB   ASN  52          2HB       ASN  52  16.304 -17.124   0.816
  406   2HB   ASN  52          1HB       ASN  52  15.044 -16.771   1.988
  407   1HD2  ASN  52          1HD2      ASN  52  17.253 -19.185   0.791
  408   2HD2  ASN  52          2HD2      ASN  52  17.173 -20.216   2.180
  409    H    VAL  53           H        VAL  53  12.687 -19.356  -0.782
  410    HA   VAL  53           HA       VAL  53  10.672 -19.293   1.220
  411    HB   VAL  53           HB       VAL  53   9.596 -21.132  -0.094
  412   1HG1  VAL  53          1HG1      VAL  53  10.511 -18.726  -1.672
  413   2HG1  VAL  53          2HG1      VAL  53   9.131 -18.788  -0.578
  414   3HG1  VAL  53          3HG1      VAL  53   9.125 -19.746  -2.056
  415   1HG2  VAL  53          1HG2      VAL  53  10.556 -21.751  -2.260
  416   2HG2  VAL  53          2HG2      VAL  53  11.620 -22.219  -0.933
  417   3HG2  VAL  53          3HG2      VAL  53  11.994 -20.793  -1.900
  418    H    GLN  54           H        GLN  54  13.237 -21.572   0.440
  419    HA   GLN  54           HA       GLN  54  12.350 -23.392   2.527
  420   1HB   GLN  54          2HB       GLN  54  14.606 -23.518   0.528
  421   2HB   GLN  54          1HB       GLN  54  14.382 -24.719   1.792
  422   1HG   GLN  54          2HG       GLN  54  12.364 -24.049  -0.336
  423   2HG   GLN  54          1HG       GLN  54  13.465 -25.425  -0.374
  424   1HE2  GLN  54          1HE2      GLN  54  10.609 -24.075   1.043
  425   2HE2  GLN  54          2HE2      GLN  54  10.087 -25.507   1.856
  426    H    GLY  55           H        GLY  55  13.227 -23.539   4.507
  427   1HA   GLY  55          2HA       GLY  55  14.731 -21.278   5.409
  428   2HA   GLY  55          1HA       GLY  55  14.168 -22.616   6.396
  429    H    THR  56           H        THR  56  15.925 -23.735   3.763
  430    HA   THR  56           HA       THR  56  18.056 -24.392   3.373
  431    HB   THR  56           HB       THR  56  19.008 -22.919   5.779
  432    HG1  THR  56           1HG      THR  56  17.616 -21.678   4.163
  433   1HG2  THR  56          1HG2      THR  56  21.051 -22.655   4.432
  434   2HG2  THR  56          2HG2      THR  56  20.284 -23.555   3.125
  435   3HG2  THR  56          3HG2      THR  56  20.631 -24.354   4.657
  436    H    THR  57           H        THR  57  18.399 -26.403   3.690
  437    HA   THR  57           HA       THR  57  18.149 -27.599   6.348
  438    HB   THR  57           HB       THR  57  18.436 -29.005   3.677
  439    HG1  THR  57           1HG      THR  57  16.194 -27.970   5.054
  440   1HG2  THR  57          1HG2      THR  57  18.990 -30.374   5.643
  441   2HG2  THR  57          2HG2      THR  57  17.501 -30.923   4.876
  442   3HG2  THR  57          3HG2      THR  57  17.431 -29.974   6.360
  443    HA   PRO  58           HA       PRO  58  22.623 -27.672   6.530
  444   1HB   PRO  58          2HB       PRO  58  22.832 -29.062   8.846
  445   2HB   PRO  58          1HB       PRO  58  22.393 -27.351   8.790
  446   1HG   PRO  58          2HG       PRO  58  20.628 -29.751   9.088
  447   2HG   PRO  58          1HG       PRO  58  20.568 -28.202   9.950
  448   1HD   PRO  58          2HD       PRO  58  18.918 -28.791   7.881
  449   2HD   PRO  58          1HD       PRO  58  19.474 -27.141   8.224
  450    H    SER  59           H        SER  59  24.332 -29.207   6.427
  451    HA   SER  59           HA       SER  59  23.759 -31.439   4.799
  452   1HB   SER  59          2HB       SER  59  26.325 -30.805   6.271
  453   2HB   SER  59          1HB       SER  59  26.153 -31.859   4.866
  454    HG   SER  59           HG       SER  59  25.585 -30.083   3.624
  455    H    ALA  60           H        ALA  60  24.034 -31.076   8.226
  456    HA   ALA  60           HA       ALA  60  24.770 -33.668   8.970
  457   1HB   ALA  60          1HB       ALA  60  22.984 -31.760  10.460
  458   2HB   ALA  60          2HB       ALA  60  24.747 -31.783  10.516
  459   3HB   ALA  60          3HB       ALA  60  23.827 -33.150  11.142
  460    H    ALA  61           H        ALA  61  21.802 -32.522   7.675
  461    HA   ALA  61           HA       ALA  61  20.234 -34.695   8.753
  462   1HB   ALA  61          1HB       ALA  61  19.197 -32.506   8.436
  463   2HB   ALA  61          2HB       ALA  61  18.379 -33.742   7.482
  464   3HB   ALA  61          3HB       ALA  61  19.489 -32.618   6.700
  465    H    VAL  62           H        VAL  62  22.411 -34.441   6.302
  466    HA   VAL  62           HA       VAL  62  21.077 -36.081   4.341
  467    HB   VAL  62           HB       VAL  62  23.991 -35.279   4.507
  468   1HG1  VAL  62          1HG1      VAL  62  23.695 -37.274   3.156
  469   2HG1  VAL  62          2HG1      VAL  62  24.073 -35.895   2.122
  470   3HG1  VAL  62          3HG1      VAL  62  22.414 -36.487   2.235
  471   1HG2  VAL  62          1HG2      VAL  62  21.714 -34.089   2.922
  472   2HG2  VAL  62          2HG2      VAL  62  23.411 -33.630   2.771
  473   3HG2  VAL  62          3HG2      VAL  62  22.548 -33.338   4.283
  474    H    SER  63           H        SER  63  23.562 -36.473   6.786
  475    HA   SER  63           HA       SER  63  24.089 -39.210   6.214
  476   1HB   SER  63          2HB       SER  63  24.595 -37.660   8.767
  477   2HB   SER  63          1HB       SER  63  25.345 -39.187   8.306
  478    HG   SER  63           HG       SER  63  25.952 -37.809   6.315
  479    H    GLU  64           H        GLU  64  21.876 -37.503   8.343
  480    HA   GLU  64           HA       GLU  64  21.002 -39.792   9.773
  481   1HB   GLU  64          2HB       GLU  64  20.714 -37.567  10.702
  482   2HB   GLU  64          1HB       GLU  64  19.700 -37.102   9.345
  483   1HG   GLU  64          2HG       GLU  64  17.979 -38.638  10.047
  484   2HG   GLU  64          1HG       GLU  64  19.010 -39.251  11.336
  485    H    ALA  65           H        ALA  65  19.973 -38.185   6.856
  486    HA   ALA  65           HA       ALA  65  17.542 -39.461   6.405
  487   1HB   ALA  65          1HB       ALA  65  17.830 -38.875   4.061
  488   2HB   ALA  65          2HB       ALA  65  19.541 -38.545   4.337
  489   3HB   ALA  65          3HB       ALA  65  18.311 -37.535   5.102
  490    H    GLU  66           H        GLU  66  20.835 -40.521   5.762
  491    HA   GLU  66           HA       GLU  66  20.304 -42.803   4.234
  492   1HB   GLU  66          2HB       GLU  66  22.573 -41.919   4.625
  493   2HB   GLU  66          1HB       GLU  66  22.463 -42.385   6.316
  494   1HG   GLU  66          2HG       GLU  66  21.979 -44.759   5.237
  495   2HG   GLU  66          1HG       GLU  66  22.900 -44.058   3.908
  496    H    GLN  67           H        GLN  67  20.534 -42.371   7.735
  497    HA   GLN  67           HA       GLN  67  20.010 -45.082   8.402
  498   1HB   GLN  67          2HB       GLN  67  19.731 -42.572  10.076
  499   2HB   GLN  67          1HB       GLN  67  19.787 -44.219  10.693
  500   1HG   GLN  67          2HG       GLN  67  22.037 -44.487  10.101
  501   2HG   GLN  67          1HG       GLN  67  22.017 -43.071   9.052
  502   1HE2  GLN  67          1HE2      GLN  67  23.763 -42.148  10.080
  503   2HE2  GLN  67          2HE2      GLN  67  23.653 -41.454  11.661
  504    H    ILE  68           H        ILE  68  18.049 -42.221   7.958
  505    HA   ILE  68           HA       ILE  68  15.592 -43.235   8.872
  506    HB   ILE  68           HB       ILE  68  16.232 -41.139   6.786
  507   1HG1  ILE  68          2HG1      ILE  68  16.921 -40.567   9.042
  508   2HG1  ILE  68          1HG1      ILE  68  15.545 -39.573   8.568
  509   1HG2  ILE  68          1HG2      ILE  68  14.026 -42.038   6.298
  510   2HG2  ILE  68          2HG2      ILE  68  13.896 -40.409   6.963
  511   3HG2  ILE  68          3HG2      ILE  68  13.545 -41.808   7.978
  512   1HD1  ILE  68          1HD1      ILE  68  14.067 -41.007   9.884
  513   2HD1  ILE  68          2HD1      ILE  68  15.354 -40.316  10.871
  514   3HD1  ILE  68          3HD1      ILE  68  15.448 -42.000  10.353
  515    H    ARG  69           H        ARG  69  17.180 -43.435   5.706
  516    HA   ARG  69           HA       ARG  69  15.063 -44.692   4.333
  517   1HB   ARG  69          2HB       ARG  69  18.026 -45.035   3.839
  518   2HB   ARG  69          1HB       ARG  69  16.738 -45.410   2.706
  519   1HG   ARG  69          2HG       ARG  69  16.132 -43.032   2.631
  520   2HG   ARG  69          1HG       ARG  69  17.469 -42.675   3.729
  521   1HD   ARG  69          2HD       ARG  69  18.973 -43.798   2.017
  522   2HD   ARG  69          1HD       ARG  69  17.598 -43.734   0.916
  523    HE   ARG  69           HE       ARG  69  18.866 -41.345   2.104
  524   1HH1  ARG  69          1HH1      ARG  69  17.220 -42.950  -0.528
  525   2HH1  ARG  69          2HH1      ARG  69  17.379 -41.608  -1.620
  526   1HH2  ARG  69          1HH2      ARG  69  19.082 -39.585   0.696
  527   2HH2  ARG  69          2HH2      ARG  69  18.459 -39.685  -0.925
  528    H    GLN  70           H        GLN  70  17.636 -45.932   6.363
  529    HA   GLN  70           HA       GLN  70  17.261 -48.677   5.869
  530   1HB   GLN  70          2HB       GLN  70  19.080 -47.226   7.207
  531   2HB   GLN  70          1HB       GLN  70  18.097 -47.748   8.564
  532   1HG   GLN  70          2HG       GLN  70  19.500 -49.513   6.579
  533   2HG   GLN  70          1HG       GLN  70  19.955 -49.226   8.255
  534   1HE2  GLN  70          1HE2      GLN  70  18.696 -50.127   9.914
  535   2HE2  GLN  70          2HE2      GLN  70  17.632 -51.459   9.604
  536    H    LEU  71           H        LEU  71  16.031 -46.537   8.433
  537    HA   LEU  71           HA       LEU  71  14.527 -48.535   9.750
  538   1HB   LEU  71          2HB       LEU  71  14.821 -45.594   9.912
  539   2HB   LEU  71          1HB       LEU  71  13.369 -46.279  10.597
  540    HG   LEU  71           HG       LEU  71  15.040 -45.991  12.326
  541   1HD1  LEU  71          1HD1      LEU  71  13.546 -47.899  12.527
  542   2HD1  LEU  71          2HD1      LEU  71  15.135 -48.268  13.201
  543   3HD1  LEU  71          3HD1      LEU  71  14.678 -48.897  11.617
  544   1HD2  LEU  71          1HD2      LEU  71  17.039 -46.078  10.929
  545   2HD2  LEU  71          2HD2      LEU  71  16.790 -47.804  10.669
  546   3HD2  LEU  71          3HD2      LEU  71  17.158 -47.201  12.285
  547    H    LYS  72           H        LYS  72  13.852 -46.435   7.074
  548    HA   LYS  72           HA       LYS  72  11.038 -46.466   7.150
  549   1HB   LYS  72          2HB       LYS  72  12.409 -44.925   5.765
  550   2HB   LYS  72          1HB       LYS  72  12.823 -46.273   4.715
  551   1HG   LYS  72          2HG       LYS  72  11.080 -44.947   3.716
  552   2HG   LYS  72          1HG       LYS  72  10.449 -46.538   4.146
  553   1HD   LYS  72          2HD       LYS  72   9.528 -45.541   6.234
  554   2HD   LYS  72          1HD       LYS  72  10.053 -43.957   5.659
  555   1HE   LYS  72          2HE       LYS  72   7.709 -44.274   5.162
  556   2HE   LYS  72          1HE       LYS  72   8.641 -44.238   3.664
  557   1HZ   LYS  72          1HZ       LYS  72   7.627 -46.674   5.035
  558   2HZ   LYS  72          2HZ       LYS  72   8.565 -46.668   3.622
  559   3HZ   LYS  72          3HZ       LYS  72   7.011 -46.001   3.608
  560    H    LYS  73           H        LYS  73  13.224 -48.988   6.436
  561    HA   LYS  73           HA       LYS  73  11.513 -50.469   4.668
  562   1HB   LYS  73          2HB       LYS  73  14.124 -50.890   5.993
  563   2HB   LYS  73          1HB       LYS  73  13.205 -52.344   5.626
  564   1HG   LYS  73          2HG       LYS  73  13.189 -51.865   3.312
  565   2HG   LYS  73          1HG       LYS  73  13.767 -50.222   3.579
  566   1HD   LYS  73          2HD       LYS  73  15.432 -52.546   4.453
  567   2HD   LYS  73          1HD       LYS  73  15.414 -52.059   2.756
  568   1HE   LYS  73          2HE       LYS  73  16.060 -50.243   5.077
  569   2HE   LYS  73          1HE       LYS  73  17.251 -51.013   4.031
  570   1HZ   LYS  73          1HZ       LYS  73  15.213 -48.999   3.227
  571   2HZ   LYS  73          2HZ       LYS  73  16.194 -49.844   2.137
  572   3HZ   LYS  73          3HZ       LYS  73  16.899 -48.793   3.263
  573    H    GLU  74           H        GLU  74  11.076 -52.893   5.417
  574    HA   GLU  74           HA       GLU  74   8.991 -52.675   7.311
  575   1HB   GLU  74          2HB       GLU  74  10.296 -55.103   6.073
  576   2HB   GLU  74          1HB       GLU  74   8.881 -55.183   7.113
  577   1HG   GLU  74          2HG       GLU  74   7.706 -53.689   5.480
  578   2HG   GLU  74          1HG       GLU  74   9.104 -53.868   4.420
  579    H    ASN  75           H        ASN  75   9.032 -52.761   9.433
  580    HA   ASN  75           HA       ASN  75  11.370 -53.977  10.734
  581   1HB   ASN  75          2HB       ASN  75  11.114 -52.299  12.533
  582   2HB   ASN  75          1HB       ASN  75  11.464 -51.564  10.974
  583   1HD2  ASN  75          1HD2      ASN  75   9.944 -50.288   9.994
  584   2HD2  ASN  75          2HD2      ASN  75   8.509 -49.755  10.801
  585    H    ALA  76           H        ALA  76  10.580 -53.867  13.328
  586    HA   ALA  76           HA       ALA  76   9.241 -56.287  13.554
  587   1HB   ALA  76          1HB       ALA  76  10.825 -55.453  15.205
  588   2HB   ALA  76          2HB       ALA  76   9.295 -55.911  15.952
  589   3HB   ALA  76          3HB       ALA  76   9.670 -54.210  15.686
  590    H    LEU  77           H        LEU  77   7.885 -53.080  13.489
  591    HA   LEU  77           HA       LEU  77   5.574 -53.479  14.988
  592   1HB   LEU  77          2HB       LEU  77   6.095 -51.677  12.631
  593   2HB   LEU  77          1HB       LEU  77   4.632 -51.618  13.585
  594    HG   LEU  77           HG       LEU  77   7.413 -51.094  14.635
  595   1HD1  LEU  77          1HD1      LEU  77   6.644 -49.327  13.148
  596   2HD1  LEU  77          2HD1      LEU  77   6.653 -48.771  14.821
  597   3HD1  LEU  77          3HD1      LEU  77   5.131 -49.212  14.046
  598   1HD2  LEU  77          1HD2      LEU  77   4.717 -50.848  15.964
  599   2HD2  LEU  77          2HD2      LEU  77   6.258 -50.355  16.664
  600   3HD2  LEU  77          3HD2      LEU  77   5.946 -52.058  16.329
  601    H    GLN  78           H        GLN  78   6.252 -54.309  11.640
  602    HA   GLN  78           HA       GLN  78   3.507 -54.993  11.064
  603   1HB   GLN  78          2HB       GLN  78   4.941 -54.113   9.291
  604   2HB   GLN  78          1HB       GLN  78   6.051 -55.460   9.491
  605   1HG   GLN  78          2HG       GLN  78   4.676 -55.782   7.541
  606   2HG   GLN  78          1HG       GLN  78   4.302 -57.003   8.755
  607   1HE2  GLN  78          1HE2      GLN  78   2.299 -57.409   7.873
  608   2HE2  GLN  78          2HE2      GLN  78   0.972 -56.310   8.016
  609    H    ARG  79           H        ARG  79   6.333 -56.590  12.261
  610    HA   ARG  79           HA       ARG  79   5.444 -59.245  11.545
  611   1HB   ARG  79          2HB       ARG  79   7.800 -58.150  13.052
  612   2HB   ARG  79          1HB       ARG  79   7.418 -59.861  13.137
  613   1HG   ARG  79          2HG       ARG  79   9.101 -59.482  11.464
  614   2HG   ARG  79          1HG       ARG  79   7.608 -60.008  10.688
  615   1HD   ARG  79          2HD       ARG  79   7.099 -57.736  10.047
  616   2HD   ARG  79          1HD       ARG  79   8.510 -57.142  10.921
  617    HE   ARG  79           HE       ARG  79   9.814 -58.586   9.272
  618   1HH1  ARG  79          1HH1      ARG  79   6.757 -57.054   8.488
  619   2HH1  ARG  79          2HH1      ARG  79   7.117 -56.906   6.790
  620   1HH2  ARG  79          1HH2      ARG  79  10.290 -58.392   7.057
  621   2HH2  ARG  79          2HH2      ARG  79   9.131 -57.672   5.985
  622    H    ALA  80           H        ALA  80   4.840 -57.074  14.039
  623    HA   ALA  80           HA       ALA  80   4.714 -58.717  16.298
  624   1HB   ALA  80          1HB       ALA  80   3.137 -56.214  15.739
  625   2HB   ALA  80          2HB       ALA  80   4.768 -56.276  16.407
  626   3HB   ALA  80          3HB       ALA  80   3.416 -56.943  17.322
  627    H    ARG  81           H        ARG  81   2.569 -58.490  13.629
  628    HA   ARG  81           HA       ARG  81   0.209 -59.377  14.941
  629   1HB   ARG  81          2HB       ARG  81   1.070 -59.363  12.066
  630   2HB   ARG  81          1HB       ARG  81  -0.445 -60.095  12.563
  631   1HG   ARG  81          2HG       ARG  81  -1.067 -57.881  13.573
  632   2HG   ARG  81          1HG       ARG  81   0.362 -57.209  12.781
  633   1HD   ARG  81          2HD       ARG  81  -1.722 -56.907  11.463
  634   2HD   ARG  81          1HD       ARG  81  -0.480 -57.832  10.614
  635    HE   ARG  81           HE       ARG  81  -2.571 -59.290  12.073
  636   1HH1  ARG  81          1HH1      ARG  81  -1.164 -58.315   9.025
  637   2HH1  ARG  81          2HH1      ARG  81  -1.976 -59.543   8.102
  638   1HH2  ARG  81          1HH2      ARG  81  -3.666 -60.888  10.878
  639   2HH2  ARG  81          2HH2      ARG  81  -3.447 -60.992   9.155
  640    H    THR  82           H        THR  82   3.015 -60.954  13.804
  641    HA   THR  82           HA       THR  82   1.719 -63.577  13.934
  642    HB   THR  82           HB       THR  82   4.412 -62.949  12.724
  643    HG1  THR  82           1HG      THR  82   1.822 -63.070  11.536
  644   1HG2  THR  82          1HG2      THR  82   2.560 -65.314  12.380
  645   2HG2  THR  82          2HG2      THR  82   4.027 -65.300  13.357
  646   3HG2  THR  82          3HG2      THR  82   4.132 -65.100  11.608
  647    H    ARG  83           H        ARG  83   5.104 -62.763  14.324
  648    HA   ARG  83           HA       ARG  83   5.067 -64.085  16.947
  649   1HB   ARG  83          2HB       ARG  83   6.471 -65.131  15.152
  650   2HB   ARG  83          1HB       ARG  83   7.432 -63.660  15.109
  651   1HG   ARG  83          2HG       ARG  83   8.151 -64.004  17.378
  652   2HG   ARG  83          1HG       ARG  83   7.083 -65.400  17.540
  653   1HD   ARG  83          2HD       ARG  83   8.342 -66.506  15.717
  654   2HD   ARG  83          1HD       ARG  83   9.460 -65.142  15.704
  655    HE   ARG  83           HE       ARG  83   9.685 -65.829  18.223
  656   1HH1  ARG  83          1HH1      ARG  83   9.347 -67.966  15.467
  657   2HH1  ARG  83          2HH1      ARG  83  10.329 -69.227  16.159
  658   1HH2  ARG  83          1HH2      ARG  83  10.940 -67.505  19.163
  659   2HH2  ARG  83          2HH2      ARG  83  11.208 -68.972  18.266
  660    H    HIS  84           H        HIS  84   6.023 -63.054  18.703
  661    HA   HIS  84           HA       HIS  84   6.061 -60.150  18.370
  662   1HB   HIS  84          2HB       HIS  84   5.874 -61.879  20.842
  663   2HB   HIS  84          1HB       HIS  84   5.904 -60.121  20.866
  664    HD1  HIS  84           1HD      HIS  84   3.503 -60.726  22.119
  665    HD2  HIS  84           2HD      HIS  84   3.723 -61.169  17.987
  666    HE1  HIS  84           1HE      HIS  84   1.117 -60.744  21.307
  667    HE2  HIS  84           2HE      HIS  84   1.274 -61.167  18.820
  668    HA   PRO  85           HA       PRO  85  10.486 -60.246  19.208
  669   1HB   PRO  85          2HB       PRO  85  11.151 -58.382  17.391
  670   2HB   PRO  85          1HB       PRO  85  10.786 -60.044  16.915
  671   1HG   PRO  85          2HG       PRO  85   9.214 -57.594  16.500
  672   2HG   PRO  85          1HG       PRO  85   9.111 -59.147  15.658
  673   1HD   PRO  85          2HD       PRO  85   7.472 -58.145  17.837
  674   2HD   PRO  85          1HD       PRO  85   7.263 -59.623  16.878
  675    H    ALA  86           H        ALA  86  11.972 -58.083  19.318
  676    HA   ALA  86           HA       ALA  86  12.546 -56.363  20.688
  677   1HB   ALA  86          1HB       ALA  86  11.218 -54.337  20.430
  678   2HB   ALA  86          2HB       ALA  86   9.902 -55.279  19.727
  679   3HB   ALA  86          3HB       ALA  86  11.447 -55.148  18.883
  680    H    GLU  87           H        GLU  87  12.202 -57.938  22.468
  681    HA   GLU  87           HA       GLU  87   9.858 -58.182  23.939
  682   1HB   GLU  87          2HB       GLU  87  11.847 -59.663  24.074
  683   2HB   GLU  87          1HB       GLU  87  12.696 -58.404  24.955
  684   1HG   GLU  87          2HG       GLU  87  11.228 -58.609  26.817
  685   2HG   GLU  87          1HG       GLU  87  10.144 -59.670  25.919
  686    H    SER  88           H        SER  88  12.234 -55.641  24.017
  687    HA   SER  88           HA       SER  88  11.266 -54.536  26.513
  688   1HB   SER  88          2HB       SER  88  13.203 -53.308  24.538
  689   2HB   SER  88          1HB       SER  88  12.995 -52.880  26.238
  690    HG   SER  88           HG       SER  88  13.951 -54.740  26.853
  691    H    CYS  89           H        CYS  89  11.284 -53.592  23.084
  692    HA   CYS  89           HA       CYS  89   9.923 -51.146  23.480
  693   1HB   CYS  89          2HB       CYS  89  11.376 -51.689  21.526
  694   2HB   CYS  89          1HB       CYS  89  10.120 -52.777  20.944
  695    HG   CYS  89           HG       CYS  89  10.419 -50.039  19.747
  696    H    LEU  90           H        LEU  90   8.853 -54.397  22.869
  697    HA   LEU  90           HA       LEU  90   6.221 -53.833  22.025
  698   1HB   LEU  90          2HB       LEU  90   7.277 -56.004  21.688
  699   2HB   LEU  90          1HB       LEU  90   7.333 -56.266  23.419
  700    HG   LEU  90           HG       LEU  90   4.844 -56.243  23.451
  701   1HD1  LEU  90          1HD1      LEU  90   4.443 -54.946  21.437
  702   2HD1  LEU  90          2HD1      LEU  90   3.654 -56.518  21.328
  703   3HD1  LEU  90          3HD1      LEU  90   5.156 -56.227  20.453
  704   1HD2  LEU  90          1HD2      LEU  90   6.152 -58.277  21.657
  705   2HD2  LEU  90          2HD2      LEU  90   4.594 -58.471  22.459
  706   3HD2  LEU  90          3HD2      LEU  90   6.066 -58.333  23.419
  707    H    GLU  91           H        GLU  91   7.641 -54.229  25.208
  708    HA   GLU  91           HA       GLU  91   5.233 -54.463  26.667
  709   1HB   GLU  91          2HB       GLU  91   7.644 -54.982  27.407
  710   2HB   GLU  91          1HB       GLU  91   7.775 -53.262  27.746
  711   1HG   GLU  91          2HG       GLU  91   7.221 -54.242  29.789
  712   2HG   GLU  91          1HG       GLU  91   5.716 -53.541  29.195
  713    H    HIS  92           H        HIS  92   7.244 -51.722  25.746
  714    HA   HIS  92           HA       HIS  92   6.874 -49.492  25.620
  715   1HB   HIS  92          2HB       HIS  92   3.998 -50.361  25.911
  716   2HB   HIS  92          1HB       HIS  92   4.466 -48.674  25.719
  717    HD1  HIS  92           1HD      HIS  92   3.966 -51.816  23.850
  718    HD2  HIS  92           2HD      HIS  92   5.586 -48.052  23.168
  719    HE1  HIS  92           1HE      HIS  92   4.167 -51.614  21.356
  720    HE2  HIS  92           2HE      HIS  92   5.382 -49.433  20.989
  721    H    HIS  93           H        HIS  93   6.033 -47.562  26.894
  722    HA   HIS  93           HA       HIS  93   6.047 -48.213  29.778
  723   1HB   HIS  93          2HB       HIS  93   7.183 -45.776  28.383
  724   2HB   HIS  93          1HB       HIS  93   7.097 -45.979  30.125
  725    HD1  HIS  93           1HD      HIS  93   9.800 -45.461  29.074
  726    HD2  HIS  93           2HD      HIS  93   8.235 -49.312  29.271
  727    HE1  HIS  93           1HE      HIS  93  11.789 -47.005  29.050
  728    HE2  HIS  93           2HE      HIS  93  10.823 -49.318  29.340
  729    H    HIS  94           H        HIS  94   4.058 -47.914  30.577
  730    HA   HIS  94           HA       HIS  94   2.374 -45.778  29.518
  731   1HB   HIS  94          2HB       HIS  94   1.858 -47.931  31.578
  732   2HB   HIS  94          1HB       HIS  94   0.692 -46.674  31.179
  733    HD1  HIS  94           1HD      HIS  94   0.658 -49.942  30.672
  734    HD2  HIS  94           2HD      HIS  94   0.948 -46.856  27.887
  735    HE1  HIS  94           1HE      HIS  94  -0.169 -50.903  28.499
  736    HE2  HIS  94           2HE      HIS  94  -0.129 -48.981  26.866
  737    H    HIS  95           H        HIS  95   1.193 -44.432  31.226
  738    HA   HIS  95           HA       HIS  95   1.231 -42.874  32.882
  739   1HB   HIS  95          2HB       HIS  95   3.561 -44.484  33.945
  740   2HB   HIS  95          1HB       HIS  95   2.957 -43.032  34.731
  741    HD1  HIS  95           1HD      HIS  95   1.422 -43.524  36.588
  742    HD2  HIS  95           2HD      HIS  95   1.251 -46.443  33.624
  743    HE1  HIS  95           1HE      HIS  95  -0.208 -45.252  37.423
  744    HE2  HIS  95           2HE      HIS  95  -0.201 -47.072  35.677
  745    H    HIS  96           H        HIS  96   1.658 -41.022  31.909
  746    HA   HIS  96           HA       HIS  96   4.412 -40.140  31.619
  747   1HB   HIS  96          2HB       HIS  96   3.736 -41.349  29.475
  748   2HB   HIS  96          1HB       HIS  96   2.548 -40.074  29.236
  749    HD1  HIS  96           1HD      HIS  96   3.364 -37.901  28.210
  750    HD2  HIS  96           2HD      HIS  96   6.450 -40.475  29.291
  751    HE1  HIS  96           1HE      HIS  96   5.452 -36.899  27.242
  752    HE2  HIS  96           2HE      HIS  96   7.263 -38.595  27.708
  753    H    HIS  97           H        HIS  97   4.580 -37.874  31.592
  754    HA   HIS  97           HA       HIS  97   2.120 -36.461  32.302
  755   1HB   HIS  97          2HB       HIS  97   5.028 -35.631  32.394
  756   2HB   HIS  97          1HB       HIS  97   3.696 -34.552  32.782
  757    HD1  HIS  97           1HD      HIS  97   2.007 -35.873  34.716
  758    HD2  HIS  97           2HD      HIS  97   6.107 -36.575  34.659
  759    HE1  HIS  97           1HE      HIS  97   2.586 -36.709  37.013
  760    HE2  HIS  97           2HE      HIS  97   5.099 -36.842  37.020
  Start of MODEL    7
    1   1H    MET   1          1HT       MET   1  -4.297  15.428  -5.443
    2   2H    MET   1          2HT       MET   1  -4.823  14.837  -3.945
    3   3H    MET   1          3HT       MET   1  -3.778  13.904  -4.907
    4    HA   MET   1           HA       MET   1  -3.132  16.483  -3.605
    5   1HB   MET   1          2HB       MET   1  -2.056  13.693  -3.124
    6   2HB   MET   1          1HB       MET   1  -1.528  15.155  -2.305
    7   1HG   MET   1          2HG       MET   1  -3.741  15.403  -1.313
    8   2HG   MET   1          1HG       MET   1  -4.277  13.942  -2.142
    9   1HE   MET   1          1HE       MET   1  -4.118  12.645   1.516
   10   2HE   MET   1          2HE       MET   1  -5.078  12.754   0.039
   11   3HE   MET   1          3HE       MET   1  -4.689  14.214   0.944
   12    HA   PRO   2           HA       PRO   2   0.110  16.896  -6.651
   13   1HB   PRO   2          2HB       PRO   2   1.798  17.932  -4.458
   14   2HB   PRO   2          1HB       PRO   2   1.306  18.720  -5.960
   15   1HG   PRO   2          2HG       PRO   2   0.270  19.454  -3.604
   16   2HG   PRO   2          1HG       PRO   2  -0.712  19.437  -5.080
   17   1HD   PRO   2          2HD       PRO   2  -0.626  17.456  -2.836
   18   2HD   PRO   2          1HD       PRO   2  -2.023  18.074  -3.743
   19    H    THR   3           H        THR   3   0.672  15.494  -3.535
   20    HA   THR   3           HA       THR   3   2.967  13.962  -4.491
   21    HB   THR   3           HB       THR   3   3.025  13.179  -2.065
   22    HG1  THR   3           1HG      THR   3   0.898  13.759  -1.497
   23   1HG2  THR   3          1HG2      THR   3   4.042  15.265  -1.264
   24   2HG2  THR   3          2HG2      THR   3   3.327  16.136  -2.622
   25   3HG2  THR   3          3HG2      THR   3   4.545  14.893  -2.912
   26    H    LYS   4           H        LYS   4   2.643  11.997  -5.303
   27    HA   LYS   4           HA       LYS   4   0.374  10.427  -4.304
   28   1HB   LYS   4          2HB       LYS   4   0.388   9.321  -6.555
   29   2HB   LYS   4          1HB       LYS   4  -0.113  11.000  -6.561
   30   1HG   LYS   4          2HG       LYS   4   1.252  10.903  -8.403
   31   2HG   LYS   4          1HG       LYS   4   2.371  11.463  -7.163
   32   1HD   LYS   4          2HD       LYS   4   3.366   9.707  -8.558
   33   2HD   LYS   4          1HD       LYS   4   3.222   9.198  -6.876
   34   1HE   LYS   4          2HE       LYS   4   2.567   7.391  -8.355
   35   2HE   LYS   4          1HE       LYS   4   1.175   7.963  -7.437
   36   1HZ   LYS   4          1HZ       LYS   4   0.530   9.288  -9.402
   37   2HZ   LYS   4          2HZ       LYS   4   0.536   7.626  -9.699
   38   3HZ   LYS   4          3HZ       LYS   4   1.805   8.586 -10.274
   39    H    THR   5           H        THR   5   3.309  10.672  -3.597
   40    HA   THR   5           HA       THR   5   4.619   8.286  -4.358
   41    HB   THR   5           HB       THR   5   5.316   9.643  -1.804
   42    HG1  THR   5           1HG      THR   5   6.170  11.422  -2.926
   43   1HG2  THR   5          1HG2      THR   5   7.585   9.411  -2.708
   44   2HG2  THR   5          2HG2      THR   5   6.920   8.768  -4.208
   45   3HG2  THR   5          3HG2      THR   5   6.732   7.866  -2.704
   46    H    TYR   6           H        TYR   6   5.152   6.505  -3.002
   47    HA   TYR   6           HA       TYR   6   3.110   5.918  -0.972
   48   1HB   TYR   6          2HB       TYR   6   3.627   3.474  -1.592
   49   2HB   TYR   6          1HB       TYR   6   2.675   4.415  -2.730
   50    HD1  TYR   6           1HD      TYR   6   6.235   3.439  -2.071
   51    HD2  TYR   6           2HD      TYR   6   3.264   4.391  -4.971
   52    HE1  TYR   6           1HE      TYR   6   7.812   2.871  -3.870
   53    HE2  TYR   6           2HE      TYR   6   4.839   3.825  -6.775
   54    HH   TYR   6           HH       TYR   6   7.258   3.637  -7.141
   55    H    SER   7           H        SER   7   3.785   4.560   0.809
   56    HA   SER   7           HA       SER   7   6.490   5.170   1.653
   57   1HB   SER   7          2HB       SER   7   4.281   3.681   3.097
   58   2HB   SER   7          1HB       SER   7   5.783   4.264   3.817
   59    HG   SER   7           HG       SER   7   4.412   6.216   2.482
   60    H    GLU   8           H        GLU   8   7.885   3.453   2.591
   61    HA   GLU   8           HA       GLU   8   8.239   1.450   0.614
   62   1HB   GLU   8          2HB       GLU   8  10.114   0.656   2.134
   63   2HB   GLU   8          1HB       GLU   8  10.232   2.294   1.519
   64   1HG   GLU   8          2HG       GLU   8  10.870   2.530   3.713
   65   2HG   GLU   8          1HG       GLU   8   9.168   2.977   3.762
   66    H    GLU   9           H        GLU   9   6.698   1.466   3.723
   67    HA   GLU   9           HA       GLU   9   6.589  -1.263   4.291
   68   1HB   GLU   9          2HB       GLU   9   5.803   0.460   5.844
   69   2HB   GLU   9          1HB       GLU   9   4.486   0.860   4.758
   70   1HG   GLU   9          2HG       GLU   9   3.460  -1.280   5.119
   71   2HG   GLU   9          1HG       GLU   9   4.840  -1.820   6.076
   72    H    PHE  10           H        PHE  10   4.640   0.718   2.155
   73    HA   PHE  10           HA       PHE  10   2.610  -1.081   1.521
   74   1HB   PHE  10          2HB       PHE  10   2.748   1.370   0.933
   75   2HB   PHE  10          1HB       PHE  10   3.846   0.930  -0.367
   76    HD1  PHE  10           1HD      PHE  10   3.016   0.286  -2.449
   77    HD2  PHE  10           2HD      PHE  10   0.419   0.365   0.923
   78    HE1  PHE  10           1HE      PHE  10   1.088  -0.082  -3.927
   79    HE2  PHE  10           2HE      PHE  10  -1.509  -0.019  -0.553
   80    HZ   PHE  10           HZ       PHE  10  -1.174  -0.240  -2.978
   81    H    LYS  11           H        LYS  11   5.701  -0.520  -0.138
   82    HA   LYS  11           HA       LYS  11   5.385  -2.575  -2.077
   83   1HB   LYS  11          2HB       LYS  11   8.023  -1.531  -1.052
   84   2HB   LYS  11          1HB       LYS  11   7.648  -2.144  -2.656
   85   1HG   LYS  11          2HG       LYS  11   6.460  -0.200  -3.233
   86   2HG   LYS  11          1HG       LYS  11   6.402   0.355  -1.560
   87   1HD   LYS  11          2HD       LYS  11   8.070   1.661  -2.604
   88   2HD   LYS  11          1HD       LYS  11   8.935   0.452  -1.657
   89   1HE   LYS  11          2HE       LYS  11   9.219  -0.904  -3.693
   90   2HE   LYS  11          1HE       LYS  11   8.422   0.367  -4.623
   91   1HZ   LYS  11          1HZ       LYS  11  10.751   0.663  -4.845
   92   2HZ   LYS  11          2HZ       LYS  11  11.002   0.548  -3.172
   93   3HZ   LYS  11          3HZ       LYS  11  10.200   1.896  -3.812
   94    H    ARG  12           H        ARG  12   6.990  -2.356   1.040
   95    HA   ARG  12           HA       ARG  12   8.329  -4.824   1.016
   96   1HB   ARG  12          2HB       ARG  12   8.563  -2.744   2.550
   97   2HB   ARG  12          1HB       ARG  12   7.306  -3.501   3.516
   98   1HG   ARG  12          2HG       ARG  12   8.693  -5.390   3.964
   99   2HG   ARG  12          1HG       ARG  12   9.909  -4.828   2.811
  100   1HD   ARG  12          2HD       ARG  12  10.154  -2.767   4.214
  101   2HD   ARG  12          1HD       ARG  12   9.116  -3.534   5.416
  102    HE   ARG  12           HE       ARG  12  10.951  -5.381   5.255
  103   1HH1  ARG  12          1HH1      ARG  12  11.428  -1.904   5.149
  104   2HH1  ARG  12          2HH1      ARG  12  13.009  -1.975   5.861
  105   1HH2  ARG  12          1HH2      ARG  12  13.052  -5.472   6.171
  106   2HH2  ARG  12          2HH2      ARG  12  13.932  -3.993   6.432
  107    H    ASP  13           H        ASP  13   5.129  -3.900   2.150
  108    HA   ASP  13           HA       ASP  13   4.454  -6.457   3.217
  109   1HB   ASP  13          2HB       ASP  13   3.333  -4.451   4.003
  110   2HB   ASP  13          1HB       ASP  13   2.732  -4.115   2.384
  111    H    ALA  14           H        ALA  14   4.003  -4.866   0.112
  112    HA   ALA  14           HA       ALA  14   2.208  -6.680  -1.036
  113   1HB   ALA  14          1HB       ALA  14   2.726  -4.479  -1.986
  114   2HB   ALA  14          2HB       ALA  14   2.895  -5.770  -3.174
  115   3HB   ALA  14          3HB       ALA  14   4.329  -5.058  -2.433
  116    H    VAL  15           H        VAL  15   5.730  -6.745  -0.782
  117    HA   VAL  15           HA       VAL  15   6.164  -8.992  -2.439
  118    HB   VAL  15           HB       VAL  15   7.790  -8.154  -0.029
  119   1HG1  VAL  15          1HG1      VAL  15   8.289 -10.423  -0.800
  120   2HG1  VAL  15          2HG1      VAL  15   9.633  -9.324  -1.104
  121   3HG1  VAL  15          3HG1      VAL  15   8.571  -9.804  -2.428
  122   1HG2  VAL  15          1HG2      VAL  15   9.214  -6.974  -1.659
  123   2HG2  VAL  15          2HG2      VAL  15   7.584  -6.307  -1.574
  124   3HG2  VAL  15          3HG2      VAL  15   8.042  -7.348  -2.922
  125    H    ALA  16           H        ALA  16   5.497  -8.669   1.020
  126    HA   ALA  16           HA       ALA  16   5.713 -11.438   1.622
  127   1HB   ALA  16          1HB       ALA  16   4.641 -10.871   3.740
  128   2HB   ALA  16          2HB       ALA  16   4.209  -9.284   3.103
  129   3HB   ALA  16          3HB       ALA  16   5.904  -9.708   3.345
  130    H    LEU  17           H        LEU  17   3.072  -9.339   0.657
  131    HA   LEU  17           HA       LEU  17   0.940 -11.137   0.985
  132   1HB   LEU  17          2HB       LEU  17   0.805  -8.670   0.529
  133   2HB   LEU  17          1HB       LEU  17   1.219  -9.012  -1.136
  134    HG   LEU  17           HG       LEU  17  -0.841 -10.305  -1.405
  135   1HD1  LEU  17          1HD1      LEU  17  -1.415  -9.481   1.438
  136   2HD1  LEU  17          2HD1      LEU  17  -1.089 -11.120   0.872
  137   3HD1  LEU  17          3HD1      LEU  17  -2.549 -10.280   0.346
  138   1HD2  LEU  17          1HD2      LEU  17  -1.309  -7.565  -0.230
  139   2HD2  LEU  17          2HD2      LEU  17  -2.409  -8.442  -1.295
  140   3HD2  LEU  17          3HD2      LEU  17  -0.841  -7.907  -1.895
  141    H    TYR  18           H        TYR  18   3.279 -10.690  -1.583
  142    HA   TYR  18           HA       TYR  18   2.049 -12.361  -3.511
  143   1HB   TYR  18          2HB       TYR  18   3.835 -10.696  -4.006
  144   2HB   TYR  18          1HB       TYR  18   4.995 -11.750  -3.206
  145    HD1  TYR  18           1HD      TYR  18   2.390 -11.974  -5.878
  146    HD2  TYR  18           2HD      TYR  18   6.276 -13.102  -4.567
  147    HE1  TYR  18           1HE      TYR  18   2.763 -13.138  -8.009
  148    HE2  TYR  18           2HE      TYR  18   6.658 -14.272  -6.696
  149    HH   TYR  18           HH       TYR  18   5.492 -15.206  -8.538
  150    H    GLU  19           H        GLU  19   4.106 -13.034  -0.760
  151    HA   GLU  19           HA       GLU  19   4.713 -15.727  -1.445
  152   1HB   GLU  19          2HB       GLU  19   4.620 -14.290   1.207
  153   2HB   GLU  19          1HB       GLU  19   5.114 -15.970   1.045
  154   1HG   GLU  19          2HG       GLU  19   6.442 -13.661  -0.355
  155   2HG   GLU  19          1HG       GLU  19   6.996 -14.367   1.163
  156    H    ASN  20           H        ASN  20   1.889 -14.164  -0.409
  157    HA   ASN  20           HA       ASN  20   0.629 -16.652   0.501
  158   1HB   ASN  20          2HB       ASN  20  -0.154 -13.745   0.742
  159   2HB   ASN  20          1HB       ASN  20  -1.263 -15.053   1.129
  160   1HD2  ASN  20          1HD2      ASN  20   1.687 -13.427   2.043
  161   2HD2  ASN  20          2HD2      ASN  20   1.791 -14.096   3.638
  162    H    SER  21           H        SER  21   1.320 -15.935  -2.299
  163    HA   SER  21           HA       SER  21  -1.019 -15.212  -3.716
  164   1HB   SER  21          2HB       SER  21   0.288 -16.169  -5.693
  165   2HB   SER  21          1HB       SER  21   1.031 -14.840  -4.808
  166    HG   SER  21           HG       SER  21   2.568 -16.115  -4.123
  167    H    ASP  22           H        ASP  22  -0.082 -18.105  -2.256
  168    HA   ASP  22           HA       ASP  22  -1.277 -20.040  -3.889
  169   1HB   ASP  22          2HB       ASP  22  -0.994 -20.028  -0.873
  170   2HB   ASP  22          1HB       ASP  22  -1.399 -21.438  -1.848
  171    H    GLY  23           H        GLY  23  -2.709 -17.546  -2.081
  172   1HA   GLY  23          2HA       GLY  23  -5.353 -18.749  -2.592
  173   2HA   GLY  23          1HA       GLY  23  -5.022 -17.901  -1.089
  174    H    ALA  24           H        ALA  24  -3.536 -16.714  -3.951
  175    HA   ALA  24           HA       ALA  24  -5.583 -14.870  -4.701
  176   1HB   ALA  24          1HB       ALA  24  -4.932 -13.811  -2.602
  177   2HB   ALA  24          2HB       ALA  24  -4.457 -12.815  -3.977
  178   3HB   ALA  24          3HB       ALA  24  -3.250 -13.779  -3.130
  179    H    SER  25           H        SER  25  -5.279 -14.635  -6.805
  180    HA   SER  25           HA       SER  25  -2.908 -15.419  -8.121
  181   1HB   SER  25          2HB       SER  25  -5.221 -13.765  -9.161
  182   2HB   SER  25          1HB       SER  25  -4.020 -14.596 -10.153
  183    HG   SER  25           HG       SER  25  -4.742 -16.572  -9.132
  184    H    LEU  26           H        LEU  26  -1.469 -14.148  -9.396
  185    HA   LEU  26           HA       LEU  26  -0.287 -12.007  -8.078
  186   1HB   LEU  26          2HB       LEU  26   0.616 -13.557  -9.936
  187   2HB   LEU  26          1HB       LEU  26  -0.091 -12.411 -11.055
  188    HG   LEU  26           HG       LEU  26   1.960 -11.603  -8.989
  189   1HD1  LEU  26          1HD1      LEU  26   2.938 -13.308 -10.407
  190   2HD1  LEU  26          2HD1      LEU  26   3.608 -11.722 -10.796
  191   3HD1  LEU  26          3HD1      LEU  26   2.391 -12.451 -11.846
  192   1HD2  LEU  26          1HD2      LEU  26   2.297  -9.694 -10.472
  193   2HD2  LEU  26          2HD2      LEU  26   0.617  -9.786  -9.944
  194   3HD2  LEU  26          3HD2      LEU  26   1.057 -10.315 -11.567
  195    H    GLN  27           H        GLN  27  -2.489 -11.956 -10.884
  196    HA   GLN  27           HA       GLN  27  -2.545  -9.182 -11.237
  197   1HB   GLN  27          2HB       GLN  27  -3.489 -10.682 -12.904
  198   2HB   GLN  27          1HB       GLN  27  -4.730 -11.204 -11.770
  199   1HG   GLN  27          2HG       GLN  27  -5.653  -9.621 -13.356
  200   2HG   GLN  27          1HG       GLN  27  -5.647  -8.936 -11.734
  201   1HE2  GLN  27          1HE2      GLN  27  -4.288  -7.234 -11.257
  202   2HE2  GLN  27          2HE2      GLN  27  -3.500  -6.308 -12.488
  203    H    GLN  28           H        GLN  28  -4.485 -11.269  -9.144
  204    HA   GLN  28           HA       GLN  28  -6.360  -9.368  -8.305
  205   1HB   GLN  28          2HB       GLN  28  -6.616 -11.770  -7.890
  206   2HB   GLN  28          1HB       GLN  28  -5.250 -11.736  -6.785
  207   1HG   GLN  28          2HG       GLN  28  -7.345 -11.780  -5.572
  208   2HG   GLN  28          1HG       GLN  28  -6.491 -10.264  -5.286
  209   1HE2  GLN  28          1HE2      GLN  28  -7.317  -8.351  -6.142
  210   2HE2  GLN  28          2HE2      GLN  28  -8.943  -8.236  -6.719
  211    H    ILE  29           H        ILE  29  -3.140 -10.135  -7.092
  212    HA   ILE  29           HA       ILE  29  -3.206  -8.515  -4.791
  213    HB   ILE  29           HB       ILE  29  -0.784  -9.175  -6.474
  214   1HG1  ILE  29          2HG1      ILE  29  -1.949 -11.221  -5.825
  215   2HG1  ILE  29          1HG1      ILE  29  -0.451 -11.060  -4.910
  216   1HG2  ILE  29          1HG2      ILE  29  -1.005  -8.380  -3.574
  217   2HG2  ILE  29          2HG2      ILE  29  -0.388  -7.374  -4.885
  218   3HG2  ILE  29          3HG2      ILE  29   0.476  -8.837  -4.414
  219   1HD1  ILE  29          1HD1      ILE  29  -3.222 -10.431  -3.912
  220   2HD1  ILE  29          2HD1      ILE  29  -1.730 -10.254  -2.987
  221   3HD1  ILE  29          3HD1      ILE  29  -2.263 -11.855  -3.505
  222    H    ALA  30           H        ALA  30  -1.784  -7.849  -7.986
  223    HA   ALA  30           HA       ALA  30  -1.178  -5.141  -7.444
  224   1HB   ALA  30          1HB       ALA  30  -0.769  -4.928  -9.821
  225   2HB   ALA  30          2HB       ALA  30  -1.620  -6.442 -10.129
  226   3HB   ALA  30          3HB       ALA  30  -0.103  -6.450  -9.231
  227    H    ASN  31           H        ASN  31  -4.039  -6.738  -8.566
  228    HA   ASN  31           HA       ASN  31  -5.417  -4.539  -9.670
  229   1HB   ASN  31          2HB       ASN  31  -6.010  -6.965  -9.940
  230   2HB   ASN  31          1HB       ASN  31  -6.610  -6.949  -8.285
  231   1HD2  ASN  31          1HD2      ASN  31  -7.196  -6.027 -11.554
  232   2HD2  ASN  31          2HD2      ASN  31  -8.823  -5.488 -11.328
  233    H    ASP  32           H        ASP  32  -5.276  -5.873  -6.399
  234    HA   ASP  32           HA       ASP  32  -7.236  -4.163  -5.271
  235   1HB   ASP  32          2HB       ASP  32  -6.403  -6.322  -4.263
  236   2HB   ASP  32          1HB       ASP  32  -4.920  -5.475  -3.833
  237    H    LEU  33           H        LEU  33  -3.752  -3.967  -5.635
  238    HA   LEU  33           HA       LEU  33  -3.454  -1.559  -4.133
  239   1HB   LEU  33          2HB       LEU  33  -1.693  -3.168  -5.938
  240   2HB   LEU  33          1HB       LEU  33  -1.202  -1.554  -5.468
  241    HG   LEU  33           HG       LEU  33  -1.217  -2.206  -3.111
  242   1HD1  LEU  33          1HD1      LEU  33  -1.918  -4.973  -4.082
  243   2HD1  LEU  33          2HD1      LEU  33  -3.001  -3.892  -3.204
  244   3HD1  LEU  33          3HD1      LEU  33  -1.545  -4.507  -2.420
  245   1HD2  LEU  33          1HD2      LEU  33   0.825  -2.493  -4.403
  246   2HD2  LEU  33          2HD2      LEU  33   0.322  -4.125  -4.847
  247   3HD2  LEU  33          3HD2      LEU  33   0.676  -3.741  -3.163
  248    H    GLY  34           H        GLY  34  -4.211  -2.335  -7.420
  249   1HA   GLY  34          2HA       GLY  34  -5.214  -0.885  -8.955
  250   2HA   GLY  34          1HA       GLY  34  -4.740   0.474  -7.950
  251    H    ILE  35           H        ILE  35  -2.375  -1.915  -8.790
  252    HA   ILE  35           HA       ILE  35  -1.142   0.012 -10.657
  253    HB   ILE  35           HB       ILE  35   1.055  -0.895  -9.944
  254   1HG1  ILE  35          2HG1      ILE  35  -0.524  -2.213  -7.729
  255   2HG1  ILE  35          1HG1      ILE  35   0.190  -3.071  -9.085
  256   1HG2  ILE  35          1HG2      ILE  35  -0.629   0.292  -7.747
  257   2HG2  ILE  35          2HG2      ILE  35   0.230   1.185  -9.003
  258   3HG2  ILE  35          3HG2      ILE  35   1.132   0.279  -7.788
  259   1HD1  ILE  35          1HD1      ILE  35   2.413  -2.411  -8.354
  260   2HD1  ILE  35          2HD1      ILE  35   1.546  -3.259  -7.071
  261   3HD1  ILE  35          3HD1      ILE  35   1.706  -1.504  -7.016
  262    H    ASN  36           H        ASN  36   0.554  -1.128 -12.071
  263    HA   ASN  36           HA       ASN  36  -0.679  -3.263 -13.488
  264   1HB   ASN  36          2HB       ASN  36   0.812  -1.476 -14.477
  265   2HB   ASN  36          1HB       ASN  36   2.172  -2.290 -13.723
  266   1HD2  ASN  36          1HD2      ASN  36  -0.303  -2.490 -16.149
  267   2HD2  ASN  36          2HD2      ASN  36   0.421  -3.781 -17.046
  268    H    ARG  37           H        ARG  37   0.117  -5.408 -13.743
  269    HA   ARG  37           HA       ARG  37   0.906  -6.631 -11.343
  270   1HB   ARG  37          2HB       ARG  37   0.912  -8.678 -12.590
  271   2HB   ARG  37          1HB       ARG  37  -0.446  -7.715 -13.124
  272   1HG   ARG  37          2HG       ARG  37   0.735  -7.087 -15.128
  273   2HG   ARG  37          1HG       ARG  37   2.183  -7.927 -14.571
  274   1HD   ARG  37          2HD       ARG  37   0.857 -10.042 -14.547
  275   2HD   ARG  37          1HD       ARG  37  -0.475  -9.152 -15.286
  276    HE   ARG  37           HE       ARG  37   1.406  -8.625 -17.041
  277   1HH1  ARG  37          1HH1      ARG  37   0.633 -11.671 -15.476
  278   2HH1  ARG  37          2HH1      ARG  37   1.312 -12.641 -16.752
  279   1HH2  ARG  37          1HH2      ARG  37   2.272  -9.913 -18.729
  280   2HH2  ARG  37          2HH2      ARG  37   2.235 -11.647 -18.588
  281    H    VAL  38           H        VAL  38   2.690  -5.443 -14.097
  282    HA   VAL  38           HA       VAL  38   5.139  -6.771 -13.471
  283    HB   VAL  38           HB       VAL  38   4.660  -4.308 -15.164
  284   1HG1  VAL  38          1HG1      VAL  38   7.093  -6.086 -14.963
  285   2HG1  VAL  38          2HG1      VAL  38   6.982  -4.415 -14.410
  286   3HG1  VAL  38          3HG1      VAL  38   6.870  -4.786 -16.131
  287   1HG2  VAL  38          1HG2      VAL  38   3.507  -6.318 -15.978
  288   2HG2  VAL  38          2HG2      VAL  38   5.038  -7.197 -15.954
  289   3HG2  VAL  38          3HG2      VAL  38   4.819  -5.836 -17.055
  290    H    THR  39           H        THR  39   3.769  -3.585 -12.751
  291    HA   THR  39           HA       THR  39   5.940  -2.417 -11.457
  292    HB   THR  39           HB       THR  39   3.053  -2.134 -10.594
  293    HG1  THR  39           1HG      THR  39   4.394  -0.597 -12.588
  294   1HG2  THR  39          1HG2      THR  39   4.633  -1.032  -9.109
  295   2HG2  THR  39          2HG2      THR  39   3.750   0.173 -10.047
  296   3HG2  THR  39          3HG2      THR  39   5.409  -0.242 -10.484
  297    H    LEU  40           H        LEU  40   3.404  -4.536 -10.193
  298    HA   LEU  40           HA       LEU  40   4.259  -4.658  -7.524
  299   1HB   LEU  40          2HB       LEU  40   2.073  -5.453  -8.233
  300   2HB   LEU  40          1HB       LEU  40   2.814  -6.696  -9.220
  301    HG   LEU  40           HG       LEU  40   3.743  -7.693  -7.102
  302   1HD1  LEU  40          1HD1      LEU  40   2.668  -7.067  -5.002
  303   2HD1  LEU  40          2HD1      LEU  40   1.813  -5.763  -5.827
  304   3HD1  LEU  40          3HD1      LEU  40   3.571  -5.716  -5.689
  305   1HD2  LEU  40          1HD2      LEU  40   1.817  -8.640  -8.227
  306   2HD2  LEU  40          2HD2      LEU  40   0.751  -7.505  -7.396
  307   3HD2  LEU  40          3HD2      LEU  40   1.615  -8.739  -6.477
  308    H    LYS  41           H        LYS  41   4.888  -6.847 -10.247
  309    HA   LYS  41           HA       LYS  41   6.521  -8.695  -8.958
  310   1HB   LYS  41          2HB       LYS  41   5.501  -8.870 -11.243
  311   2HB   LYS  41          1HB       LYS  41   6.750  -7.789 -11.828
  312   1HG   LYS  41          2HG       LYS  41   8.463  -9.391 -11.333
  313   2HG   LYS  41          1HG       LYS  41   7.299 -10.447 -10.529
  314   1HD   LYS  41          2HD       LYS  41   6.119 -10.764 -12.638
  315   2HD   LYS  41          1HD       LYS  41   7.255  -9.688 -13.447
  316   1HE   LYS  41          2HE       LYS  41   9.072 -11.215 -13.036
  317   2HE   LYS  41          1HE       LYS  41   8.028 -12.256 -12.067
  318   1HZ   LYS  41          1HZ       LYS  41   6.787 -12.859 -13.970
  319   2HZ   LYS  41          2HZ       LYS  41   8.415 -13.006 -14.413
  320   3HZ   LYS  41          3HZ       LYS  41   7.515 -11.667 -14.929
  321    H    ASN  42           H        ASN  42   7.370  -5.729 -10.655
  322    HA   ASN  42           HA       ASN  42  10.145  -5.899 -10.493
  323   1HB   ASN  42          2HB       ASN  42   8.236  -3.604 -10.718
  324   2HB   ASN  42          1HB       ASN  42   9.956  -3.292 -10.512
  325   1HD2  ASN  42          1HD2      ASN  42   9.980  -2.326 -12.574
  326   2HD2  ASN  42          2HD2      ASN  42   9.987  -3.285 -14.016
  327    H    TRP  43           H        TRP  43   7.847  -4.692  -8.064
  328    HA   TRP  43           HA       TRP  43   9.847  -3.809  -6.231
  329   1HB   TRP  43          2HB       TRP  43   6.988  -4.698  -5.772
  330   2HB   TRP  43          1HB       TRP  43   8.022  -4.073  -4.497
  331    HD1  TRP  43           HD       TRP  43   9.153  -1.768  -6.781
  332    HE1  TRP  43           1HE      TRP  43   7.672   0.329  -7.012
  333    HE3  TRP  43           3HE      TRP  43   4.856  -3.574  -4.679
  334    HZ2  TRP  43           2HZ      TRP  43   5.036   1.109  -6.375
  335    HZ3  TRP  43           3HZ      TRP  43   2.908  -2.084  -4.517
  336    HH2  TRP  43           HH       TRP  43   2.998   0.207  -5.346
  337    H    ILE  44           H        ILE  44   8.021  -6.793  -6.599
  338    HA   ILE  44           HA       ILE  44   8.923  -8.156  -4.340
  339    HB   ILE  44           HB       ILE  44   8.127  -9.345  -7.001
  340   1HG1  ILE  44          2HG1      ILE  44   6.387  -8.872  -4.581
  341   2HG1  ILE  44          1HG1      ILE  44   6.498  -7.727  -5.912
  342   1HG2  ILE  44          1HG2      ILE  44   9.237 -10.961  -5.541
  343   2HG2  ILE  44          2HG2      ILE  44   7.519 -11.329  -5.702
  344   3HG2  ILE  44          3HG2      ILE  44   8.121 -10.554  -4.237
  345   1HD1  ILE  44          1HD1      ILE  44   5.527 -10.566  -6.073
  346   2HD1  ILE  44          2HD1      ILE  44   5.690  -9.467  -7.442
  347   3HD1  ILE  44          3HD1      ILE  44   4.542  -9.105  -6.151
  348    H    ILE  45           H        ILE  45  10.171  -8.270  -7.673
  349    HA   ILE  45           HA       ILE  45  12.185 -10.169  -7.227
  350    HB   ILE  45           HB       ILE  45  12.161  -7.916  -9.242
  351   1HG1  ILE  45          2HG1      ILE  45  11.288 -10.799  -9.526
  352   2HG1  ILE  45          1HG1      ILE  45  10.194  -9.428  -9.366
  353   1HG2  ILE  45          1HG2      ILE  45  13.770 -10.473  -9.211
  354   2HG2  ILE  45          2HG2      ILE  45  14.399  -8.840  -8.981
  355   3HG2  ILE  45          3HG2      ILE  45  13.711  -9.310 -10.536
  356   1HD1  ILE  45          1HD1      ILE  45  11.026  -8.524 -11.475
  357   2HD1  ILE  45          2HD1      ILE  45  10.394 -10.159 -11.675
  358   3HD1  ILE  45          3HD1      ILE  45  12.136  -9.888 -11.622
  359    H    LYS  46           H        LYS  46  12.128  -6.711  -6.655
  360    HA   LYS  46           HA       LYS  46  14.998  -6.544  -6.381
  361   1HB   LYS  46          2HB       LYS  46  13.550  -4.715  -7.333
  362   2HB   LYS  46          1HB       LYS  46  12.951  -4.433  -5.705
  363   1HG   LYS  46          2HG       LYS  46  15.163  -3.847  -4.946
  364   2HG   LYS  46          1HG       LYS  46  15.838  -4.233  -6.532
  365   1HD   LYS  46          2HD       LYS  46  14.332  -2.473  -7.495
  366   2HD   LYS  46          1HD       LYS  46  13.918  -2.014  -5.842
  367   1HE   LYS  46          2HE       LYS  46  15.664  -0.569  -6.726
  368   2HE   LYS  46          1HE       LYS  46  16.275  -1.535  -5.385
  369   1HZ   LYS  46          1HZ       LYS  46  17.808  -1.400  -7.304
  370   2HZ   LYS  46          2HZ       LYS  46  16.666  -2.225  -8.247
  371   3HZ   LYS  46          3HZ       LYS  46  17.370  -2.991  -6.916
  372    H    TYR  47           H        TYR  47  12.187  -6.382  -4.226
  373    HA   TYR  47           HA       TYR  47  13.902  -5.973  -1.927
  374   1HB   TYR  47          2HB       TYR  47  10.918  -6.110  -2.277
  375   2HB   TYR  47          1HB       TYR  47  11.664  -6.062  -0.682
  376    HD1  TYR  47           1HD      TYR  47  11.252  -4.174  -3.850
  377    HD2  TYR  47           2HD      TYR  47  12.483  -4.035   0.220
  378    HE1  TYR  47           1HE      TYR  47  11.377  -1.723  -3.979
  379    HE2  TYR  47           2HE      TYR  47  12.607  -1.581   0.104
  380    HH   TYR  47           HH       TYR  47  12.869   0.170  -1.558
  381    H    GLY  48           H        GLY  48  12.143  -8.614  -3.388
  382   1HA   GLY  48          2HA       GLY  48  12.726 -10.284  -1.031
  383   2HA   GLY  48          1HA       GLY  48  11.529 -10.647  -2.264
  384    H    SER  49           H        SER  49  14.721  -9.533  -3.091
  385    HA   SER  49           HA       SER  49  15.211 -11.916  -4.629
  386   1HB   SER  49          2HB       SER  49  15.855  -9.622  -5.405
  387   2HB   SER  49          1HB       SER  49  17.050  -9.559  -4.112
  388    HG   SER  49           HG       SER  49  17.062 -11.003  -6.493
  389    H    ASN  50           H        ASN  50  16.344 -10.465  -1.653
  390    HA   ASN  50           HA       ASN  50  17.664 -11.157   0.033
  391   1HB   ASN  50          2HB       ASN  50  16.082 -13.058   0.104
  392   2HB   ASN  50          1HB       ASN  50  17.121 -13.950  -1.004
  393   1HD2  ASN  50          1HD2      ASN  50  17.499 -15.601   0.466
  394   2HD2  ASN  50          2HD2      ASN  50  18.500 -15.384   1.866
  395    H    HIS  51           H        HIS  51  18.782 -13.986  -1.680
  396    HA   HIS  51           HA       HIS  51  21.118 -12.656  -2.748
  397   1HB   HIS  51          2HB       HIS  51  21.353 -14.616  -0.463
  398   2HB   HIS  51          1HB       HIS  51  22.696 -14.187  -1.508
  399    HD1  HIS  51           1HD      HIS  51  23.274 -11.484  -1.481
  400    HD2  HIS  51           2HD      HIS  51  21.115 -13.022   1.733
  401    HE1  HIS  51           1HE      HIS  51  23.532  -9.814   0.377
  402    HE2  HIS  51           2HE      HIS  51  22.186 -10.730   2.290
  403    H    ASN  52           H        ASN  52  20.225 -13.534  -4.678
  404    HA   ASN  52           HA       ASN  52  20.419 -16.456  -4.926
  405   1HB   ASN  52          2HB       ASN  52  18.359 -15.198  -5.768
  406   2HB   ASN  52          1HB       ASN  52  19.391 -14.544  -7.035
  407   1HD2  ASN  52          1HD2      ASN  52  20.231 -15.959  -8.613
  408   2HD2  ASN  52          2HD2      ASN  52  19.514 -17.505  -8.914
  409    H    VAL  53           H        VAL  53  22.829 -15.597  -4.565
  410    HA   VAL  53           HA       VAL  53  24.153 -14.720  -6.947
  411    HB   VAL  53           HB       VAL  53  25.086 -14.115  -4.802
  412   1HG1  VAL  53          1HG1      VAL  53  26.081 -15.727  -3.276
  413   2HG1  VAL  53          2HG1      VAL  53  25.521 -17.048  -4.302
  414   3HG1  VAL  53          3HG1      VAL  53  24.352 -16.012  -3.480
  415   1HG2  VAL  53          1HG2      VAL  53  27.418 -14.816  -5.121
  416   2HG2  VAL  53          2HG2      VAL  53  26.647 -14.319  -6.629
  417   3HG2  VAL  53          3HG2      VAL  53  26.873 -16.032  -6.275
  418    H    GLN  54           H        GLN  54  24.078 -17.779  -5.155
  419    HA   GLN  54           HA       GLN  54  24.828 -19.157  -7.640
  420   1HB   GLN  54          2HB       GLN  54  25.566 -19.575  -4.836
  421   2HB   GLN  54          1HB       GLN  54  25.028 -21.042  -5.634
  422   1HG   GLN  54          2HG       GLN  54  27.395 -20.913  -5.811
  423   2HG   GLN  54          1HG       GLN  54  26.710 -20.630  -7.409
  424   1HE2  GLN  54          1HE2      GLN  54  26.946 -18.614  -8.361
  425   2HE2  GLN  54          2HE2      GLN  54  28.006 -17.396  -7.729
  426    H    GLY  55           H        GLY  55  22.946 -19.627  -8.617
  427   1HA   GLY  55          2HA       GLY  55  21.308 -21.680  -7.628
  428   2HA   GLY  55          1HA       GLY  55  20.506 -20.144  -7.329
  429    H    THR  56           H        THR  56  20.618 -22.628  -9.374
  430    HA   THR  56           HA       THR  56  20.093 -23.087 -11.507
  431    HB   THR  56           HB       THR  56  18.285 -21.674 -12.517
  432    HG1  THR  56           1HG      THR  56  19.113 -19.825 -10.955
  433   1HG2  THR  56          1HG2      THR  56  17.870 -22.634  -9.690
  434   2HG2  THR  56          2HG2      THR  56  17.763 -23.614 -11.152
  435   3HG2  THR  56          3HG2      THR  56  16.590 -22.329 -10.865
  436    H    THR  57           H        THR  57  21.997 -22.913 -12.601
  437    HA   THR  57           HA       THR  57  22.600 -20.328 -13.851
  438    HB   THR  57           HB       THR  57  24.846 -21.551 -14.328
  439    HG1  THR  57           1HG      THR  57  25.284 -23.257 -12.972
  440   1HG2  THR  57          1HG2      THR  57  24.621 -19.665 -12.794
  441   2HG2  THR  57          2HG2      THR  57  25.720 -20.877 -12.136
  442   3HG2  THR  57          3HG2      THR  57  24.072 -20.754 -11.519
  443    HA   PRO  58           HA       PRO  58  20.937 -22.548 -17.468
  444   1HB   PRO  58          2HB       PRO  58  20.983 -19.866 -18.660
  445   2HB   PRO  58          1HB       PRO  58  19.620 -20.961 -18.418
  446   1HG   PRO  58          2HG       PRO  58  19.906 -18.703 -16.974
  447   2HG   PRO  58          1HG       PRO  58  19.191 -20.175 -16.289
  448   1HD   PRO  58          2HD       PRO  58  21.959 -19.078 -15.964
  449   2HD   PRO  58          1HD       PRO  58  20.887 -19.813 -14.750
  450    H    SER  59           H        SER  59  23.672 -20.533 -17.066
  451    HA   SER  59           HA       SER  59  24.711 -20.534 -19.680
  452   1HB   SER  59          2HB       SER  59  26.909 -20.119 -18.329
  453   2HB   SER  59          1HB       SER  59  25.621 -18.911 -18.283
  454    HG   SER  59           HG       SER  59  26.624 -19.697 -16.198
  455    H    ALA  60           H        ALA  60  24.970 -22.822 -17.021
  456    HA   ALA  60           HA       ALA  60  27.119 -24.332 -18.091
  457   1HB   ALA  60          1HB       ALA  60  26.494 -26.027 -16.435
  458   2HB   ALA  60          2HB       ALA  60  24.990 -25.159 -16.121
  459   3HB   ALA  60          3HB       ALA  60  26.539 -24.412 -15.728
  460    H    ALA  61           H        ALA  61  23.700 -24.328 -18.610
  461    HA   ALA  61           HA       ALA  61  23.639 -26.942 -19.823
  462   1HB   ALA  61          1HB       ALA  61  21.712 -26.144 -18.556
  463   2HB   ALA  61          2HB       ALA  61  21.274 -26.488 -20.230
  464   3HB   ALA  61          3HB       ALA  61  21.500 -24.822 -19.705
  465    H    VAL  62           H        VAL  62  24.766 -24.057 -20.855
  466    HA   VAL  62           HA       VAL  62  23.811 -24.172 -23.580
  467    HB   VAL  62           HB       VAL  62  26.026 -22.505 -22.371
  468   1HG1  VAL  62          1HG1      VAL  62  26.254 -22.824 -24.803
  469   2HG1  VAL  62          2HG1      VAL  62  25.900 -21.151 -24.372
  470   3HG1  VAL  62          3HG1      VAL  62  24.626 -22.184 -25.019
  471   1HG2  VAL  62          1HG2      VAL  62  24.397 -20.671 -22.418
  472   2HG2  VAL  62          2HG2      VAL  62  23.844 -21.999 -21.397
  473   3HG2  VAL  62          3HG2      VAL  62  23.167 -21.787 -23.009
  474    H    SER  63           H        SER  63  26.849 -24.739 -21.895
  475    HA   SER  63           HA       SER  63  28.219 -25.695 -24.218
  476   1HB   SER  63          2HB       SER  63  28.981 -26.006 -21.305
  477   2HB   SER  63          1HB       SER  63  30.050 -26.176 -22.697
  478    HG   SER  63           HG       SER  63  29.479 -23.925 -23.175
  479    H    GLU  64           H        GLU  64  26.546 -27.145 -21.488
  480    HA   GLU  64           HA       GLU  64  27.405 -29.803 -21.845
  481   1HB   GLU  64          2HB       GLU  64  26.209 -28.707 -19.848
  482   2HB   GLU  64          1HB       GLU  64  24.724 -29.013 -20.735
  483   1HG   GLU  64          2HG       GLU  64  24.956 -30.794 -19.232
  484   2HG   GLU  64          1HG       GLU  64  25.417 -31.437 -20.805
  485    H    ALA  65           H        ALA  65  25.149 -27.876 -23.541
  486    HA   ALA  65           HA       ALA  65  23.319 -29.789 -24.450
  487   1HB   ALA  65          1HB       ALA  65  22.936 -27.377 -24.582
  488   2HB   ALA  65          2HB       ALA  65  22.707 -28.158 -26.146
  489   3HB   ALA  65          3HB       ALA  65  24.183 -27.248 -25.821
  490    H    GLU  66           H        GLU  66  26.524 -28.957 -25.605
  491    HA   GLU  66           HA       GLU  66  26.281 -30.101 -28.193
  492   1HB   GLU  66          2HB       GLU  66  28.064 -28.466 -27.404
  493   2HB   GLU  66          1HB       GLU  66  28.831 -29.826 -26.603
  494   1HG   GLU  66          2HG       GLU  66  29.917 -29.434 -28.704
  495   2HG   GLU  66          1HG       GLU  66  29.047 -30.966 -28.774
  496    H    GLN  67           H        GLN  67  27.284 -31.346 -25.076
  497    HA   GLN  67           HA       GLN  67  28.132 -33.887 -26.119
  498   1HB   GLN  67          2HB       GLN  67  27.646 -33.022 -23.262
  499   2HB   GLN  67          1HB       GLN  67  28.513 -34.468 -23.775
  500   1HG   GLN  67          2HG       GLN  67  30.240 -33.135 -24.789
  501   2HG   GLN  67          1HG       GLN  67  29.348 -31.654 -24.453
  502   1HE2  GLN  67          1HE2      GLN  67  30.969 -30.745 -23.300
  503   2HE2  GLN  67          2HE2      GLN  67  31.423 -31.294 -21.721
  504    H    ILE  68           H        ILE  68  25.355 -32.652 -24.317
  505    HA   ILE  68           HA       ILE  68  23.910 -35.057 -24.133
  506    HB   ILE  68           HB       ILE  68  23.307 -32.176 -23.855
  507   1HG1  ILE  68          2HG1      ILE  68  22.236 -32.951 -21.787
  508   2HG1  ILE  68          1HG1      ILE  68  22.415 -34.623 -22.308
  509   1HG2  ILE  68          1HG2      ILE  68  20.869 -32.512 -23.780
  510   2HG2  ILE  68          2HG2      ILE  68  21.090 -34.137 -24.433
  511   3HG2  ILE  68          3HG2      ILE  68  21.533 -32.730 -25.400
  512   1HD1  ILE  68          1HD1      ILE  68  24.812 -34.442 -22.163
  513   2HD1  ILE  68          2HD1      ILE  68  24.075 -33.959 -20.635
  514   3HD1  ILE  68          3HD1      ILE  68  24.688 -32.735 -21.749
  515    H    ARG  69           H        ARG  69  24.276 -32.710 -26.671
  516    HA   ARG  69           HA       ARG  69  22.285 -33.369 -28.471
  517   1HB   ARG  69          2HB       ARG  69  23.951 -31.503 -28.598
  518   2HB   ARG  69          1HB       ARG  69  25.160 -32.672 -29.092
  519   1HG   ARG  69          2HG       ARG  69  23.826 -33.150 -31.107
  520   2HG   ARG  69          1HG       ARG  69  22.689 -31.886 -30.613
  521   1HD   ARG  69          2HD       ARG  69  24.620 -30.297 -30.540
  522   2HD   ARG  69          1HD       ARG  69  25.619 -31.563 -31.247
  523    HE   ARG  69           HE       ARG  69  23.258 -30.954 -32.770
  524   1HH1  ARG  69          1HH1      ARG  69  26.602 -30.104 -32.156
  525   2HH1  ARG  69          2HH1      ARG  69  26.802 -29.312 -33.693
  526   1HH2  ARG  69          1HH2      ARG  69  23.524 -29.876 -34.770
  527   2HH2  ARG  69          2HH2      ARG  69  25.077 -29.198 -35.177
  528    H    GLN  70           H        GLN  70  25.354 -34.949 -27.845
  529    HA   GLN  70           HA       GLN  70  25.200 -36.774 -30.040
  530   1HB   GLN  70          2HB       GLN  70  27.272 -35.834 -28.921
  531   2HB   GLN  70          1HB       GLN  70  26.940 -36.913 -27.589
  532   1HG   GLN  70          2HG       GLN  70  27.153 -38.040 -30.323
  533   2HG   GLN  70          1HG       GLN  70  28.613 -37.564 -29.463
  534   1HE2  GLN  70          1HE2      GLN  70  27.796 -40.216 -30.266
  535   2HE2  GLN  70          2HE2      GLN  70  27.684 -41.159 -28.825
  536    H    LEU  71           H        LEU  71  24.822 -36.981 -26.549
  537    HA   LEU  71           HA       LEU  71  24.462 -39.832 -26.610
  538   1HB   LEU  71          2HB       LEU  71  25.679 -38.470 -24.841
  539   2HB   LEU  71          1HB       LEU  71  24.100 -38.010 -24.244
  540    HG   LEU  71           HG       LEU  71  24.854 -40.907 -24.488
  541   1HD1  LEU  71          1HD1      LEU  71  26.626 -39.823 -23.203
  542   2HD1  LEU  71          2HD1      LEU  71  25.626 -40.854 -22.181
  543   3HD1  LEU  71          3HD1      LEU  71  25.416 -39.105 -22.140
  544   1HD2  LEU  71          1HD2      LEU  71  22.503 -40.360 -24.065
  545   2HD2  LEU  71          2HD2      LEU  71  22.976 -39.424 -22.648
  546   3HD2  LEU  71          3HD2      LEU  71  23.236 -41.167 -22.681
  547    H    LYS  72           H        LYS  72  22.337 -37.068 -25.785
  548    HA   LYS  72           HA       LYS  72  20.231 -38.795 -24.916
  549   1HB   LYS  72          2HB       LYS  72  20.633 -36.435 -24.098
  550   2HB   LYS  72          1HB       LYS  72  19.976 -35.873 -25.626
  551   1HG   LYS  72          2HG       LYS  72  17.829 -36.733 -25.138
  552   2HG   LYS  72          1HG       LYS  72  18.438 -37.681 -23.780
  553   1HD   LYS  72          2HD       LYS  72  17.313 -35.782 -22.880
  554   2HD   LYS  72          1HD       LYS  72  19.043 -35.518 -22.664
  555   1HE   LYS  72          2HE       LYS  72  18.218 -33.465 -23.423
  556   2HE   LYS  72          1HE       LYS  72  18.945 -34.210 -24.844
  557   1HZ   LYS  72          1HZ       LYS  72  16.811 -33.223 -25.365
  558   2HZ   LYS  72          2HZ       LYS  72  16.045 -34.174 -24.191
  559   3HZ   LYS  72          3HZ       LYS  72  16.733 -34.907 -25.561
  560    H    LYS  73           H        LYS  73  21.036 -37.210 -27.923
  561    HA   LYS  73           HA       LYS  73  18.883 -38.765 -29.189
  562   1HB   LYS  73          2HB       LYS  73  18.730 -36.096 -29.109
  563   2HB   LYS  73          1HB       LYS  73  19.806 -36.246 -30.492
  564   1HG   LYS  73          2HG       LYS  73  18.156 -37.673 -31.611
  565   2HG   LYS  73          1HG       LYS  73  17.085 -37.505 -30.221
  566   1HD   LYS  73          2HD       LYS  73  17.284 -34.979 -30.621
  567   2HD   LYS  73          1HD       LYS  73  17.929 -35.418 -32.203
  568   1HE   LYS  73          2HE       LYS  73  15.238 -36.203 -31.086
  569   2HE   LYS  73          1HE       LYS  73  15.537 -34.985 -32.322
  570   1HZ   LYS  73          1HZ       LYS  73  16.338 -36.691 -33.802
  571   2HZ   LYS  73          2HZ       LYS  73  14.792 -37.105 -33.246
  572   3HZ   LYS  73          3HZ       LYS  73  16.153 -37.880 -32.606
  573    H    GLU  74           H        GLU  74  19.909 -40.373 -30.171
  574    HA   GLU  74           HA       GLU  74  22.646 -40.543 -30.417
  575   1HB   GLU  74          2HB       GLU  74  22.179 -42.475 -31.993
  576   2HB   GLU  74          1HB       GLU  74  21.458 -42.563 -30.395
  577   1HG   GLU  74          2HG       GLU  74  19.325 -41.793 -31.343
  578   2HG   GLU  74          1HG       GLU  74  20.062 -41.787 -32.946
  579    H    ASN  75           H        ASN  75  23.982 -39.445 -31.546
  580    HA   ASN  75           HA       ASN  75  23.364 -37.894 -33.823
  581   1HB   ASN  75          2HB       ASN  75  25.175 -37.459 -32.164
  582   2HB   ASN  75          1HB       ASN  75  26.081 -38.789 -32.853
  583   1HD2  ASN  75          1HD2      ASN  75  24.837 -35.580 -33.436
  584   2HD2  ASN  75          2HD2      ASN  75  25.876 -35.215 -34.771
  585    H    ALA  76           H        ALA  76  24.128 -41.140 -33.423
  586    HA   ALA  76           HA       ALA  76  25.468 -41.874 -35.724
  587   1HB   ALA  76          1HB       ALA  76  24.962 -43.416 -33.879
  588   2HB   ALA  76          2HB       ALA  76  24.497 -44.077 -35.446
  589   3HB   ALA  76          3HB       ALA  76  23.268 -43.418 -34.369
  590    H    LEU  77           H        LEU  77  22.070 -41.107 -35.310
  591    HA   LEU  77           HA       LEU  77  21.144 -42.004 -37.810
  592   1HB   LEU  77          2HB       LEU  77  20.119 -39.793 -36.023
  593   2HB   LEU  77          1HB       LEU  77  19.259 -40.440 -37.400
  594    HG   LEU  77           HG       LEU  77  19.991 -41.981 -34.914
  595   1HD1  LEU  77          1HD1      LEU  77  17.339 -40.960 -35.913
  596   2HD1  LEU  77          2HD1      LEU  77  18.235 -40.355 -34.520
  597   3HD1  LEU  77          3HD1      LEU  77  17.577 -41.992 -34.504
  598   1HD2  LEU  77          1HD2      LEU  77  18.380 -42.818 -37.323
  599   2HD2  LEU  77          2HD2      LEU  77  18.637 -43.770 -35.861
  600   3HD2  LEU  77          3HD2      LEU  77  19.999 -43.390 -36.913
  601    H    GLN  78           H        GLN  78  22.531 -38.956 -36.735
  602    HA   GLN  78           HA       GLN  78  22.109 -37.500 -39.128
  603   1HB   GLN  78          2HB       GLN  78  22.577 -36.412 -36.987
  604   2HB   GLN  78          1HB       GLN  78  24.165 -37.158 -36.931
  605   1HG   GLN  78          2HG       GLN  78  23.688 -35.568 -39.337
  606   2HG   GLN  78          1HG       GLN  78  23.615 -34.646 -37.835
  607   1HE2  GLN  78          1HE2      GLN  78  25.643 -36.368 -40.040
  608   2HE2  GLN  78          2HE2      GLN  78  27.152 -35.989 -39.281
  609    H    ARG  79           H        ARG  79  24.690 -39.564 -37.944
  610    HA   ARG  79           HA       ARG  79  26.522 -38.953 -40.034
  611   1HB   ARG  79          2HB       ARG  79  26.457 -41.312 -38.149
  612   2HB   ARG  79          1HB       ARG  79  27.828 -40.830 -39.140
  613   1HG   ARG  79          2HG       ARG  79  28.005 -38.740 -37.932
  614   2HG   ARG  79          1HG       ARG  79  26.580 -39.149 -36.979
  615   1HD   ARG  79          2HD       ARG  79  27.820 -41.151 -36.139
  616   2HD   ARG  79          1HD       ARG  79  29.257 -40.534 -36.960
  617    HE   ARG  79           HE       ARG  79  28.203 -38.505 -35.330
  618   1HH1  ARG  79          1HH1      ARG  79  29.831 -41.592 -35.006
  619   2HH1  ARG  79          2HH1      ARG  79  30.535 -41.207 -33.462
  620   1HH2  ARG  79          1HH2      ARG  79  29.129 -37.989 -33.324
  621   2HH2  ARG  79          2HH2      ARG  79  30.137 -39.142 -32.500
  622    H    ALA  80           H        ALA  80  23.863 -41.076 -39.733
  623    HA   ALA  80           HA       ALA  80  24.621 -42.828 -41.883
  624   1HB   ALA  80          1HB       ALA  80  23.147 -43.608 -40.079
  625   2HB   ALA  80          2HB       ALA  80  22.385 -43.763 -41.662
  626   3HB   ALA  80          3HB       ALA  80  21.921 -42.444 -40.589
  627    H    ARG  81           H        ARG  81  22.923 -39.838 -41.543
  628    HA   ARG  81           HA       ARG  81  21.756 -39.949 -44.191
  629   1HB   ARG  81          2HB       ARG  81  21.892 -37.680 -42.203
  630   2HB   ARG  81          1HB       ARG  81  20.966 -37.673 -43.691
  631   1HG   ARG  81          2HG       ARG  81  19.676 -39.618 -42.803
  632   2HG   ARG  81          1HG       ARG  81  20.523 -39.395 -41.271
  633   1HD   ARG  81          2HD       ARG  81  18.462 -38.257 -41.049
  634   2HD   ARG  81          1HD       ARG  81  19.685 -37.012 -41.297
  635    HE   ARG  81           HE       ARG  81  18.046 -37.994 -43.536
  636   1HH1  ARG  81          1HH1      ARG  81  19.278 -35.352 -41.589
  637   2HH1  ARG  81          2HH1      ARG  81  18.466 -34.126 -42.518
  638   1HH2  ARG  81          1HH2      ARG  81  17.015 -36.395 -44.768
  639   2HH2  ARG  81          2HH2      ARG  81  17.209 -34.714 -44.349
  640    H    THR  82           H        THR  82  24.549 -38.732 -42.650
  641    HA   THR  82           HA       THR  82  25.244 -36.935 -44.825
  642    HB   THR  82           HB       THR  82  26.964 -37.550 -42.423
  643    HG1  THR  82           1HG      THR  82  24.716 -36.930 -41.868
  644   1HG2  THR  82          1HG2      THR  82  26.625 -35.061 -44.108
  645   2HG2  THR  82          2HG2      THR  82  27.959 -36.206 -44.229
  646   3HG2  THR  82          3HG2      THR  82  27.746 -35.260 -42.757
  647    H    ARG  83           H        ARG  83  25.364 -40.124 -44.522
  648    HA   ARG  83           HA       ARG  83  26.410 -41.801 -45.572
  649   1HB   ARG  83          2HB       ARG  83  26.425 -40.665 -47.607
  650   2HB   ARG  83          1HB       ARG  83  27.577 -39.462 -47.036
  651   1HG   ARG  83          2HG       ARG  83  29.292 -41.237 -46.944
  652   2HG   ARG  83          1HG       ARG  83  28.129 -42.337 -47.678
  653   1HD   ARG  83          2HD       ARG  83  28.764 -39.733 -48.998
  654   2HD   ARG  83          1HD       ARG  83  29.867 -41.096 -49.169
  655    HE   ARG  83           HE       ARG  83  27.076 -41.636 -49.786
  656   1HH1  ARG  83          1HH1      ARG  83  30.226 -40.701 -50.989
  657   2HH1  ARG  83          2HH1      ARG  83  29.942 -41.311 -52.591
  658   1HH2  ARG  83          1HH2      ARG  83  26.676 -42.411 -51.904
  659   2HH2  ARG  83          2HH2      ARG  83  27.916 -42.284 -53.116
  660    H    HIS  84           H        HIS  84  28.005 -43.157 -45.100
  661    HA   HIS  84           HA       HIS  84  30.236 -42.288 -43.460
  662   1HB   HIS  84          2HB       HIS  84  29.543 -45.021 -44.588
  663   2HB   HIS  84          1HB       HIS  84  30.835 -44.700 -43.439
  664    HD1  HIS  84           1HD      HIS  84  27.070 -44.773 -43.694
  665    HD2  HIS  84           2HD      HIS  84  30.052 -44.576 -40.798
  666    HE1  HIS  84           1HE      HIS  84  25.905 -45.126 -41.497
  667    HE2  HIS  84           2HE      HIS  84  27.757 -45.244 -39.793
  668    HA   PRO  85           HA       PRO  85  32.367 -41.516 -47.327
  669   1HB   PRO  85          2HB       PRO  85  34.546 -40.305 -46.299
  670   2HB   PRO  85          1HB       PRO  85  32.972 -39.503 -46.380
  671   1HG   PRO  85          2HG       PRO  85  34.292 -40.859 -44.060
  672   2HG   PRO  85          1HG       PRO  85  33.406 -39.323 -44.100
  673   1HD   PRO  85          2HD       PRO  85  32.306 -41.660 -43.236
  674   2HD   PRO  85          1HD       PRO  85  31.361 -40.358 -43.986
  675    H    ALA  86           H        ALA  86  34.571 -41.886 -48.214
  676    HA   ALA  86           HA       ALA  86  35.556 -44.502 -47.396
  677   1HB   ALA  86          1HB       ALA  86  36.320 -42.818 -49.785
  678   2HB   ALA  86          2HB       ALA  86  35.080 -44.073 -49.774
  679   3HB   ALA  86          3HB       ALA  86  36.769 -44.500 -49.498
  680    H    GLU  87           H        GLU  87  38.011 -44.782 -47.578
  681    HA   GLU  87           HA       GLU  87  39.247 -43.474 -45.490
  682   1HB   GLU  87          2HB       GLU  87  40.582 -44.800 -47.859
  683   2HB   GLU  87          1HB       GLU  87  41.375 -44.397 -46.345
  684   1HG   GLU  87          2HG       GLU  87  40.901 -46.693 -46.246
  685   2HG   GLU  87          1HG       GLU  87  39.717 -45.909 -45.205
  686    H    SER  88           H        SER  88  39.825 -42.893 -48.960
  687    HA   SER  88           HA       SER  88  41.638 -40.778 -48.600
  688   1HB   SER  88          2HB       SER  88  39.818 -41.231 -50.975
  689   2HB   SER  88          1HB       SER  88  41.356 -40.365 -50.964
  690    HG   SER  88           HG       SER  88  41.056 -42.855 -51.534
  691    H    CYS  89           H        CYS  89  38.132 -40.839 -48.821
  692    HA   CYS  89           HA       CYS  89  37.854 -38.010 -49.131
  693   1HB   CYS  89          2HB       CYS  89  35.755 -39.984 -48.219
  694   2HB   CYS  89          1HB       CYS  89  35.482 -38.393 -48.925
  695    HG   CYS  89           HG       CYS  89  34.911 -40.702 -50.634
  696    H    LEU  90           H        LEU  90  38.004 -40.231 -46.490
  697    HA   LEU  90           HA       LEU  90  36.861 -38.611 -44.486
  698   1HB   LEU  90          2HB       LEU  90  37.136 -41.034 -44.260
  699   2HB   LEU  90          1HB       LEU  90  38.878 -40.842 -44.253
  700    HG   LEU  90           HG       LEU  90  38.701 -39.563 -42.141
  701   1HD1  LEU  90          1HD1      LEU  90  35.796 -40.361 -42.269
  702   2HD1  LEU  90          2HD1      LEU  90  36.431 -38.720 -42.398
  703   3HD1  LEU  90          3HD1      LEU  90  36.601 -39.616 -40.889
  704   1HD2  LEU  90          1HD2      LEU  90  39.167 -41.964 -42.129
  705   2HD2  LEU  90          2HD2      LEU  90  37.436 -42.298 -42.065
  706   3HD2  LEU  90          3HD2      LEU  90  38.226 -41.478 -40.719
  707    H    GLU  91           H        GLU  91  40.163 -38.987 -45.660
  708    HA   GLU  91           HA       GLU  91  41.458 -37.511 -43.663
  709   1HB   GLU  91          2HB       GLU  91  42.578 -38.932 -45.406
  710   2HB   GLU  91          1HB       GLU  91  42.267 -37.653 -46.573
  711   1HG   GLU  91          2HG       GLU  91  43.622 -36.111 -45.254
  712   2HG   GLU  91          1HG       GLU  91  43.924 -37.382 -44.073
  713    H    HIS  92           H        HIS  92  40.092 -36.482 -46.767
  714    HA   HIS  92           HA       HIS  92  39.478 -34.465 -47.606
  715   1HB   HIS  92          2HB       HIS  92  39.152 -33.991 -44.663
  716   2HB   HIS  92          1HB       HIS  92  38.932 -32.666 -45.793
  717    HD1  HIS  92           1HD      HIS  92  36.944 -34.896 -43.997
  718    HD2  HIS  92           2HD      HIS  92  37.022 -33.755 -48.001
  719    HE1  HIS  92           1HE      HIS  92  34.654 -35.411 -44.896
  720    HE2  HIS  92           2HE      HIS  92  34.673 -34.557 -47.272
  721    H    HIS  93           H        HIS  93  39.969 -31.925 -47.251
  722    HA   HIS  93           HA       HIS  93  41.474 -30.240 -47.402
  723   1HB   HIS  93          2HB       HIS  93  41.841 -30.804 -44.994
  724   2HB   HIS  93          1HB       HIS  93  43.159 -31.864 -45.480
  725    HD1  HIS  93           1HD      HIS  93  45.368 -30.748 -46.249
  726    HD2  HIS  93           2HD      HIS  93  42.410 -28.062 -45.084
  727    HE1  HIS  93           1HE      HIS  93  46.528 -28.533 -45.982
  728    HE2  HIS  93           2HE      HIS  93  44.762 -26.983 -45.069
  729    H    HIS  94           H        HIS  94  41.972 -30.548 -49.556
  730    HA   HIS  94           HA       HIS  94  44.677 -31.514 -50.043
  731   1HB   HIS  94          2HB       HIS  94  42.233 -32.663 -51.371
  732   2HB   HIS  94          1HB       HIS  94  43.795 -32.678 -52.180
  733    HD1  HIS  94           1HD      HIS  94  41.764 -34.530 -49.778
  734    HD2  HIS  94           2HD      HIS  94  45.811 -34.191 -50.700
  735    HE1  HIS  94           1HE      HIS  94  42.878 -36.518 -48.705
  736    HE2  HIS  94           2HE      HIS  94  45.334 -36.273 -49.234
  737    H    HIS  95           H        HIS  95  41.879 -30.563 -52.033
  738    HA   HIS  95           HA       HIS  95  41.574 -28.943 -53.589
  739   1HB   HIS  95          2HB       HIS  95  42.284 -27.374 -51.825
  740   2HB   HIS  95          1HB       HIS  95  43.964 -27.607 -52.289
  741    HD1  HIS  95           1HD      HIS  95  44.737 -26.522 -54.538
  742    HD2  HIS  95           2HD      HIS  95  40.836 -25.609 -53.409
  743    HE1  HIS  95           1HE      HIS  95  44.043 -24.592 -55.990
  744    HE2  HIS  95           2HE      HIS  95  41.639 -24.146 -55.389
  745    H    HIS  96           H        HIS  96  42.073 -28.880 -55.721
  746    HA   HIS  96           HA       HIS  96  44.812 -29.686 -56.455
  747   1HB   HIS  96          2HB       HIS  96  44.022 -31.074 -58.233
  748   2HB   HIS  96          1HB       HIS  96  43.157 -31.551 -56.780
  749    HD1  HIS  96           1HD      HIS  96  42.633 -29.739 -60.057
  750    HD2  HIS  96           2HD      HIS  96  40.410 -31.332 -56.923
  751    HE1  HIS  96           1HE      HIS  96  40.244 -29.697 -60.834
  752    HE2  HIS  96           2HE      HIS  96  38.944 -30.844 -59.001
  753    H    HIS  97           H        HIS  97  45.331 -29.178 -58.748
  754    HA   HIS  97           HA       HIS  97  43.859 -26.881 -59.814
  755   1HB   HIS  97          2HB       HIS  97  45.827 -26.050 -58.492
  756   2HB   HIS  97          1HB       HIS  97  46.878 -26.961 -59.568
  757    HD1  HIS  97           1HD      HIS  97  47.680 -25.771 -61.599
  758    HD2  HIS  97           2HD      HIS  97  44.359 -23.926 -59.907
  759    HE1  HIS  97           1HE      HIS  97  47.383 -23.615 -62.857
  760    HE2  HIS  97           2HE      HIS  97  45.506 -22.426 -61.676
  Start of MODEL    8
    1   1H    MET   1          1HT       MET   1   2.972  21.227  -9.658
    2   2H    MET   1          2HT       MET   1   3.361  20.769  -8.073
    3   3H    MET   1          3HT       MET   1   1.817  21.370  -8.423
    4    HA   MET   1           HA       MET   1   1.290  19.469  -9.737
    5   1HB   MET   1          2HB       MET   1   4.110  18.615  -9.056
    6   2HB   MET   1          1HB       MET   1   2.907  17.545  -9.760
    7   1HG   MET   1          2HG       MET   1   2.777  18.958 -11.732
    8   2HG   MET   1          1HG       MET   1   3.949  20.069 -11.023
    9   1HE   MET   1          1HE       MET   1   5.413  19.920 -13.215
   10   2HE   MET   1          2HE       MET   1   4.261  18.799 -13.936
   11   3HE   MET   1          3HE       MET   1   5.981  18.407 -13.921
   12    HA   PRO   2           HA       PRO   2  -0.361  17.935  -6.006
   13   1HB   PRO   2          2HB       PRO   2  -0.631  15.259  -7.220
   14   2HB   PRO   2          1HB       PRO   2  -1.880  16.358  -6.627
   15   1HG   PRO   2          2HG       PRO   2  -1.516  15.951  -9.250
   16   2HG   PRO   2          1HG       PRO   2  -1.973  17.541  -8.612
   17   1HD   PRO   2          2HD       PRO   2   0.704  16.557  -9.516
   18   2HD   PRO   2          1HD       PRO   2  -0.065  18.136  -9.781
   19    H    THR   3           H        THR   3   2.418  16.504  -7.315
   20    HA   THR   3           HA       THR   3   4.192  15.409  -6.438
   21    HB   THR   3           HB       THR   3   2.940  15.679  -3.746
   22    HG1  THR   3           1HG      THR   3   3.313  17.673  -5.277
   23   1HG2  THR   3          1HG2      THR   3   5.802  15.526  -4.663
   24   2HG2  THR   3          2HG2      THR   3   4.916  14.274  -3.793
   25   3HG2  THR   3          3HG2      THR   3   5.292  15.802  -2.996
   26    H    LYS   4           H        LYS   4   4.798  13.283  -5.929
   27    HA   LYS   4           HA       LYS   4   2.601  11.426  -5.383
   28   1HB   LYS   4          2HB       LYS   4   2.864  11.724  -7.860
   29   2HB   LYS   4          1HB       LYS   4   4.492  11.085  -7.712
   30   1HG   LYS   4          2HG       LYS   4   2.847   9.422  -8.485
   31   2HG   LYS   4          1HG       LYS   4   3.658   8.960  -6.988
   32   1HD   LYS   4          2HD       LYS   4   1.749   9.525  -5.684
   33   2HD   LYS   4          1HD       LYS   4   0.966  10.310  -7.056
   34   1HE   LYS   4          2HE       LYS   4   1.658   7.379  -7.032
   35   2HE   LYS   4          1HE       LYS   4   0.114   8.001  -6.445
   36   1HZ   LYS   4          1HZ       LYS   4   1.174   8.459  -9.189
   37   2HZ   LYS   4          2HZ       LYS   4  -0.351   8.901  -8.600
   38   3HZ   LYS   4          3HZ       LYS   4   0.041   7.261  -8.779
   39    H    THR   5           H        THR   5   3.358  10.712  -3.480
   40    HA   THR   5           HA       THR   5   5.895   9.215  -3.579
   41    HB   THR   5           HB       THR   5   5.020  10.665  -1.082
   42    HG1  THR   5           1HG      THR   5   5.732  11.871  -3.286
   43   1HG2  THR   5          1HG2      THR   5   7.399  10.467  -0.500
   44   2HG2  THR   5          2HG2      THR   5   7.706   9.655  -2.034
   45   3HG2  THR   5          3HG2      THR   5   6.685   8.886  -0.819
   46    H    TYR   6           H        TYR   6   5.972   7.549  -1.803
   47    HA   TYR   6           HA       TYR   6   3.415   6.668  -0.783
   48   1HB   TYR   6          2HB       TYR   6   3.880   4.349  -1.715
   49   2HB   TYR   6          1HB       TYR   6   3.340   5.547  -2.882
   50    HD1  TYR   6           1HD      TYR   6   6.568   4.286  -1.450
   51    HD2  TYR   6           2HD      TYR   6   4.439   5.550  -4.909
   52    HE1  TYR   6           1HE      TYR   6   8.534   3.785  -2.831
   53    HE2  TYR   6           2HE      TYR   6   6.403   5.049  -6.305
   54    HH   TYR   6           HH       TYR   6   8.836   4.822  -6.060
   55    H    SER   7           H        SER   7   3.861   4.468   0.449
   56    HA   SER   7           HA       SER   7   6.290   4.873   2.035
   57   1HB   SER   7          2HB       SER   7   4.020   2.951   2.588
   58   2HB   SER   7          1HB       SER   7   5.252   3.511   3.717
   59    HG   SER   7           HG       SER   7   3.106   4.967   2.581
   60    H    GLU   8           H        GLU   8   7.964   3.483   2.013
   61    HA   GLU   8           HA       GLU   8   8.099   1.467   0.004
   62   1HB   GLU   8          2HB       GLU   8   9.980   2.105   2.281
   63   2HB   GLU   8          1HB       GLU   8  10.325   0.948   1.000
   64   1HG   GLU   8          2HG       GLU   8  10.035   2.790  -0.646
   65   2HG   GLU   8          1HG       GLU   8   9.893   3.909   0.709
   66    H    GLU   9           H        GLU   9   7.299   1.507   3.370
   67    HA   GLU   9           HA       GLU   9   7.473  -1.213   4.012
   68   1HB   GLU   9          2HB       GLU   9   6.996   0.645   5.599
   69   2HB   GLU   9          1HB       GLU   9   5.391   0.789   4.914
   70   1HG   GLU   9          2HG       GLU   9   5.370  -0.422   7.025
   71   2HG   GLU   9          1HG       GLU   9   4.823  -1.430   5.688
   72    H    PHE  10           H        PHE  10   5.150   0.596   2.164
   73    HA   PHE  10           HA       PHE  10   3.075  -1.295   2.012
   74   1HB   PHE  10          2HB       PHE  10   2.841   1.071   1.299
   75   2HB   PHE  10          1HB       PHE  10   3.901   0.748  -0.068
   76    HD1  PHE  10           1HD      PHE  10   0.707  -0.396   1.463
   77    HD2  PHE  10           2HD      PHE  10   2.989   0.136  -2.089
   78    HE1  PHE  10           1HE      PHE  10  -1.245  -1.032   0.113
   79    HE2  PHE  10           2HE      PHE  10   1.038  -0.499  -3.441
   80    HZ   PHE  10           HZ       PHE  10  -1.081  -1.082  -2.338
   81    H    LYS  11           H        LYS  11   5.956  -0.798   0.000
   82    HA   LYS  11           HA       LYS  11   5.428  -2.854  -1.873
   83   1HB   LYS  11          2HB       LYS  11   8.115  -1.821  -0.937
   84   2HB   LYS  11          1HB       LYS  11   7.819  -2.748  -2.400
   85   1HG   LYS  11          2HG       LYS  11   6.465  -0.907  -3.285
   86   2HG   LYS  11          1HG       LYS  11   6.799   0.025  -1.821
   87   1HD   LYS  11          2HD       LYS  11   9.199  -0.073  -2.314
   88   2HD   LYS  11          1HD       LYS  11   8.858  -0.991  -3.780
   89   1HE   LYS  11          2HE       LYS  11   7.673   0.869  -4.729
   90   2HE   LYS  11          1HE       LYS  11   7.807   1.773  -3.220
   91   1HZ   LYS  11          1HZ       LYS  11  10.265   1.685  -3.531
   92   2HZ   LYS  11          2HZ       LYS  11   9.442   2.594  -4.702
   93   3HZ   LYS  11          3HZ       LYS  11  10.005   1.039  -5.081
   94    H    ARG  12           H        ARG  12   7.081  -2.756   1.212
   95    HA   ARG  12           HA       ARG  12   8.159  -5.333   1.281
   96   1HB   ARG  12          2HB       ARG  12   8.706  -3.499   2.848
   97   2HB   ARG  12          1HB       ARG  12   7.111  -3.645   3.562
   98   1HG   ARG  12          2HG       ARG  12   7.665  -5.894   4.341
   99   2HG   ARG  12          1HG       ARG  12   9.275  -5.739   3.622
  100   1HD   ARG  12          2HD       ARG  12   9.719  -3.794   5.028
  101   2HD   ARG  12          1HD       ARG  12   8.113  -3.934   5.736
  102    HE   ARG  12           HE       ARG  12   9.811  -6.266   6.029
  103   1HH1  ARG  12          1HH1      ARG  12   8.579  -3.289   7.422
  104   2HH1  ARG  12          2HH1      ARG  12   9.072  -3.709   9.036
  105   1HH2  ARG  12          1HH2      ARG  12  10.400  -6.830   8.160
  106   2HH2  ARG  12          2HH2      ARG  12  10.095  -5.708   9.459
  107    H    ASP  13           H        ASP  13   4.975  -4.121   2.249
  108    HA   ASP  13           HA       ASP  13   4.006  -6.633   3.180
  109   1HB   ASP  13          2HB       ASP  13   3.033  -4.447   3.837
  110   2HB   ASP  13          1HB       ASP  13   2.438  -4.239   2.196
  111    H    ALA  14           H        ALA  14   3.980  -4.968   0.094
  112    HA   ALA  14           HA       ALA  14   2.226  -6.660  -1.314
  113   1HB   ALA  14          1HB       ALA  14   2.897  -4.442  -2.120
  114   2HB   ALA  14          2HB       ALA  14   3.205  -5.686  -3.331
  115   3HB   ALA  14          3HB       ALA  14   4.537  -5.034  -2.377
  116    H    VAL  15           H        VAL  15   5.714  -6.827  -0.744
  117    HA   VAL  15           HA       VAL  15   6.233  -9.008  -2.455
  118    HB   VAL  15           HB       VAL  15   7.697  -8.289   0.097
  119   1HG1  VAL  15          1HG1      VAL  15   8.208 -10.547  -0.669
  120   2HG1  VAL  15          2HG1      VAL  15   9.587  -9.471  -0.893
  121   3HG1  VAL  15          3HG1      VAL  15   8.589  -9.923  -2.274
  122   1HG2  VAL  15          1HG2      VAL  15   8.156  -7.414  -2.751
  123   2HG2  VAL  15          2HG2      VAL  15   9.271  -7.122  -1.415
  124   3HG2  VAL  15          3HG2      VAL  15   7.662  -6.400  -1.397
  125    H    ALA  16           H        ALA  16   5.220  -8.843   0.936
  126    HA   ALA  16           HA       ALA  16   5.296 -11.639   1.409
  127   1HB   ALA  16          1HB       ALA  16   3.977 -11.156   3.399
  128   2HB   ALA  16          2HB       ALA  16   3.611  -9.544   2.783
  129   3HB   ALA  16          3HB       ALA  16   5.266  -9.968   3.216
  130    H    LEU  17           H        LEU  17   2.907  -9.465   0.051
  131    HA   LEU  17           HA       LEU  17   0.678 -11.179   0.099
  132   1HB   LEU  17          2HB       LEU  17   1.432  -8.937  -1.764
  133   2HB   LEU  17          1HB       LEU  17  -0.096  -9.787  -1.873
  134    HG   LEU  17           HG       LEU  17   0.835  -8.261   0.560
  135   1HD1  LEU  17          1HD1      LEU  17  -1.151  -7.485  -1.572
  136   2HD1  LEU  17          2HD1      LEU  17   0.437  -6.764  -1.326
  137   3HD1  LEU  17          3HD1      LEU  17  -0.810  -6.584  -0.095
  138   1HD2  LEU  17          1HD2      LEU  17  -0.715 -10.072   1.077
  139   2HD2  LEU  17          2HD2      LEU  17  -1.837  -9.474  -0.147
  140   3HD2  LEU  17          3HD2      LEU  17  -1.491  -8.501   1.282
  141    H    TYR  18           H        TYR  18   3.409 -10.955  -2.074
  142    HA   TYR  18           HA       TYR  18   2.331 -12.504  -4.182
  143   1HB   TYR  18          2HB       TYR  18   4.279 -11.018  -4.464
  144   2HB   TYR  18          1HB       TYR  18   5.231 -12.075  -3.429
  145    HD1  TYR  18           1HD      TYR  18   3.224 -12.161  -6.575
  146    HD2  TYR  18           2HD      TYR  18   6.551 -13.710  -4.426
  147    HE1  TYR  18           1HE      TYR  18   3.904 -13.439  -8.562
  148    HE2  TYR  18           2HE      TYR  18   7.237 -14.995  -6.408
  149    HH   TYR  18           HH       TYR  18   6.292 -15.897  -8.438
  150    H    GLU  19           H        GLU  19   3.908 -13.355  -1.178
  151    HA   GLU  19           HA       GLU  19   4.338 -16.097  -1.902
  152   1HB   GLU  19          2HB       GLU  19   4.424 -14.641   0.729
  153   2HB   GLU  19          1HB       GLU  19   4.651 -16.379   0.616
  154   1HG   GLU  19          2HG       GLU  19   6.511 -15.853  -1.047
  155   2HG   GLU  19          1HG       GLU  19   6.383 -14.191  -0.470
  156    H    ASN  20           H        ASN  20   1.702 -14.270  -0.650
  157    HA   ASN  20           HA       ASN  20   0.310 -16.631   0.340
  158   1HB   ASN  20          2HB       ASN  20  -0.328 -13.682   0.380
  159   2HB   ASN  20          1HB       ASN  20  -1.510 -14.896   0.846
  160   1HD2  ASN  20          1HD2      ASN  20   1.483 -13.329   1.699
  161   2HD2  ASN  20          2HD2      ASN  20   1.542 -13.912   3.326
  162    H    SER  21           H        SER  21   0.938 -16.317  -2.499
  163    HA   SER  21           HA       SER  21  -1.355 -15.405  -3.903
  164   1HB   SER  21          2HB       SER  21  -0.143 -16.612  -5.832
  165   2HB   SER  21          1HB       SER  21   0.630 -15.216  -5.087
  166    HG   SER  21           HG       SER  21   2.211 -16.442  -4.477
  167    H    ASP  22           H        ASP  22  -0.539 -18.412  -2.466
  168    HA   ASP  22           HA       ASP  22  -2.088 -20.135  -4.081
  169   1HB   ASP  22          2HB       ASP  22  -0.450 -20.939  -2.382
  170   2HB   ASP  22          1HB       ASP  22  -1.551 -20.417  -1.111
  171    H    GLY  23           H        GLY  23  -2.910 -17.790  -1.705
  172   1HA   GLY  23          2HA       GLY  23  -5.732 -18.630  -1.879
  173   2HA   GLY  23          1HA       GLY  23  -5.050 -17.769  -0.507
  174    H    ALA  24           H        ALA  24  -3.694 -16.530  -3.287
  175    HA   ALA  24           HA       ALA  24  -5.824 -14.662  -3.893
  176   1HB   ALA  24          1HB       ALA  24  -3.263 -13.686  -2.628
  177   2HB   ALA  24          2HB       ALA  24  -4.853 -13.672  -1.868
  178   3HB   ALA  24          3HB       ALA  24  -4.545 -12.665  -3.284
  179    H    SER  25           H        SER  25  -5.770 -14.571  -6.027
  180    HA   SER  25           HA       SER  25  -3.604 -15.465  -7.592
  181   1HB   SER  25          2HB       SER  25  -6.041 -15.393  -8.266
  182   2HB   SER  25          1HB       SER  25  -5.852 -13.658  -8.507
  183    HG   SER  25           HG       SER  25  -5.575 -14.853 -10.447
  184    H    LEU  26           H        LEU  26  -2.119 -14.361  -8.874
  185    HA   LEU  26           HA       LEU  26  -0.910 -12.094  -7.792
  186   1HB   LEU  26          2HB       LEU  26   0.023 -13.868  -9.414
  187   2HB   LEU  26          1HB       LEU  26  -0.681 -12.895 -10.688
  188    HG   LEU  26           HG       LEU  26   1.320 -11.758  -8.740
  189   1HD1  LEU  26          1HD1      LEU  26   2.362 -13.677  -9.796
  190   2HD1  LEU  26          2HD1      LEU  26   3.030 -12.184 -10.456
  191   3HD1  LEU  26          3HD1      LEU  26   1.851 -13.107 -11.386
  192   1HD2  LEU  26          1HD2      LEU  26   1.712 -10.147 -10.534
  193   2HD2  LEU  26          2HD2      LEU  26   0.021 -10.139 -10.030
  194   3HD2  LEU  26          3HD2      LEU  26   0.494 -10.946 -11.525
  195    H    GLN  27           H        GLN  27  -3.230 -12.441 -10.420
  196    HA   GLN  27           HA       GLN  27  -3.336  -9.808 -11.344
  197   1HB   GLN  27          2HB       GLN  27  -4.512 -11.971 -12.188
  198   2HB   GLN  27          1HB       GLN  27  -5.778 -11.548 -11.052
  199   1HG   GLN  27          2HG       GLN  27  -4.865  -9.896 -13.402
  200   2HG   GLN  27          1HG       GLN  27  -6.344 -10.836 -13.298
  201   1HE2  GLN  27          1HE2      GLN  27  -4.763  -7.908 -12.567
  202   2HE2  GLN  27          2HE2      GLN  27  -6.112  -7.096 -11.855
  203    H    GLN  28           H        GLN  28  -5.191 -11.415  -8.779
  204    HA   GLN  28           HA       GLN  28  -6.763  -9.206  -8.062
  205   1HB   GLN  28          2HB       GLN  28  -5.967 -11.692  -6.561
  206   2HB   GLN  28          1HB       GLN  28  -7.063 -10.495  -5.889
  207   1HG   GLN  28          2HG       GLN  28  -7.488 -12.049  -8.429
  208   2HG   GLN  28          1HG       GLN  28  -8.285 -12.342  -6.882
  209   1HE2  GLN  28          1HE2      GLN  28  -8.081 -10.263  -9.658
  210   2HE2  GLN  28          2HE2      GLN  28  -9.523  -9.359  -9.344
  211    H    ILE  29           H        ILE  29  -3.628 -10.308  -6.860
  212    HA   ILE  29           HA       ILE  29  -3.387  -8.517  -4.710
  213    HB   ILE  29           HB       ILE  29  -1.213  -9.688  -6.456
  214   1HG1  ILE  29          2HG1      ILE  29  -2.590 -11.380  -5.313
  215   2HG1  ILE  29          1HG1      ILE  29  -0.958 -11.337  -4.657
  216   1HG2  ILE  29          1HG2      ILE  29   0.308  -9.191  -4.600
  217   2HG2  ILE  29          2HG2      ILE  29  -1.007  -8.379  -3.747
  218   3HG2  ILE  29          3HG2      ILE  29  -0.405  -7.727  -5.271
  219   1HD1  ILE  29          1HD1      ILE  29  -2.604 -11.579  -2.893
  220   2HD1  ILE  29          2HD1      ILE  29  -3.392 -10.086  -3.407
  221   3HD1  ILE  29          3HD1      ILE  29  -1.755 -10.038  -2.752
  222    H    ALA  30           H        ALA  30  -2.115  -8.242  -8.032
  223    HA   ALA  30           HA       ALA  30  -1.097  -5.634  -7.709
  224   1HB   ALA  30          1HB       ALA  30  -0.882  -5.610 -10.136
  225   2HB   ALA  30          2HB       ALA  30  -1.926  -7.030 -10.248
  226   3HB   ALA  30          3HB       ALA  30  -0.350  -7.150  -9.467
  227    H    ASN  31           H        ASN  31  -4.207  -6.845  -8.821
  228    HA   ASN  31           HA       ASN  31  -5.247  -4.429  -9.838
  229   1HB   ASN  31          2HB       ASN  31  -6.091  -6.985  -9.864
  230   2HB   ASN  31          1HB       ASN  31  -7.112  -6.366  -8.571
  231   1HD2  ASN  31          1HD2      ASN  31  -7.850  -7.327 -11.203
  232   2HD2  ASN  31          2HD2      ASN  31  -8.655  -6.016 -11.997
  233    H    ASP  32           H        ASP  32  -5.349  -5.911  -6.639
  234    HA   ASP  32           HA       ASP  32  -7.154  -4.075  -5.472
  235   1HB   ASP  32          2HB       ASP  32  -6.632  -6.324  -4.533
  236   2HB   ASP  32          1HB       ASP  32  -5.032  -5.735  -4.096
  237    H    LEU  33           H        LEU  33  -3.630  -4.237  -5.584
  238    HA   LEU  33           HA       LEU  33  -3.199  -1.955  -3.954
  239   1HB   LEU  33          2HB       LEU  33  -1.507  -3.636  -5.743
  240   2HB   LEU  33          1HB       LEU  33  -0.891  -2.081  -5.231
  241    HG   LEU  33           HG       LEU  33  -1.054  -2.755  -2.891
  242   1HD1  LEU  33          1HD1      LEU  33  -1.576  -5.065  -2.284
  243   2HD1  LEU  33          2HD1      LEU  33  -2.002  -5.409  -3.962
  244   3HD1  LEU  33          3HD1      LEU  33  -2.959  -4.260  -3.026
  245   1HD2  LEU  33          1HD2      LEU  33   0.702  -4.459  -2.905
  246   2HD2  LEU  33          2HD2      LEU  33   1.011  -3.192  -4.091
  247   3HD2  LEU  33          3HD2      LEU  33   0.393  -4.758  -4.615
  248    H    GLY  34           H        GLY  34  -3.721  -2.453  -7.356
  249   1HA   GLY  34          2HA       GLY  34  -4.579  -0.808  -8.798
  250   2HA   GLY  34          1HA       GLY  34  -4.023   0.432  -7.683
  251    H    ILE  35           H        ILE  35  -2.005  -2.193  -8.824
  252    HA   ILE  35           HA       ILE  35  -0.543  -0.317 -10.545
  253    HB   ILE  35           HB       ILE  35   1.581  -1.379  -9.769
  254   1HG1  ILE  35          2HG1      ILE  35  -0.171  -2.454  -7.549
  255   2HG1  ILE  35          1HG1      ILE  35   0.584  -3.421  -8.813
  256   1HG2  ILE  35          1HG2      ILE  35   0.929   0.820  -8.971
  257   2HG2  ILE  35          2HG2      ILE  35   1.747  -0.085  -7.695
  258   3HG2  ILE  35          3HG2      ILE  35  -0.009   0.082  -7.673
  259   1HD1  ILE  35          1HD1      ILE  35   2.037  -1.826  -6.710
  260   2HD1  ILE  35          2HD1      ILE  35   2.793  -2.792  -7.977
  261   3HD1  ILE  35          3HD1      ILE  35   1.822  -3.576  -6.730
  262    H    ASN  36           H        ASN  36   0.787  -1.377 -12.152
  263    HA   ASN  36           HA       ASN  36  -0.428  -3.607 -13.380
  264   1HB   ASN  36          2HB       ASN  36   0.962  -1.799 -14.502
  265   2HB   ASN  36          1HB       ASN  36   2.385  -2.614 -13.866
  266   1HD2  ASN  36          1HD2      ASN  36  -0.218  -2.741 -16.125
  267   2HD2  ASN  36          2HD2      ASN  36   0.370  -4.077 -17.049
  268    H    ARG  37           H        ARG  37   0.340  -5.722 -13.633
  269    HA   ARG  37           HA       ARG  37   1.315  -6.944 -11.322
  270   1HB   ARG  37          2HB       ARG  37   1.435  -8.961 -12.693
  271   2HB   ARG  37          1HB       ARG  37  -0.069  -8.102 -12.928
  272   1HG   ARG  37          2HG       ARG  37   0.828  -7.162 -15.018
  273   2HG   ARG  37          1HG       ARG  37   2.296  -8.118 -14.786
  274   1HD   ARG  37          2HD       ARG  37   0.986 -10.169 -14.848
  275   2HD   ARG  37          1HD       ARG  37  -0.494  -9.232 -15.030
  276    HE   ARG  37           HE       ARG  37   0.957  -8.421 -17.141
  277   1HH1  ARG  37          1HH1      ARG  37   0.209 -11.599 -15.901
  278   2HH1  ARG  37          2HH1      ARG  37   0.203 -12.362 -17.461
  279   1HH2  ARG  37          1HH2      ARG  37   0.949  -9.409 -19.214
  280   2HH2  ARG  37          2HH2      ARG  37   0.614 -11.115 -19.338
  281    H    VAL  38           H        VAL  38   2.951  -5.730 -14.158
  282    HA   VAL  38           HA       VAL  38   5.460  -7.002 -13.560
  283    HB   VAL  38           HB       VAL  38   4.908  -4.611 -15.341
  284   1HG1  VAL  38          1HG1      VAL  38   7.057  -5.145 -16.393
  285   2HG1  VAL  38          2HG1      VAL  38   7.306  -6.446 -15.229
  286   3HG1  VAL  38          3HG1      VAL  38   7.265  -4.770 -14.682
  287   1HG2  VAL  38          1HG2      VAL  38   4.984  -6.242 -17.187
  288   2HG2  VAL  38          2HG2      VAL  38   3.656  -6.563 -16.070
  289   3HG2  VAL  38          3HG2      VAL  38   5.120  -7.545 -16.007
  290    H    THR  39           H        THR  39   4.025  -3.816 -12.977
  291    HA   THR  39           HA       THR  39   6.241  -2.581 -11.785
  292    HB   THR  39           HB       THR  39   3.356  -2.128 -10.982
  293    HG1  THR  39           1HG      THR  39   4.760  -1.451 -13.342
  294   1HG2  THR  39          1HG2      THR  39   5.742  -0.278 -11.105
  295   2HG2  THR  39          2HG2      THR  39   5.040  -0.958  -9.638
  296   3HG2  THR  39          3HG2      THR  39   4.110   0.174 -10.618
  297    H    LEU  40           H        LEU  40   3.642  -4.559 -10.428
  298    HA   LEU  40           HA       LEU  40   4.450  -4.547  -7.742
  299   1HB   LEU  40          2HB       LEU  40   2.279  -5.388  -8.458
  300   2HB   LEU  40          1HB       LEU  40   3.048  -6.677  -9.363
  301    HG   LEU  40           HG       LEU  40   3.908  -7.598  -7.205
  302   1HD1  LEU  40          1HD1      LEU  40   2.066  -5.544  -5.990
  303   2HD1  LEU  40          2HD1      LEU  40   3.827  -5.539  -5.890
  304   3HD1  LEU  40          3HD1      LEU  40   2.904  -6.831  -5.123
  305   1HD2  LEU  40          1HD2      LEU  40   1.924  -8.522  -8.251
  306   2HD2  LEU  40          2HD2      LEU  40   0.920  -7.304  -7.463
  307   3HD2  LEU  40          3HD2      LEU  40   1.750  -8.523  -6.496
  308    H    LYS  41           H        LYS  41   5.228  -6.751 -10.400
  309    HA   LYS  41           HA       LYS  41   6.852  -8.563  -9.059
  310   1HB   LYS  41          2HB       LYS  41   6.003  -8.711 -11.428
  311   2HB   LYS  41          1HB       LYS  41   7.265  -7.576 -11.882
  312   1HG   LYS  41          2HG       LYS  41   8.180  -9.637 -12.394
  313   2HG   LYS  41          1HG       LYS  41   8.874  -9.258 -10.817
  314   1HD   LYS  41          2HD       LYS  41   7.207 -10.656  -9.733
  315   2HD   LYS  41          1HD       LYS  41   6.486 -11.017 -11.300
  316   1HE   LYS  41          2HE       LYS  41   9.302 -11.697 -10.458
  317   2HE   LYS  41          1HE       LYS  41   7.955 -12.832 -10.539
  318   1HZ   LYS  41          1HZ       LYS  41   9.478 -12.860 -12.497
  319   2HZ   LYS  41          2HZ       LYS  41   8.942 -11.299 -12.888
  320   3HZ   LYS  41          3HZ       LYS  41   7.847 -12.597 -12.883
  321    H    ASN  42           H        ASN  42   7.733  -5.596 -10.762
  322    HA   ASN  42           HA       ASN  42  10.477  -5.607 -10.355
  323   1HB   ASN  42          2HB       ASN  42   8.496  -3.369 -10.684
  324   2HB   ASN  42          1HB       ASN  42  10.210  -3.039 -10.458
  325   1HD2  ASN  42          1HD2      ASN  42  10.246  -2.090 -12.527
  326   2HD2  ASN  42          2HD2      ASN  42  10.265  -3.056 -13.958
  327    H    TRP  43           H        TRP  43   7.942  -4.291  -8.248
  328    HA   TRP  43           HA       TRP  43   9.601  -3.245  -6.248
  329   1HB   TRP  43          2HB       TRP  43   6.795  -4.338  -6.202
  330   2HB   TRP  43          1HB       TRP  43   7.569  -3.761  -4.733
  331    HD1  TRP  43           HD       TRP  43   8.728  -1.555  -7.407
  332    HE1  TRP  43           1HE      TRP  43   7.349   0.621  -7.467
  333    HE3  TRP  43           3HE      TRP  43   4.815  -2.993  -4.453
  334    HZ2  TRP  43           2HZ      TRP  43   4.911   1.595  -6.397
  335    HZ3  TRP  43           3HZ      TRP  43   3.007  -1.390  -4.018
  336    HH2  TRP  43           HH       TRP  43   3.053   0.856  -4.973
  337    H    ILE  44           H        ILE  44   8.226  -6.461  -6.683
  338    HA   ILE  44           HA       ILE  44   9.107  -7.589  -4.271
  339    HB   ILE  44           HB       ILE  44   8.606  -8.961  -6.915
  340   1HG1  ILE  44          2HG1      ILE  44   6.745  -8.610  -4.556
  341   2HG1  ILE  44          1HG1      ILE  44   6.700  -7.609  -6.004
  342   1HG2  ILE  44          1HG2      ILE  44   8.228 -10.976  -5.563
  343   2HG2  ILE  44          2HG2      ILE  44   8.704 -10.085  -4.118
  344   3HG2  ILE  44          3HG2      ILE  44   9.880 -10.377  -5.400
  345   1HD1  ILE  44          1HD1      ILE  44   4.995  -9.336  -6.057
  346   2HD1  ILE  44          2HD1      ILE  44   6.234 -10.579  -5.890
  347   3HD1  ILE  44          3HD1      ILE  44   6.179  -9.578  -7.341
  348    H    ILE  45           H        ILE  45  10.583  -7.642  -7.513
  349    HA   ILE  45           HA       ILE  45  12.769  -9.279  -6.782
  350    HB   ILE  45           HB       ILE  45  12.584  -7.293  -9.054
  351   1HG1  ILE  45          2HG1      ILE  45  12.031 -10.270  -9.001
  352   2HG1  ILE  45          1HG1      ILE  45  10.801  -9.015  -9.071
  353   1HG2  ILE  45          1HG2      ILE  45  14.883  -7.895  -8.637
  354   2HG2  ILE  45          2HG2      ILE  45  14.325  -8.702 -10.104
  355   3HG2  ILE  45          3HG2      ILE  45  14.462  -9.606  -8.596
  356   1HD1  ILE  45          1HD1      ILE  45  11.205 -10.010 -11.257
  357   2HD1  ILE  45          2HD1      ILE  45  12.898  -9.524 -11.168
  358   3HD1  ILE  45          3HD1      ILE  45  11.631  -8.299 -11.239
  359    H    LYS  46           H        LYS  46  12.322  -5.788  -6.781
  360    HA   LYS  46           HA       LYS  46  15.074  -5.161  -6.421
  361   1HB   LYS  46          2HB       LYS  46  13.463  -3.587  -7.418
  362   2HB   LYS  46          1HB       LYS  46  12.633  -3.466  -5.875
  363   1HG   LYS  46          2HG       LYS  46  14.572  -2.445  -4.866
  364   2HG   LYS  46          1HG       LYS  46  15.496  -2.670  -6.354
  365   1HD   LYS  46          2HD       LYS  46  13.961  -1.187  -7.539
  366   2HD   LYS  46          1HD       LYS  46  13.012  -0.979  -6.067
  367   1HE   LYS  46          2HE       LYS  46  14.523   0.913  -6.478
  368   2HE   LYS  46          1HE       LYS  46  14.888   0.082  -4.968
  369   1HZ   LYS  46          1HZ       LYS  46  16.339  -0.457  -7.501
  370   2HZ   LYS  46          2HZ       LYS  46  16.769  -0.949  -5.933
  371   3HZ   LYS  46          3HZ       LYS  46  16.852   0.688  -6.363
  372    H    TYR  47           H        TYR  47  12.296  -5.229  -4.174
  373    HA   TYR  47           HA       TYR  47  14.065  -4.596  -1.961
  374   1HB   TYR  47          2HB       TYR  47  11.090  -5.029  -2.150
  375   2HB   TYR  47          1HB       TYR  47  11.912  -4.779  -0.616
  376    HD1  TYR  47           1HD      TYR  47  11.776  -2.632   0.217
  377    HD2  TYR  47           2HD      TYR  47  11.904  -3.170  -4.004
  378    HE1  TYR  47           1HE      TYR  47  11.619  -0.199  -0.097
  379    HE2  TYR  47           2HE      TYR  47  11.766  -0.737  -4.323
  380    HH   TYR  47           HH       TYR  47  12.082   1.495  -1.689
  381    H    GLY  48           H        GLY  48  12.158  -7.344  -3.096
  382   1HA   GLY  48          2HA       GLY  48  13.478  -9.011  -1.051
  383   2HA   GLY  48          1HA       GLY  48  11.985  -9.428  -1.887
  384    H    SER  49           H        SER  49  15.407  -8.762  -2.465
  385    HA   SER  49           HA       SER  49  15.572  -9.589  -5.102
  386   1HB   SER  49          2HB       SER  49  17.723  -9.751  -2.979
  387   2HB   SER  49          1HB       SER  49  17.984  -9.734  -4.725
  388    HG   SER  49           HG       SER  49  16.488  -7.659  -4.248
  389    H    ASN  50           H        ASN  50  15.434 -11.503  -2.220
  390    HA   ASN  50           HA       ASN  50  14.952 -13.698  -1.924
  391   1HB   ASN  50          2HB       ASN  50  13.526 -13.665  -3.860
  392   2HB   ASN  50          1HB       ASN  50  14.910 -13.756  -4.944
  393   1HD2  ASN  50          1HD2      ASN  50  12.871 -15.512  -2.745
  394   2HD2  ASN  50          2HD2      ASN  50  13.396 -17.092  -3.205
  395    H    HIS  51           H        HIS  51  17.228 -13.477  -4.664
  396    HA   HIS  51           HA       HIS  51  18.657 -15.789  -3.718
  397   1HB   HIS  51          2HB       HIS  51  19.312 -13.851  -5.943
  398   2HB   HIS  51          1HB       HIS  51  20.188 -15.343  -5.615
  399    HD1  HIS  51           1HD      HIS  51  18.862 -17.598  -6.026
  400    HD2  HIS  51           2HD      HIS  51  16.994 -14.145  -7.403
  401    HE1  HIS  51           1HE      HIS  51  17.053 -18.380  -7.588
  402    HE2  HIS  51           2HE      HIS  51  16.117 -16.266  -8.592
  403    H    ASN  52           H        ASN  52  19.260 -12.304  -3.866
  404    HA   ASN  52           HA       ASN  52  21.740 -12.550  -2.398
  405   1HB   ASN  52          2HB       ASN  52  21.223 -10.740  -4.120
  406   2HB   ASN  52          1HB       ASN  52  20.174 -10.014  -2.909
  407   1HD2  ASN  52          1HD2      ASN  52  21.092  -9.082  -1.071
  408   2HD2  ASN  52          2HD2      ASN  52  22.773  -8.674  -0.999
  409    H    VAL  53           H        VAL  53  20.358 -13.854  -0.780
  410    HA   VAL  53           HA       VAL  53  18.817 -12.274   1.072
  411    HB   VAL  53           HB       VAL  53  18.129 -14.554   0.674
  412   1HG1  VAL  53          1HG1      VAL  53  20.776 -15.416   1.821
  413   2HG1  VAL  53          2HG1      VAL  53  20.278 -15.558   0.136
  414   3HG1  VAL  53          3HG1      VAL  53  19.445 -16.489   1.381
  415   1HG2  VAL  53          1HG2      VAL  53  17.979 -15.369   2.986
  416   2HG2  VAL  53          2HG2      VAL  53  17.630 -13.646   2.853
  417   3HG2  VAL  53          3HG2      VAL  53  19.196 -14.185   3.460
  418    H    GLN  54           H        GLN  54  21.878 -14.057   1.213
  419    HA   GLN  54           HA       GLN  54  23.784 -13.770   2.423
  420   1HB   GLN  54          2HB       GLN  54  23.470 -11.429   1.448
  421   2HB   GLN  54          1HB       GLN  54  22.815 -10.967   3.012
  422   1HG   GLN  54          2HG       GLN  54  25.169 -10.358   2.782
  423   2HG   GLN  54          1HG       GLN  54  24.909 -11.517   4.088
  424   1HE2  GLN  54          1HE2      GLN  54  25.745 -13.579   3.914
  425   2HE2  GLN  54          2HE2      GLN  54  26.896 -14.020   2.696
  426    H    GLY  55           H        GLY  55  21.206 -14.588   3.714
  427   1HA   GLY  55          2HA       GLY  55  21.459 -13.612   6.449
  428   2HA   GLY  55          1HA       GLY  55  20.212 -14.688   5.838
  429    H    THR  56           H        THR  56  20.407 -16.823   6.164
  430    HA   THR  56           HA       THR  56  22.980 -17.963   6.859
  431    HB   THR  56           HB       THR  56  21.766 -19.206   8.800
  432    HG1  THR  56           1HG      THR  56  20.048 -17.042   8.272
  433   1HG2  THR  56          1HG2      THR  56  23.672 -17.731   9.139
  434   2HG2  THR  56          2HG2      THR  56  22.469 -17.486  10.406
  435   3HG2  THR  56          3HG2      THR  56  22.614 -16.323   9.088
  436    H    THR  57           H        THR  57  22.983 -19.284   5.146
  437    HA   THR  57           HA       THR  57  20.915 -20.804   4.102
  438    HB   THR  57           HB       THR  57  22.964 -20.613   2.877
  439    HG1  THR  57           1HG      THR  57  21.759 -22.846   3.083
  440   1HG2  THR  57          1HG2      THR  57  24.314 -22.103   5.124
  441   2HG2  THR  57          2HG2      THR  57  24.518 -20.393   4.742
  442   3HG2  THR  57          3HG2      THR  57  25.071 -21.624   3.606
  443    HA   PRO  58           HA       PRO  58  20.112 -23.300   7.728
  444   1HB   PRO  58          2HB       PRO  58  18.193 -24.648   5.943
  445   2HB   PRO  58          1HB       PRO  58  17.913 -23.803   7.468
  446   1HG   PRO  58          2HG       PRO  58  17.149 -22.746   5.128
  447   2HG   PRO  58          1HG       PRO  58  17.760 -21.735   6.450
  448   1HD   PRO  58          2HD       PRO  58  19.163 -22.676   3.979
  449   2HD   PRO  58          1HD       PRO  58  19.210 -21.084   4.764
  450    H    SER  59           H        SER  59  21.802 -24.670   8.038
  451    HA   SER  59           HA       SER  59  22.628 -26.677   6.222
  452   1HB   SER  59          2HB       SER  59  24.109 -25.744   7.956
  453   2HB   SER  59          1HB       SER  59  23.098 -26.458   9.208
  454    HG   SER  59           HG       SER  59  24.605 -27.847   7.234
  455    H    ALA  60           H        ALA  60  20.161 -26.535   8.635
  456    HA   ALA  60           HA       ALA  60  19.738 -29.329   8.958
  457   1HB   ALA  60          1HB       ALA  60  18.950 -27.684  10.607
  458   2HB   ALA  60          2HB       ALA  60  17.630 -28.690  10.009
  459   3HB   ALA  60          3HB       ALA  60  17.822 -27.042   9.415
  460    H    ALA  61           H        ALA  61  19.007 -27.095   6.480
  461    HA   ALA  61           HA       ALA  61  16.702 -28.570   5.510
  462   1HB   ALA  61          1HB       ALA  61  16.531 -26.842   3.804
  463   2HB   ALA  61          2HB       ALA  61  18.066 -26.151   4.330
  464   3HB   ALA  61          3HB       ALA  61  16.669 -26.123   5.407
  465    H    VAL  62           H        VAL  62  19.890 -29.115   5.365
  466    HA   VAL  62           HA       VAL  62  20.292 -29.665   2.603
  467    HB   VAL  62           HB       VAL  62  21.717 -30.775   5.025
  468   1HG1  VAL  62          1HG1      VAL  62  23.516 -31.411   3.478
  469   2HG1  VAL  62          2HG1      VAL  62  22.509 -30.927   2.114
  470   3HG1  VAL  62          3HG1      VAL  62  22.022 -32.283   3.131
  471   1HG2  VAL  62          1HG2      VAL  62  21.936 -28.373   4.796
  472   2HG2  VAL  62          2HG2      VAL  62  22.433 -28.560   3.114
  473   3HG2  VAL  62          3HG2      VAL  62  23.465 -29.165   4.410
  474    H    SER  63           H        SER  63  18.973 -31.451   5.288
  475    HA   SER  63           HA       SER  63  18.830 -34.002   4.121
  476   1HB   SER  63          2HB       SER  63  16.775 -32.841   6.010
  477   2HB   SER  63          1HB       SER  63  17.299 -34.521   5.870
  478    HG   SER  63           HG       SER  63  18.912 -34.114   7.155
  479    H    GLU  64           H        GLU  64  16.691 -31.202   4.012
  480    HA   GLU  64           HA       GLU  64  14.641 -32.480   2.483
  481   1HB   GLU  64          2HB       GLU  64  14.147 -30.557   3.916
  482   2HB   GLU  64          1HB       GLU  64  15.227 -29.547   2.968
  483   1HG   GLU  64          2HG       GLU  64  13.750 -29.919   1.002
  484   2HG   GLU  64          1HG       GLU  64  12.628 -30.771   2.063
  485    H    ALA  65           H        ALA  65  17.624 -30.932   1.754
  486    HA   ALA  65           HA       ALA  65  17.171 -30.078  -0.878
  487   1HB   ALA  65          1HB       ALA  65  19.742 -31.108   0.321
  488   2HB   ALA  65          2HB       ALA  65  19.157 -29.446   0.401
  489   3HB   ALA  65          3HB       ALA  65  19.594 -30.153  -1.156
  490    H    GLU  66           H        GLU  66  17.887 -33.225   0.464
  491    HA   GLU  66           HA       GLU  66  18.368 -34.596  -1.962
  492   1HB   GLU  66          2HB       GLU  66  18.920 -35.542   0.235
  493   2HB   GLU  66          1HB       GLU  66  17.218 -35.610   0.646
  494   1HG   GLU  66          2HG       GLU  66  18.003 -37.796   0.048
  495   2HG   GLU  66          1HG       GLU  66  16.852 -37.224  -1.152
  496    H    GLN  67           H        GLN  67  15.452 -33.858  -0.144
  497    HA   GLN  67           HA       GLN  67  13.660 -35.265  -1.861
  498   1HB   GLN  67          2HB       GLN  67  12.993 -32.872  -0.143
  499   2HB   GLN  67          1HB       GLN  67  11.889 -34.107  -0.722
  500   1HG   GLN  67          2HG       GLN  67  14.028 -34.389   1.369
  501   2HG   GLN  67          1HG       GLN  67  12.282 -34.472   1.595
  502   1HE2  GLN  67          1HE2      GLN  67  15.127 -36.159   0.681
  503   2HE2  GLN  67          2HE2      GLN  67  14.410 -37.715   0.510
  504    H    ILE  68           H        ILE  68  14.616 -31.884  -1.540
  505    HA   ILE  68           HA       ILE  68  13.105 -30.790  -3.624
  506    HB   ILE  68           HB       ILE  68  15.744 -29.929  -2.437
  507   1HG1  ILE  68          2HG1      ILE  68  13.907 -29.907  -0.868
  508   2HG1  ILE  68          1HG1      ILE  68  14.327 -28.253  -1.286
  509   1HG2  ILE  68          1HG2      ILE  68  15.592 -28.966  -4.651
  510   2HG2  ILE  68          2HG2      ILE  68  15.325 -27.718  -3.432
  511   3HG2  ILE  68          3HG2      ILE  68  13.958 -28.398  -4.313
  512   1HD1  ILE  68          1HD1      ILE  68  12.426 -28.168  -2.839
  513   2HD1  ILE  68          2HD1      ILE  68  11.930 -28.509  -1.180
  514   3HD1  ILE  68          3HD1      ILE  68  11.990 -29.811  -2.366
  515    H    ARG  69           H        ARG  69  16.210 -32.371  -3.608
  516    HA   ARG  69           HA       ARG  69  17.229 -31.869  -6.104
  517   1HB   ARG  69          2HB       ARG  69  18.257 -33.222  -4.281
  518   2HB   ARG  69          1HB       ARG  69  17.164 -34.532  -4.684
  519   1HG   ARG  69          2HG       ARG  69  18.195 -34.716  -6.886
  520   2HG   ARG  69          1HG       ARG  69  19.302 -33.402  -6.472
  521   1HD   ARG  69          2HD       ARG  69  20.067 -34.760  -4.521
  522   2HD   ARG  69          1HD       ARG  69  19.071 -36.085  -5.116
  523    HE   ARG  69           HE       ARG  69  20.713 -35.346  -7.217
  524   1HH1  ARG  69          1HH1      ARG  69  21.082 -36.580  -3.958
  525   2HH1  ARG  69          2HH1      ARG  69  22.577 -37.405  -4.300
  526   1HH2  ARG  69          1HH2      ARG  69  22.667 -36.415  -7.678
  527   2HH2  ARG  69          2HH2      ARG  69  23.493 -37.299  -6.431
  528    H    GLN  70           H        GLN  70  14.883 -34.355  -5.208
  529    HA   GLN  70           HA       GLN  70  14.416 -35.198  -7.906
  530   1HB   GLN  70          2HB       GLN  70  14.276 -36.643  -5.854
  531   2HB   GLN  70          1HB       GLN  70  12.817 -35.776  -5.426
  532   1HG   GLN  70          2HG       GLN  70  11.761 -36.510  -7.481
  533   2HG   GLN  70          1HG       GLN  70  13.226 -37.379  -7.926
  534   1HE2  GLN  70          1HE2      GLN  70  12.131 -39.357  -7.992
  535   2HE2  GLN  70          2HE2      GLN  70  11.637 -40.173  -6.552
  536    H    LEU  71           H        LEU  71  12.681 -33.421  -5.426
  537    HA   LEU  71           HA       LEU  71  10.231 -33.221  -6.796
  538   1HB   LEU  71          2HB       LEU  71  10.776 -32.953  -4.298
  539   2HB   LEU  71          1HB       LEU  71  11.154 -31.290  -4.689
  540    HG   LEU  71           HG       LEU  71   8.864 -31.667  -3.734
  541   1HD1  LEU  71          1HD1      LEU  71   9.357 -29.653  -5.004
  542   2HD1  LEU  71          2HD1      LEU  71   7.707 -30.194  -5.300
  543   3HD1  LEU  71          3HD1      LEU  71   8.959 -30.489  -6.505
  544   1HD2  LEU  71          1HD2      LEU  71   8.395 -33.009  -6.390
  545   2HD2  LEU  71          2HD2      LEU  71   7.140 -32.570  -5.231
  546   3HD2  LEU  71          3HD2      LEU  71   8.353 -33.778  -4.801
  547    H    LYS  72           H        LYS  72  12.813 -30.757  -6.387
  548    HA   LYS  72           HA       LYS  72  11.176 -28.920  -7.962
  549   1HB   LYS  72          2HB       LYS  72  12.262 -28.284  -5.744
  550   2HB   LYS  72          1HB       LYS  72  13.794 -28.280  -6.606
  551   1HG   LYS  72          2HG       LYS  72  13.080 -26.491  -8.018
  552   2HG   LYS  72          1HG       LYS  72  11.431 -26.587  -7.396
  553   1HD   LYS  72          2HD       LYS  72  12.524 -24.713  -6.375
  554   2HD   LYS  72          1HD       LYS  72  12.315 -25.967  -5.149
  555   1HE   LYS  72          2HE       LYS  72  14.652 -26.672  -5.531
  556   2HE   LYS  72          1HE       LYS  72  14.841 -25.343  -6.676
  557   1HZ   LYS  72          1HZ       LYS  72  14.255 -25.109  -3.771
  558   2HZ   LYS  72          2HZ       LYS  72  14.287 -23.800  -4.847
  559   3HZ   LYS  72          3HZ       LYS  72  15.701 -24.685  -4.554
  560    H    LYS  73           H        LYS  73  13.349 -31.206  -8.719
  561    HA   LYS  73           HA       LYS  73  14.180 -29.692 -11.100
  562   1HB   LYS  73          2HB       LYS  73  15.831 -31.114  -9.244
  563   2HB   LYS  73          1HB       LYS  73  15.894 -31.933 -10.799
  564   1HG   LYS  73          2HG       LYS  73  17.668 -30.317 -10.662
  565   2HG   LYS  73          1HG       LYS  73  16.492 -29.799 -11.871
  566   1HD   LYS  73          2HD       LYS  73  15.482 -28.293 -10.197
  567   2HD   LYS  73          1HD       LYS  73  16.723 -28.777  -9.042
  568   1HE   LYS  73          2HE       LYS  73  17.413 -26.707  -9.993
  569   2HE   LYS  73          1HE       LYS  73  18.435 -27.966 -10.678
  570   1HZ   LYS  73          1HZ       LYS  73  17.733 -26.442 -12.388
  571   2HZ   LYS  73          2HZ       LYS  73  16.102 -26.688 -12.008
  572   3HZ   LYS  73          3HZ       LYS  73  17.015 -27.952 -12.667
  573    H    GLU  74           H        GLU  74  13.011 -30.320 -12.744
  574    HA   GLU  74           HA       GLU  74  11.400 -32.599 -12.795
  575   1HB   GLU  74          2HB       GLU  74  12.383 -30.857 -15.058
  576   2HB   GLU  74          1HB       GLU  74  11.182 -32.122 -15.259
  577   1HG   GLU  74          2HG       GLU  74  10.025 -30.061 -15.099
  578   2HG   GLU  74          1HG       GLU  74   9.756 -30.929 -13.592
  579    H    ASN  75           H        ASN  75  12.035 -34.630 -12.855
  580    HA   ASN  75           HA       ASN  75  14.186 -35.370 -14.713
  581   1HB   ASN  75          2HB       ASN  75  14.898 -37.135 -13.143
  582   2HB   ASN  75          1HB       ASN  75  15.068 -35.533 -12.440
  583   1HD2  ASN  75          1HD2      ASN  75  13.806 -34.949 -10.717
  584   2HD2  ASN  75          2HD2      ASN  75  12.845 -36.086  -9.838
  585    H    ALA  76           H        ALA  76  14.065 -38.035 -14.680
  586    HA   ALA  76           HA       ALA  76  11.942 -38.548 -16.402
  587   1HB   ALA  76          1HB       ALA  76  12.672 -40.850 -16.390
  588   2HB   ALA  76          2HB       ALA  76  13.592 -40.576 -14.911
  589   3HB   ALA  76          3HB       ALA  76  14.072 -39.778 -16.407
  590    H    LEU  77           H        LEU  77  12.330 -39.465 -13.009
  591    HA   LEU  77           HA       LEU  77  10.005 -41.054 -12.870
  592   1HB   LEU  77          2HB       LEU  77  11.536 -39.631 -10.696
  593   2HB   LEU  77          1HB       LEU  77  10.291 -40.827 -10.420
  594    HG   LEU  77           HG       LEU  77  12.921 -41.325 -11.808
  595   1HD1  LEU  77          1HD1      LEU  77  13.156 -40.977  -9.404
  596   2HD1  LEU  77          2HD1      LEU  77  13.454 -42.660  -9.837
  597   3HD1  LEU  77          3HD1      LEU  77  11.919 -42.198  -9.100
  598   1HD2  LEU  77          1HD2      LEU  77  12.269 -43.675 -11.782
  599   2HD2  LEU  77          2HD2      LEU  77  11.116 -42.712 -12.709
  600   3HD2  LEU  77          3HD2      LEU  77  10.713 -43.247 -11.076
  601    H    GLN  78           H        GLN  78  10.624 -37.650 -12.225
  602    HA   GLN  78           HA       GLN  78   8.105 -37.079 -11.060
  603   1HB   GLN  78          2HB       GLN  78  10.112 -35.277 -12.423
  604   2HB   GLN  78          1HB       GLN  78   8.698 -34.699 -11.551
  605   1HG   GLN  78          2HG       GLN  78  10.895 -36.360 -10.338
  606   2HG   GLN  78          1HG       GLN  78  10.788 -34.601 -10.240
  607   1HE2  GLN  78          1HE2      GLN  78   9.260 -33.664  -8.933
  608   2HE2  GLN  78          2HE2      GLN  78   8.371 -34.552  -7.748
  609    H    ARG  79           H        ARG  79   9.302 -37.049 -14.361
  610    HA   ARG  79           HA       ARG  79   6.937 -35.748 -15.382
  611   1HB   ARG  79          2HB       ARG  79   9.332 -35.572 -16.295
  612   2HB   ARG  79          1HB       ARG  79   9.039 -37.144 -17.022
  613   1HG   ARG  79          2HG       ARG  79   7.104 -36.187 -18.223
  614   2HG   ARG  79          1HG       ARG  79   7.508 -34.607 -17.549
  615   1HD   ARG  79          2HD       ARG  79   8.428 -34.692 -19.737
  616   2HD   ARG  79          1HD       ARG  79   9.770 -34.842 -18.603
  617    HE   ARG  79           HE       ARG  79   8.564 -37.191 -19.921
  618   1HH1  ARG  79          1HH1      ARG  79  11.365 -35.237 -19.091
  619   2HH1  ARG  79          2HH1      ARG  79  12.501 -36.393 -19.724
  620   1HH2  ARG  79          1HH2      ARG  79  10.068 -38.692 -20.763
  621   2HH2  ARG  79          2HH2      ARG  79  11.773 -38.342 -20.659
  622    H    ALA  80           H        ALA  80   7.930 -38.921 -14.697
  623    HA   ALA  80           HA       ALA  80   6.334 -40.268 -16.655
  624   1HB   ALA  80          1HB       ALA  80   8.373 -41.268 -15.733
  625   2HB   ALA  80          2HB       ALA  80   6.964 -42.305 -15.502
  626   3HB   ALA  80          3HB       ALA  80   7.601 -41.365 -14.152
  627    H    ARG  81           H        ARG  81   5.718 -38.871 -13.606
  628    HA   ARG  81           HA       ARG  81   3.819 -40.531 -12.470
  629   1HB   ARG  81          2HB       ARG  81   4.259 -37.573 -12.333
  630   2HB   ARG  81          1HB       ARG  81   2.896 -38.306 -11.505
  631   1HG   ARG  81          2HG       ARG  81   4.423 -39.719 -10.234
  632   2HG   ARG  81          1HG       ARG  81   5.794 -38.990 -11.075
  633   1HD   ARG  81          2HD       ARG  81   5.398 -36.884 -10.098
  634   2HD   ARG  81          1HD       ARG  81   3.799 -37.360  -9.533
  635    HE   ARG  81           HE       ARG  81   5.607 -39.069  -8.311
  636   1HH1  ARG  81          1HH1      ARG  81   5.048 -35.610  -8.431
  637   2HH1  ARG  81          2HH1      ARG  81   5.475 -35.353  -6.764
  638   1HH2  ARG  81          1HH2      ARG  81   6.216 -38.725  -6.119
  639   2HH2  ARG  81          2HH2      ARG  81   6.169 -37.113  -5.474
  640    H    THR  82           H        THR  82   3.486 -38.542 -15.240
  641    HA   THR  82           HA       THR  82   0.685 -38.160 -15.186
  642    HB   THR  82           HB       THR  82   2.423 -38.298 -17.656
  643    HG1  THR  82           1HG      THR  82   1.936 -36.077 -15.922
  644   1HG2  THR  82          1HG2      THR  82   0.819 -36.683 -18.559
  645   2HG2  THR  82          2HG2      THR  82  -0.095 -36.737 -17.051
  646   3HG2  THR  82          3HG2      THR  82   0.006 -38.171 -18.074
  647    H    ARG  83           H        ARG  83   2.627 -40.890 -15.861
  648    HA   ARG  83           HA       ARG  83   0.275 -42.355 -16.824
  649   1HB   ARG  83          2HB       ARG  83   3.083 -42.387 -17.899
  650   2HB   ARG  83          1HB       ARG  83   1.987 -43.726 -18.149
  651   1HG   ARG  83          2HG       ARG  83   1.536 -40.896 -19.062
  652   2HG   ARG  83          1HG       ARG  83   2.056 -42.244 -20.076
  653   1HD   ARG  83          2HD       ARG  83  -0.120 -43.370 -19.137
  654   2HD   ARG  83          1HD       ARG  83  -0.603 -41.699 -18.854
  655    HE   ARG  83           HE       ARG  83   0.364 -42.385 -21.521
  656   1HH1  ARG  83          1HH1      ARG  83  -2.351 -41.628 -19.432
  657   2HH1  ARG  83          2HH1      ARG  83  -3.469 -41.418 -20.750
  658   1HH2  ARG  83          1HH2      ARG  83  -1.092 -42.076 -23.245
  659   2HH2  ARG  83          2HH2      ARG  83  -2.755 -41.702 -22.916
  660    H    HIS  84           H        HIS  84   0.258 -44.603 -16.293
  661    HA   HIS  84           HA       HIS  84   2.405 -45.479 -14.474
  662   1HB   HIS  84          2HB       HIS  84   0.227 -45.184 -13.278
  663   2HB   HIS  84          1HB       HIS  84  -0.486 -46.385 -14.350
  664    HD1  HIS  84           1HD      HIS  84   1.500 -46.017 -11.272
  665    HD2  HIS  84           2HD      HIS  84   0.592 -49.043 -13.982
  666    HE1  HIS  84           1HE      HIS  84   2.151 -48.168 -10.138
  667    HE2  HIS  84           2HE      HIS  84   1.867 -49.935 -11.915
  668    HA   PRO  85           HA       PRO  85   2.704 -48.143 -18.097
  669   1HB   PRO  85          2HB       PRO  85   5.218 -49.014 -17.605
  670   2HB   PRO  85          1HB       PRO  85   4.879 -47.428 -18.305
  671   1HG   PRO  85          2HG       PRO  85   5.521 -48.151 -15.473
  672   2HG   PRO  85          1HG       PRO  85   6.122 -46.793 -16.443
  673   1HD   PRO  85          2HD       PRO  85   4.131 -46.535 -14.610
  674   2HD   PRO  85          1HD       PRO  85   4.228 -45.538 -16.074
  675    H    ALA  86           H        ALA  86   3.427 -50.478 -18.383
  676    HA   ALA  86           HA       ALA  86   2.177 -52.038 -16.274
  677   1HB   ALA  86          1HB       ALA  86   1.483 -52.394 -18.597
  678   2HB   ALA  86          2HB       ALA  86   2.146 -53.855 -17.869
  679   3HB   ALA  86          3HB       ALA  86   3.123 -52.916 -18.998
  680    H    GLU  87           H        GLU  87   3.770 -51.983 -14.693
  681    HA   GLU  87           HA       GLU  87   6.460 -52.831 -15.224
  682   1HB   GLU  87          2HB       GLU  87   6.852 -52.559 -12.876
  683   2HB   GLU  87          1HB       GLU  87   5.816 -51.237 -13.385
  684   1HG   GLU  87          2HG       GLU  87   4.890 -53.730 -11.966
  685   2HG   GLU  87          1HG       GLU  87   5.183 -52.168 -11.207
  686    H    SER  88           H        SER  88   3.502 -54.282 -14.154
  687    HA   SER  88           HA       SER  88   4.472 -56.700 -13.129
  688   1HB   SER  88          2HB       SER  88   1.850 -56.246 -14.569
  689   2HB   SER  88          1HB       SER  88   2.205 -57.509 -13.393
  690    HG   SER  88           HG       SER  88   2.348 -54.727 -12.792
  691    H    CYS  89           H        CYS  89   3.853 -55.660 -16.417
  692    HA   CYS  89           HA       CYS  89   3.878 -58.289 -17.530
  693   1HB   CYS  89          2HB       CYS  89   2.661 -56.339 -18.531
  694   2HB   CYS  89          1HB       CYS  89   4.220 -55.659 -18.972
  695    HG   CYS  89           HG       CYS  89   4.793 -58.151 -20.465
  696    H    LEU  90           H        LEU  90   6.270 -55.949 -16.756
  697    HA   LEU  90           HA       LEU  90   8.275 -56.763 -18.586
  698   1HB   LEU  90          2HB       LEU  90   8.306 -54.591 -17.424
  699   2HB   LEU  90          1HB       LEU  90   8.584 -55.414 -15.902
  700    HG   LEU  90           HG       LEU  90  10.754 -56.240 -16.775
  701   1HD1  LEU  90          1HD1      LEU  90  11.661 -55.222 -18.824
  702   2HD1  LEU  90          2HD1      LEU  90  10.094 -54.476 -19.133
  703   3HD1  LEU  90          3HD1      LEU  90  10.254 -56.232 -19.153
  704   1HD2  LEU  90          1HD2      LEU  90  10.374 -53.251 -16.885
  705   2HD2  LEU  90          2HD2      LEU  90  11.912 -54.084 -16.666
  706   3HD2  LEU  90          3HD2      LEU  90  10.658 -54.209 -15.430
  707    H    GLU  91           H        GLU  91   7.741 -57.531 -15.154
  708    HA   GLU  91           HA       GLU  91   9.855 -59.482 -15.149
  709   1HB   GLU  91          2HB       GLU  91   7.709 -58.918 -13.100
  710   2HB   GLU  91          1HB       GLU  91   9.104 -59.958 -12.851
  711   1HG   GLU  91          2HG       GLU  91  10.581 -58.018 -13.205
  712   2HG   GLU  91          1HG       GLU  91   9.157 -56.993 -13.373
  713    H    HIS  92           H        HIS  92   6.321 -59.526 -15.199
  714    HA   HIS  92           HA       HIS  92   6.357 -62.446 -15.379
  715   1HB   HIS  92          2HB       HIS  92   3.961 -60.596 -15.232
  716   2HB   HIS  92          1HB       HIS  92   3.942 -62.349 -15.091
  717    HD1  HIS  92           1HD      HIS  92   4.803 -63.373 -12.827
  718    HD2  HIS  92           2HD      HIS  92   4.668 -59.215 -12.928
  719    HE1  HIS  92           1HE      HIS  92   5.031 -62.621 -10.438
  720    HE2  HIS  92           2HE      HIS  92   4.775 -60.114 -10.507
  721    H    HIS  93           H        HIS  93   7.477 -62.058 -17.492
  722    HA   HIS  93           HA       HIS  93   5.576 -61.429 -19.637
  723   1HB   HIS  93          2HB       HIS  93   7.524 -61.141 -21.099
  724   2HB   HIS  93          1HB       HIS  93   7.642 -60.109 -19.680
  725    HD1  HIS  93           1HD      HIS  93   9.712 -60.336 -18.267
  726    HD2  HIS  93           2HD      HIS  93   9.322 -63.409 -21.045
  727    HE1  HIS  93           1HE      HIS  93  11.870 -61.626 -18.164
  728    HE2  HIS  93           2HE      HIS  93  11.569 -63.546 -19.771
  729    H    HIS  94           H        HIS  94   5.406 -62.815 -21.453
  730    HA   HIS  94           HA       HIS  94   6.383 -65.552 -21.017
  731   1HB   HIS  94          2HB       HIS  94   3.535 -64.734 -21.622
  732   2HB   HIS  94          1HB       HIS  94   4.130 -66.380 -21.805
  733    HD1  HIS  94           1HD      HIS  94   3.023 -63.905 -19.260
  734    HD2  HIS  94           2HD      HIS  94   4.672 -67.726 -19.365
  735    HE1  HIS  94           1HE      HIS  94   2.750 -64.832 -16.933
  736    HE2  HIS  94           2HE      HIS  94   3.586 -67.208 -17.073
  737    H    HIS  95           H        HIS  95   5.927 -66.910 -23.042
  738    HA   HIS  95           HA       HIS  95   6.873 -65.368 -25.331
  739   1HB   HIS  95          2HB       HIS  95   7.970 -67.535 -24.635
  740   2HB   HIS  95          1HB       HIS  95   6.494 -68.364 -25.117
  741    HD1  HIS  95           1HD      HIS  95   9.424 -66.490 -26.538
  742    HD2  HIS  95           2HD      HIS  95   6.198 -68.763 -27.848
  743    HE1  HIS  95           1HE      HIS  95   9.867 -66.956 -28.970
  744    HE2  HIS  95           2HE      HIS  95   8.030 -68.536 -29.660
  745    H    HIS  96           H        HIS  96   5.223 -64.341 -26.274
  746    HA   HIS  96           HA       HIS  96   3.196 -63.866 -27.159
  747   1HB   HIS  96          2HB       HIS  96   3.936 -65.532 -28.847
  748   2HB   HIS  96          1HB       HIS  96   3.158 -66.800 -27.905
  749    HD1  HIS  96           1HD      HIS  96   0.765 -67.259 -28.429
  750    HD2  HIS  96           2HD      HIS  96   2.023 -63.581 -29.913
  751    HE1  HIS  96           1HE      HIS  96  -1.160 -66.386 -29.787
  752    HE2  HIS  96           2HE      HIS  96  -0.297 -64.264 -30.844
  753    H    HIS  97           H        HIS  97   1.998 -67.061 -26.639
  754    HA   HIS  97           HA       HIS  97   1.079 -67.045 -24.056
  755   1HB   HIS  97          2HB       HIS  97  -0.538 -65.291 -25.748
  756   2HB   HIS  97          1HB       HIS  97  -1.485 -66.582 -25.016
  757    HD1  HIS  97           1HD      HIS  97  -0.763 -63.254 -24.378
  758    HD2  HIS  97           2HD      HIS  97  -0.546 -66.678 -22.023
  759    HE1  HIS  97           1HE      HIS  97  -0.819 -62.446 -21.995
  760    HE2  HIS  97           2HE      HIS  97  -0.531 -64.517 -20.590
  Start of MODEL    9
    1   1H    MET   1          1HT       MET   1  -2.609  13.281   2.694
    2   2H    MET   1          2HT       MET   1  -2.062  13.866   4.185
    3   3H    MET   1          3HT       MET   1  -2.294  12.204   3.965
    4    HA   MET   1           HA       MET   1   0.052  12.883   3.924
    5   1HB   MET   1          2HB       MET   1   0.619  11.668   1.811
    6   2HB   MET   1          1HB       MET   1  -0.537  10.815   2.828
    7   1HG   MET   1          2HG       MET   1  -2.353  11.697   1.372
    8   2HG   MET   1          1HG       MET   1  -1.117  12.367   0.317
    9   1HE   MET   1          1HE       MET   1   0.693  10.864  -0.951
   10   2HE   MET   1          2HE       MET   1   0.707   9.100  -0.908
   11   3HE   MET   1          3HE       MET   1   1.113  10.020   0.539
   12    HA   PRO   2           HA       PRO   2   0.217  16.893   1.786
   13   1HB   PRO   2          2HB       PRO   2   2.565  17.294   3.486
   14   2HB   PRO   2          1HB       PRO   2   1.079  18.244   3.395
   15   1HG   PRO   2          2HG       PRO   2   1.669  16.699   5.525
   16   2HG   PRO   2          1HG       PRO   2   0.004  16.959   4.971
   17   1HD   PRO   2          2HD       PRO   2   1.807  14.604   4.523
   18   2HD   PRO   2          1HD       PRO   2   0.075  14.637   4.925
   19    H    THR   3           H        THR   3   2.689  14.513   2.332
   20    HA   THR   3           HA       THR   3   3.759  14.877  -0.293
   21    HB   THR   3           HB       THR   3   4.927  16.724   0.852
   22    HG1  THR   3           1HG      THR   3   6.991  16.161   0.158
   23   1HG2  THR   3          1HG2      THR   3   6.577  16.243   2.601
   24   2HG2  THR   3          2HG2      THR   3   6.057  14.557   2.622
   25   3HG2  THR   3          3HG2      THR   3   4.940  15.829   3.117
   26    H    LYS   4           H        LYS   4   5.637  13.426  -0.645
   27    HA   LYS   4           HA       LYS   4   6.573  11.384  -0.700
   28   1HB   LYS   4          2HB       LYS   4   7.346  11.860   1.578
   29   2HB   LYS   4          1HB       LYS   4   5.836  11.231   2.226
   30   1HG   LYS   4          2HG       LYS   4   7.762   9.653   2.355
   31   2HG   LYS   4          1HG       LYS   4   6.348   9.021   1.508
   32   1HD   LYS   4          2HD       LYS   4   7.389   9.541  -0.637
   33   2HD   LYS   4          1HD       LYS   4   8.794  10.204   0.189
   34   1HE   LYS   4          2HE       LYS   4   9.250   7.997   1.161
   35   2HE   LYS   4          1HE       LYS   4   7.845   7.343   0.316
   36   1HZ   LYS   4          1HZ       LYS   4  10.234   8.546  -0.976
   37   2HZ   LYS   4          2HZ       LYS   4   8.887   7.903  -1.788
   38   3HZ   LYS   4          3HZ       LYS   4   9.899   6.886  -0.882
   39    H    THR   5           H        THR   5   5.633   9.946  -1.893
   40    HA   THR   5           HA       THR   5   3.004   8.919  -1.269
   41    HB   THR   5           HB       THR   5   3.465   7.704  -3.497
   42    HG1  THR   5           1HG      THR   5   5.256   9.603  -4.252
   43   1HG2  THR   5          1HG2      THR   5   2.017   9.683  -3.266
   44   2HG2  THR   5          2HG2      THR   5   2.904   9.684  -4.789
   45   3HG2  THR   5          3HG2      THR   5   3.433  10.717  -3.462
   46    H    TYR   6           H        TYR   6   3.499   6.336  -2.542
   47    HA   TYR   6           HA       TYR   6   3.879   4.668  -0.436
   48   1HB   TYR   6          2HB       TYR   6   4.295   2.878  -2.051
   49   2HB   TYR   6          1HB       TYR   6   2.993   3.926  -2.587
   50    HD1  TYR   6           1HD      TYR   6   4.520   6.162  -3.827
   51    HD2  TYR   6           2HD      TYR   6   5.148   1.962  -3.990
   52    HE1  TYR   6           1HE      TYR   6   5.633   6.423  -5.999
   53    HE2  TYR   6           2HE      TYR   6   6.260   2.210  -6.167
   54    HH   TYR   6           HH       TYR   6   6.097   4.015  -8.122
   55    H    SER   7           H        SER   7   5.473   3.952   0.766
   56    HA   SER   7           HA       SER   7   8.220   4.689   0.096
   57   1HB   SER   7          2HB       SER   7   8.613   4.156   2.531
   58   2HB   SER   7          1HB       SER   7   7.472   5.475   2.249
   59    HG   SER   7           HG       SER   7   6.880   3.732   3.819
   60    H    GLU   8           H        GLU   8   9.658   2.860   1.563
   61    HA   GLU   8           HA       GLU   8   9.605   0.595  -0.157
   62   1HB   GLU   8          2HB       GLU   8  11.463  -0.249   1.101
   63   2HB   GLU   8          1HB       GLU   8  11.683   1.480   0.893
   64   1HG   GLU   8          2HG       GLU   8  11.065   1.908   3.152
   65   2HG   GLU   8          1HG       GLU   8  10.556   0.236   3.387
   66    H    GLU   9           H        GLU   9   8.293   1.272   2.999
   67    HA   GLU   9           HA       GLU   9   7.843  -1.360   3.881
   68   1HB   GLU   9          2HB       GLU   9   7.682   0.689   5.300
   69   2HB   GLU   9          1HB       GLU   9   6.180   1.096   4.485
   70   1HG   GLU   9          2HG       GLU   9   5.681   0.074   6.595
   71   2HG   GLU   9          1HG       GLU   9   5.201  -1.016   5.294
   72    H    PHE  10           H        PHE  10   5.937   0.835   1.898
   73    HA   PHE  10           HA       PHE  10   3.595  -0.720   1.725
   74   1HB   PHE  10          2HB       PHE  10   3.691   1.654   1.072
   75   2HB   PHE  10          1HB       PHE  10   4.738   1.242  -0.282
   76    HD1  PHE  10           1HD      PHE  10   3.845   0.472  -2.325
   77    HD2  PHE  10           2HD      PHE  10   1.328   0.832   1.092
   78    HE1  PHE  10           1HE      PHE  10   1.869   0.118  -3.747
   79    HE2  PHE  10           2HE      PHE  10  -0.651   0.480  -0.326
   80    HZ   PHE  10           HZ       PHE  10  -0.382   0.121  -2.748
   81    H    LYS  11           H        LYS  11   6.530  -0.614  -0.225
   82    HA   LYS  11           HA       LYS  11   5.647  -2.504  -2.155
   83   1HB   LYS  11          2HB       LYS  11   8.487  -1.780  -1.415
   84   2HB   LYS  11          1HB       LYS  11   7.951  -2.529  -2.914
   85   1HG   LYS  11          2HG       LYS  11   6.638  -0.475  -3.401
   86   2HG   LYS  11          1HG       LYS  11   7.348   0.265  -1.966
   87   1HD   LYS  11          2HD       LYS  11   9.589  -0.079  -2.930
   88   2HD   LYS  11          1HD       LYS  11   8.839  -0.739  -4.387
   89   1HE   LYS  11          2HE       LYS  11   7.614   1.419  -4.640
   90   2HE   LYS  11          1HE       LYS  11   8.553   2.051  -3.291
   91   1HZ   LYS  11          1HZ       LYS  11   9.654   1.079  -5.867
   92   2HZ   LYS  11          2HZ       LYS  11  10.578   1.667  -4.576
   93   3HZ   LYS  11          3HZ       LYS  11   9.512   2.693  -5.399
   94    H    ARG  12           H        ARG  12   7.480  -2.732   0.858
   95    HA   ARG  12           HA       ARG  12   8.193  -5.426   0.702
   96   1HB   ARG  12          2HB       ARG  12   9.104  -3.733   2.268
   97   2HB   ARG  12          1HB       ARG  12   7.579  -3.754   3.139
   98   1HG   ARG  12          2HG       ARG  12   7.949  -5.862   4.001
   99   2HG   ARG  12          1HG       ARG  12   9.133  -6.273   2.756
  100   1HD   ARG  12          2HD       ARG  12  10.296  -5.895   4.782
  101   2HD   ARG  12          1HD       ARG  12  10.644  -4.554   3.714
  102    HE   ARG  12           HE       ARG  12   8.493  -3.803   5.331
  103   1HH1  ARG  12          1HH1      ARG  12  11.875  -4.648   5.680
  104   2HH1  ARG  12          2HH1      ARG  12  12.130  -3.636   7.069
  105   1HH2  ARG  12          1HH2      ARG  12   8.797  -2.489   7.174
  106   2HH2  ARG  12          2HH2      ARG  12  10.362  -2.421   7.939
  107    H    ASP  13           H        ASP  13   5.284  -3.839   1.953
  108    HA   ASP  13           HA       ASP  13   4.078  -6.163   3.034
  109   1HB   ASP  13          2HB       ASP  13   3.360  -3.880   3.631
  110   2HB   ASP  13          1HB       ASP  13   2.752  -3.646   1.995
  111    H    ALA  14           H        ALA  14   4.043  -4.702  -0.152
  112    HA   ALA  14           HA       ALA  14   2.024  -6.309  -1.295
  113   1HB   ALA  14          1HB       ALA  14   2.878  -5.526  -3.437
  114   2HB   ALA  14          2HB       ALA  14   4.341  -4.933  -2.647
  115   3HB   ALA  14          3HB       ALA  14   2.780  -4.200  -2.278
  116    H    VAL  15           H        VAL  15   5.495  -6.740  -0.907
  117    HA   VAL  15           HA       VAL  15   5.724  -9.039  -2.552
  118    HB   VAL  15           HB       VAL  15   7.464  -8.174  -0.233
  119   1HG1  VAL  15          1HG1      VAL  15   8.035 -10.143  -2.450
  120   2HG1  VAL  15          2HG1      VAL  15   7.765 -10.544  -0.754
  121   3HG1  VAL  15          3HG1      VAL  15   9.182  -9.605  -1.221
  122   1HG2  VAL  15          1HG2      VAL  15   7.378  -6.491  -1.963
  123   2HG2  VAL  15          2HG2      VAL  15   7.710  -7.704  -3.201
  124   3HG2  VAL  15          3HG2      VAL  15   8.943  -7.304  -2.005
  125    H    ALA  16           H        ALA  16   5.090  -8.548   0.885
  126    HA   ALA  16           HA       ALA  16   5.125 -11.243   1.685
  127   1HB   ALA  16          1HB       ALA  16   3.818 -10.507   3.618
  128   2HB   ALA  16          2HB       ALA  16   3.490  -8.970   2.815
  129   3HB   ALA  16          3HB       ALA  16   5.139  -9.392   3.273
  130    H    LEU  17           H        LEU  17   2.662  -9.274   0.158
  131    HA   LEU  17           HA       LEU  17   0.477 -11.036   0.425
  132   1HB   LEU  17          2HB       LEU  17   1.064  -8.612  -0.992
  133   2HB   LEU  17          1HB       LEU  17   0.293  -9.737  -2.090
  134    HG   LEU  17           HG       LEU  17  -1.457  -8.465  -1.221
  135   1HD1  LEU  17          1HD1      LEU  17  -1.957 -10.840  -1.184
  136   2HD1  LEU  17          2HD1      LEU  17  -2.775 -10.013   0.140
  137   3HD1  LEU  17          3HD1      LEU  17  -1.326 -10.965   0.457
  138   1HD2  LEU  17          1HD2      LEU  17  -0.226  -7.379   0.576
  139   2HD2  LEU  17          2HD2      LEU  17  -0.308  -8.857   1.535
  140   3HD2  LEU  17          3HD2      LEU  17  -1.787  -7.980   1.136
  141    H    TYR  18           H        TYR  18   3.118 -10.872  -1.902
  142    HA   TYR  18           HA       TYR  18   1.939 -12.713  -3.736
  143   1HB   TYR  18          2HB       TYR  18   3.654 -10.961  -4.338
  144   2HB   TYR  18          1HB       TYR  18   4.867 -11.976  -3.564
  145    HD1  TYR  18           1HD      TYR  18   2.160 -12.222  -6.123
  146    HD2  TYR  18           2HD      TYR  18   6.048 -13.460  -4.907
  147    HE1  TYR  18           1HE      TYR  18   2.407 -13.474  -8.221
  148    HE2  TYR  18           2HE      TYR  18   6.307 -14.717  -7.007
  149    HH   TYR  18           HH       TYR  18   5.053 -15.653  -8.776
  150    H    GLU  19           H        GLU  19   3.967 -13.039  -0.912
  151    HA   GLU  19           HA       GLU  19   4.784 -15.714  -1.348
  152   1HB   GLU  19          2HB       GLU  19   4.353 -14.137   1.188
  153   2HB   GLU  19          1HB       GLU  19   4.919 -15.801   1.194
  154   1HG   GLU  19          2HG       GLU  19   6.820 -15.058  -0.258
  155   2HG   GLU  19          1HG       GLU  19   6.296 -13.399   0.031
  156    H    ASN  20           H        ASN  20   1.849 -14.266  -0.241
  157    HA   ASN  20           HA       ASN  20   0.682 -16.819   0.550
  158   1HB   ASN  20          2HB       ASN  20  -0.260 -13.956   0.741
  159   2HB   ASN  20          1HB       ASN  20  -1.298 -15.319   1.133
  160   1HD2  ASN  20          1HD2      ASN  20   1.468 -13.441   2.112
  161   2HD2  ASN  20          2HD2      ASN  20   1.600 -14.115   3.699
  162    H    SER  21           H        SER  21   1.379 -16.599  -2.134
  163    HA   SER  21           HA       SER  21  -0.634 -15.563  -3.806
  164   1HB   SER  21          2HB       SER  21   0.474 -16.904  -5.572
  165   2HB   SER  21          1HB       SER  21   1.598 -15.906  -4.646
  166    HG   SER  21           HG       SER  21   2.579 -17.829  -4.627
  167    H    ASP  22           H        ASP  22  -0.442 -18.499  -2.047
  168    HA   ASP  22           HA       ASP  22  -1.896 -20.282  -3.558
  169   1HB   ASP  22          2HB       ASP  22  -0.909 -20.863  -1.380
  170   2HB   ASP  22          1HB       ASP  22  -2.115 -19.867  -0.571
  171    H    GLY  23           H        GLY  23  -3.105 -17.765  -1.422
  172   1HA   GLY  23          2HA       GLY  23  -5.749 -18.088  -2.691
  173   2HA   GLY  23          1HA       GLY  23  -5.511 -17.500  -1.051
  174    H    ALA  24           H        ALA  24  -3.269 -16.402  -3.423
  175    HA   ALA  24           HA       ALA  24  -4.785 -14.004  -4.023
  176   1HB   ALA  24          1HB       ALA  24  -3.173 -12.467  -3.071
  177   2HB   ALA  24          2HB       ALA  24  -2.206 -13.813  -2.469
  178   3HB   ALA  24          3HB       ALA  24  -3.816 -13.520  -1.812
  179    H    SER  25           H        SER  25  -4.571 -14.376  -6.163
  180    HA   SER  25           HA       SER  25  -2.112 -15.209  -7.355
  181   1HB   SER  25          2HB       SER  25  -3.509 -14.708  -9.489
  182   2HB   SER  25          1HB       SER  25  -4.014 -16.020  -8.426
  183    HG   SER  25           HG       SER  25  -5.392 -13.860  -9.146
  184    H    LEU  26           H        LEU  26  -1.083 -14.032  -9.145
  185    HA   LEU  26           HA       LEU  26  -0.062 -11.588  -8.294
  186   1HB   LEU  26          2HB       LEU  26   0.787 -13.341 -10.050
  187   2HB   LEU  26          1HB       LEU  26  -0.086 -12.343 -11.195
  188    HG   LEU  26           HG       LEU  26   2.105 -11.293  -9.401
  189   1HD1  LEU  26          1HD1      LEU  26   3.521 -11.378 -11.406
  190   2HD1  LEU  26          2HD1      LEU  26   2.232 -12.219 -12.267
  191   3HD1  LEU  26          3HD1      LEU  26   3.014 -12.985 -10.884
  192   1HD2  LEU  26          1HD2      LEU  26   2.141  -9.427 -10.985
  193   2HD2  LEU  26          2HD2      LEU  26   0.559  -9.582 -10.220
  194   3HD2  LEU  26          3HD2      LEU  26   0.799 -10.150 -11.872
  195    H    GLN  27           H        GLN  27  -2.466 -12.240 -10.852
  196    HA   GLN  27           HA       GLN  27  -2.963  -9.596 -11.614
  197   1HB   GLN  27          2HB       GLN  27  -3.794 -11.802 -12.669
  198   2HB   GLN  27          1HB       GLN  27  -5.105 -11.718 -11.504
  199   1HG   GLN  27          2HG       GLN  27  -4.512  -9.497 -13.436
  200   2HG   GLN  27          1HG       GLN  27  -5.576 -10.841 -13.828
  201   1HE2  GLN  27          1HE2      GLN  27  -6.125  -8.009 -13.664
  202   2HE2  GLN  27          2HE2      GLN  27  -7.390  -7.820 -12.505
  203    H    GLN  28           H        GLN  28  -4.398 -11.571  -9.082
  204    HA   GLN  28           HA       GLN  28  -6.387  -9.737  -8.305
  205   1HB   GLN  28          2HB       GLN  28  -5.348 -12.302  -7.392
  206   2HB   GLN  28          1HB       GLN  28  -5.882 -11.284  -6.068
  207   1HG   GLN  28          2HG       GLN  28  -7.677 -12.732  -6.824
  208   2HG   GLN  28          1HG       GLN  28  -8.069 -11.040  -7.125
  209   1HE2  GLN  28          1HE2      GLN  28  -9.544 -11.527  -8.721
  210   2HE2  GLN  28          2HE2      GLN  28  -9.064 -12.097 -10.284
  211    H    ILE  29           H        ILE  29  -3.042 -10.196  -7.247
  212    HA   ILE  29           HA       ILE  29  -3.132  -8.493  -4.997
  213    HB   ILE  29           HB       ILE  29  -0.761  -8.987  -6.816
  214   1HG1  ILE  29          2HG1      ILE  29  -1.684 -11.086  -5.919
  215   2HG1  ILE  29          1HG1      ILE  29  -0.110 -10.721  -5.206
  216   1HG2  ILE  29          1HG2      ILE  29  -0.898  -8.012  -3.963
  217   2HG2  ILE  29          2HG2      ILE  29  -0.469  -7.042  -5.373
  218   3HG2  ILE  29          3HG2      ILE  29   0.580  -8.364  -4.858
  219   1HD1  ILE  29          1HD1      ILE  29  -1.288  -9.828  -3.223
  220   2HD1  ILE  29          2HD1      ILE  29  -1.585 -11.539  -3.512
  221   3HD1  ILE  29          3HD1      ILE  29  -2.818 -10.348  -3.931
  222    H    ALA  30           H        ALA  30  -2.158  -7.857  -8.352
  223    HA   ALA  30           HA       ALA  30  -1.747  -5.074  -7.972
  224   1HB   ALA  30          1HB       ALA  30  -1.639  -4.962 -10.403
  225   2HB   ALA  30          2HB       ALA  30  -2.307  -6.590 -10.520
  226   3HB   ALA  30          3HB       ALA  30  -0.715  -6.340  -9.802
  227    H    ASN  31           H        ASN  31  -4.495  -7.038  -8.710
  228    HA   ASN  31           HA       ASN  31  -6.217  -5.043  -9.733
  229   1HB   ASN  31          2HB       ASN  31  -6.343  -7.698  -9.692
  230   2HB   ASN  31          1HB       ASN  31  -7.282  -7.404  -8.234
  231   1HD2  ASN  31          1HD2      ASN  31  -8.028  -8.560 -10.770
  232   2HD2  ASN  31          2HD2      ASN  31  -9.335  -7.606 -11.391
  233    H    ASP  32           H        ASP  32  -5.732  -6.395  -6.498
  234    HA   ASP  32           HA       ASP  32  -7.809  -4.966  -5.218
  235   1HB   ASP  32          2HB       ASP  32  -6.659  -7.008  -4.298
  236   2HB   ASP  32          1HB       ASP  32  -5.261  -6.001  -3.951
  237    H    LEU  33           H        LEU  33  -4.311  -4.381  -5.377
  238    HA   LEU  33           HA       LEU  33  -4.452  -1.953  -3.894
  239   1HB   LEU  33          2HB       LEU  33  -2.304  -3.333  -5.461
  240   2HB   LEU  33          1HB       LEU  33  -2.059  -1.703  -4.877
  241    HG   LEU  33           HG       LEU  33  -2.465  -2.527  -2.554
  242   1HD1  LEU  33          1HD1      LEU  33  -2.336  -4.928  -2.124
  243   2HD1  LEU  33          2HD1      LEU  33  -2.376  -5.242  -3.859
  244   3HD1  LEU  33          3HD1      LEU  33  -3.770  -4.512  -3.063
  245   1HD2  LEU  33          1HD2      LEU  33  -0.289  -3.582  -2.312
  246   2HD2  LEU  33          2HD2      LEU  33  -0.211  -2.226  -3.437
  247   3HD2  LEU  33          3HD2      LEU  33  -0.227  -3.880  -4.050
  248    H    GLY  34           H        GLY  34  -4.604  -2.770  -7.270
  249   1HA   GLY  34          2HA       GLY  34  -5.371  -1.435  -9.009
  250   2HA   GLY  34          1HA       GLY  34  -5.365  -0.056  -7.918
  251    H    ILE  35           H        ILE  35  -2.812  -2.304  -8.916
  252    HA   ILE  35           HA       ILE  35  -1.299  -0.013  -9.973
  253    HB   ILE  35           HB       ILE  35   0.776  -1.060  -9.074
  254   1HG1  ILE  35          2HG1      ILE  35  -1.152  -2.740  -7.458
  255   2HG1  ILE  35          1HG1      ILE  35  -0.123  -3.336  -8.755
  256   1HG2  ILE  35          1HG2      ILE  35  -1.281  -0.192  -7.051
  257   2HG2  ILE  35          2HG2      ILE  35  -0.168   0.845  -7.945
  258   3HG2  ILE  35          3HG2      ILE  35   0.454  -0.291  -6.749
  259   1HD1  ILE  35          1HD1      ILE  35   0.822  -2.156  -6.154
  260   2HD1  ILE  35          2HD1      ILE  35   1.854  -2.761  -7.450
  261   3HD1  ILE  35          3HD1      ILE  35   0.797  -3.868  -6.575
  262    H    ASN  36           H        ASN  36   0.662  -0.861 -11.283
  263    HA   ASN  36           HA       ASN  36  -0.318  -2.746 -13.203
  264   1HB   ASN  36          2HB       ASN  36   1.136  -0.736 -13.734
  265   2HB   ASN  36          1HB       ASN  36   2.478  -1.619 -13.026
  266   1HD2  ASN  36          1HD2      ASN  36   0.193  -1.494 -15.617
  267   2HD2  ASN  36          2HD2      ASN  36   1.029  -2.573 -16.671
  268    H    ARG  37           H        ARG  37   0.478  -4.781 -13.647
  269    HA   ARG  37           HA       ARG  37   1.293  -6.251 -11.373
  270   1HB   ARG  37          2HB       ARG  37   0.995  -8.148 -12.693
  271   2HB   ARG  37          1HB       ARG  37  -0.195  -7.022 -13.294
  272   1HG   ARG  37          2HG       ARG  37   1.241  -6.529 -15.200
  273   2HG   ARG  37          1HG       ARG  37   2.461  -7.643 -14.575
  274   1HD   ARG  37          2HD       ARG  37   0.538  -9.371 -14.591
  275   2HD   ARG  37          1HD       ARG  37  -0.251  -8.241 -15.688
  276    HE   ARG  37           HE       ARG  37   2.273  -8.616 -16.717
  277   1HH1  ARG  37          1HH1      ARG  37  -0.531 -10.603 -16.018
  278   2HH1  ARG  37          2HH1      ARG  37  -0.119 -11.823 -17.187
  279   1HH2  ARG  37          1HH2      ARG  37   2.825 -10.201 -18.230
  280   2HH2  ARG  37          2HH2      ARG  37   1.824 -11.612 -18.431
  281    H    VAL  38           H        VAL  38   2.964  -4.906 -14.122
  282    HA   VAL  38           HA       VAL  38   5.398  -6.354 -13.745
  283    HB   VAL  38           HB       VAL  38   4.952  -3.731 -15.194
  284   1HG1  VAL  38          1HG1      VAL  38   7.228  -5.699 -15.362
  285   2HG1  VAL  38          2HG1      VAL  38   7.288  -4.101 -14.617
  286   3HG1  VAL  38          3HG1      VAL  38   7.033  -4.255 -16.356
  287   1HG2  VAL  38          1HG2      VAL  38   3.579  -5.547 -16.089
  288   2HG2  VAL  38          2HG2      VAL  38   5.019  -6.552 -16.263
  289   3HG2  VAL  38          3HG2      VAL  38   4.848  -5.081 -17.221
  290    H    THR  39           H        THR  39   4.202  -3.151 -12.783
  291    HA   THR  39           HA       THR  39   6.506  -2.251 -11.465
  292    HB   THR  39           HB       THR  39   3.627  -1.706 -10.689
  293    HG1  THR  39           1HG      THR  39   5.317  -0.698 -12.721
  294   1HG2  THR  39          1HG2      THR  39   5.259  -0.996  -8.993
  295   2HG2  THR  39          2HG2      THR  39   4.497   0.389  -9.778
  296   3HG2  THR  39          3HG2      THR  39   6.138  -0.089 -10.219
  297    H    LEU  40           H        LEU  40   3.749  -4.133 -10.269
  298    HA   LEU  40           HA       LEU  40   4.580  -4.534  -7.637
  299   1HB   LEU  40          2HB       LEU  40   2.361  -5.137  -8.421
  300   2HB   LEU  40          1HB       LEU  40   3.036  -6.345  -9.495
  301    HG   LEU  40           HG       LEU  40   3.850  -7.582  -7.472
  302   1HD1  LEU  40          1HD1      LEU  40   3.873  -5.731  -5.896
  303   2HD1  LEU  40          2HD1      LEU  40   2.835  -7.033  -5.316
  304   3HD1  LEU  40          3HD1      LEU  40   2.120  -5.584  -6.023
  305   1HD2  LEU  40          1HD2      LEU  40   1.658  -8.502  -6.920
  306   2HD2  LEU  40          2HD2      LEU  40   1.816  -8.230  -8.655
  307   3HD2  LEU  40          3HD2      LEU  40   0.878  -7.109  -7.668
  308    H    LYS  41           H        LYS  41   5.168  -6.503 -10.523
  309    HA   LYS  41           HA       LYS  41   6.713  -8.532  -9.429
  310   1HB   LYS  41          2HB       LYS  41   5.816  -8.436 -11.751
  311   2HB   LYS  41          1HB       LYS  41   7.046  -7.256 -12.148
  312   1HG   LYS  41          2HG       LYS  41   8.790  -8.890 -11.697
  313   2HG   LYS  41          1HG       LYS  41   7.563 -10.085 -11.265
  314   1HD   LYS  41          2HD       LYS  41   6.663 -10.027 -13.514
  315   2HD   LYS  41          1HD       LYS  41   7.784  -8.740 -13.961
  316   1HE   LYS  41          2HE       LYS  41   8.620 -11.495 -13.063
  317   2HE   LYS  41          1HE       LYS  41   8.463 -11.003 -14.748
  318   1HZ   LYS  41          1HZ       LYS  41  10.216  -9.463 -14.514
  319   2HZ   LYS  41          2HZ       LYS  41  10.763 -10.895 -13.785
  320   3HZ   LYS  41          3HZ       LYS  41  10.230  -9.602 -12.829
  321    H    ASN  42           H        ASN  42   7.695  -5.401 -10.707
  322    HA   ASN  42           HA       ASN  42  10.459  -5.652 -10.466
  323   1HB   ASN  42          2HB       ASN  42   8.686  -3.223 -10.240
  324   2HB   ASN  42          1HB       ASN  42  10.441  -3.128 -10.236
  325   1HD2  ASN  42          1HD2      ASN  42   8.668  -1.935 -12.097
  326   2HD2  ASN  42          2HD2      ASN  42   9.029  -2.599 -13.658
  327    H    TRP  43           H        TRP  43   8.057  -4.710  -8.054
  328    HA   TRP  43           HA       TRP  43   9.974  -4.032  -6.043
  329   1HB   TRP  43          2HB       TRP  43   7.071  -4.838  -5.719
  330   2HB   TRP  43          1HB       TRP  43   8.071  -4.098  -4.479
  331    HD1  TRP  43           HD       TRP  43   9.183  -2.034  -7.060
  332    HE1  TRP  43           1HE      TRP  43   7.705   0.050  -7.426
  333    HE3  TRP  43           3HE      TRP  43   4.974  -3.590  -4.621
  334    HZ2  TRP  43           2HZ      TRP  43   5.096   0.907  -6.761
  335    HZ3  TRP  43           3HZ      TRP  43   3.034  -2.083  -4.534
  336    HH2  TRP  43           HH       TRP  43   3.097   0.117  -5.583
  337    H    ILE  44           H        ILE  44   8.062  -6.894  -6.807
  338    HA   ILE  44           HA       ILE  44   8.631  -8.475  -4.602
  339    HB   ILE  44           HB       ILE  44   8.227  -9.374  -7.466
  340   1HG1  ILE  44          2HG1      ILE  44   6.245  -9.148  -5.186
  341   2HG1  ILE  44          1HG1      ILE  44   6.394  -7.993  -6.505
  342   1HG2  ILE  44          1HG2      ILE  44   7.986 -10.940  -4.900
  343   2HG2  ILE  44          2HG2      ILE  44   9.225 -11.144  -6.137
  344   3HG2  ILE  44          3HG2      ILE  44   7.543 -11.526  -6.505
  345   1HD1  ILE  44          1HD1      ILE  44   5.794  -9.748  -8.096
  346   2HD1  ILE  44          2HD1      ILE  44   4.545  -9.492  -6.877
  347   3HD1  ILE  44          3HD1      ILE  44   5.621 -10.883  -6.757
  348    H    ILE  45           H        ILE  45  10.472  -8.135  -7.627
  349    HA   ILE  45           HA       ILE  45  12.434 -10.074  -6.967
  350    HB   ILE  45           HB       ILE  45  12.638  -7.713  -8.851
  351   1HG1  ILE  45          2HG1      ILE  45  11.962 -10.617  -9.375
  352   2HG1  ILE  45          1HG1      ILE  45  10.811  -9.286  -9.389
  353   1HG2  ILE  45          1HG2      ILE  45  14.341 -10.196  -8.652
  354   2HG2  ILE  45          2HG2      ILE  45  14.842  -8.560  -8.223
  355   3HG2  ILE  45          3HG2      ILE  45  14.471  -8.958  -9.902
  356   1HD1  ILE  45          1HD1      ILE  45  11.453  -9.936 -11.641
  357   2HD1  ILE  45          2HD1      ILE  45  13.145  -9.615 -11.257
  358   3HD1  ILE  45          3HD1      ILE  45  11.980  -8.292 -11.280
  359    H    LYS  46           H        LYS  46  12.308  -6.552  -6.564
  360    HA   LYS  46           HA       LYS  46  14.987  -6.291  -5.706
  361   1HB   LYS  46          2HB       LYS  46  12.601  -4.459  -5.498
  362   2HB   LYS  46          1HB       LYS  46  14.222  -4.000  -5.022
  363   1HG   LYS  46          2HG       LYS  46  14.997  -4.459  -7.321
  364   2HG   LYS  46          1HG       LYS  46  13.327  -4.800  -7.774
  365   1HD   LYS  46          2HD       LYS  46  12.694  -2.519  -7.130
  366   2HD   LYS  46          1HD       LYS  46  14.372  -2.181  -6.700
  367   1HE   LYS  46          2HE       LYS  46  13.989  -1.289  -8.882
  368   2HE   LYS  46          1HE       LYS  46  14.997  -2.725  -9.065
  369   1HZ   LYS  46          1HZ       LYS  46  13.421  -3.049 -10.689
  370   2HZ   LYS  46          2HZ       LYS  46  12.177  -2.322  -9.796
  371   3HZ   LYS  46          3HZ       LYS  46  12.706  -3.883  -9.399
  372    H    TYR  47           H        TYR  47  11.903  -6.261  -3.911
  373    HA   TYR  47           HA       TYR  47  13.331  -6.063  -1.400
  374   1HB   TYR  47          2HB       TYR  47  10.402  -6.219  -2.091
  375   2HB   TYR  47          1HB       TYR  47  10.988  -6.190  -0.430
  376    HD1  TYR  47           1HD      TYR  47  10.836  -4.268  -3.586
  377    HD2  TYR  47           2HD      TYR  47  11.693  -4.157   0.581
  378    HE1  TYR  47           1HE      TYR  47  10.948  -1.818  -3.678
  379    HE2  TYR  47           2HE      TYR  47  11.808  -1.702   0.499
  380    HH   TYR  47           HH       TYR  47  12.103   0.076  -1.004
  381    H    GLY  48           H        GLY  48  11.975  -8.555  -3.372
  382   1HA   GLY  48          2HA       GLY  48  11.744 -10.570  -1.379
  383   2HA   GLY  48          1HA       GLY  48  11.925 -10.841  -3.109
  384    H    SER  49           H        SER  49  14.384  -9.369  -3.328
  385    HA   SER  49           HA       SER  49  16.248 -11.343  -2.440
  386   1HB   SER  49          2HB       SER  49  16.767  -8.643  -3.699
  387   2HB   SER  49          1HB       SER  49  17.935  -9.954  -3.538
  388    HG   SER  49           HG       SER  49  15.689  -9.754  -5.226
  389    H    ASN  50           H        ASN  50  15.818  -7.889  -1.755
  390    HA   ASN  50           HA       ASN  50  16.187  -8.112   1.017
  391   1HB   ASN  50          2HB       ASN  50  18.514  -8.660   0.444
  392   2HB   ASN  50          1HB       ASN  50  18.634  -7.191  -0.516
  393   1HD2  ASN  50          1HD2      ASN  50  20.276  -6.305   0.639
  394   2HD2  ASN  50          2HD2      ASN  50  20.093  -5.738   2.267
  395    H    HIS  51           H        HIS  51  17.402  -5.874  -1.449
  396    HA   HIS  51           HA       HIS  51  15.418  -3.875  -0.956
  397   1HB   HIS  51          2HB       HIS  51  18.008  -3.742   0.511
  398   2HB   HIS  51          1HB       HIS  51  17.439  -2.246  -0.217
  399    HD1  HIS  51           1HD      HIS  51  17.247  -4.067   2.852
  400    HD2  HIS  51           2HD      HIS  51  14.606  -1.713   0.665
  401    HE1  HIS  51           1HE      HIS  51  15.464  -3.363   4.473
  402    HE2  HIS  51           2HE      HIS  51  13.981  -1.779   3.175
  403    H    ASN  52           H        ASN  52  15.782  -1.939  -2.282
  404    HA   ASN  52           HA       ASN  52  17.358  -2.571  -4.624
  405   1HB   ASN  52          2HB       ASN  52  16.229  -0.414  -5.486
  406   2HB   ASN  52          1HB       ASN  52  15.252  -1.860  -5.310
  407   1HD2  ASN  52          1HD2      ASN  52  13.746  -1.962  -3.637
  408   2HD2  ASN  52          2HD2      ASN  52  13.186  -0.538  -2.827
  409    H    VAL  53           H        VAL  53  19.311  -2.331  -3.424
  410    HA   VAL  53           HA       VAL  53  20.203   0.228  -2.519
  411    HB   VAL  53           HB       VAL  53  21.869  -2.182  -3.277
  412   1HG1  VAL  53          1HG1      VAL  53  23.512  -1.289  -1.727
  413   2HG1  VAL  53          2HG1      VAL  53  22.475   0.102  -1.412
  414   3HG1  VAL  53          3HG1      VAL  53  23.168  -0.136  -3.017
  415   1HG2  VAL  53          1HG2      VAL  53  21.741  -2.851  -0.933
  416   2HG2  VAL  53          2HG2      VAL  53  20.131  -2.784  -1.655
  417   3HG2  VAL  53          3HG2      VAL  53  20.674  -1.485  -0.595
  418    H    GLN  54           H        GLN  54  19.948  -1.333  -5.525
  419    HA   GLN  54           HA       GLN  54  20.603  -0.927  -7.635
  420   1HB   GLN  54          2HB       GLN  54  19.635   1.341  -7.055
  421   2HB   GLN  54          1HB       GLN  54  21.286   1.880  -6.765
  422   1HG   GLN  54          2HG       GLN  54  20.487   2.484  -9.005
  423   2HG   GLN  54          1HG       GLN  54  21.881   1.406  -9.063
  424   1HE2  GLN  54          1HE2      GLN  54  18.455   1.693  -9.609
  425   2HE2  GLN  54          2HE2      GLN  54  18.271   0.230 -10.518
  426    H    GLY  55           H        GLY  55  22.303  -2.398  -7.294
  427   1HA   GLY  55          2HA       GLY  55  24.930  -1.122  -7.589
  428   2HA   GLY  55          1HA       GLY  55  24.729  -2.379  -6.368
  429    H    THR  56           H        THR  56  25.245  -1.695  -9.650
  430    HA   THR  56           HA       THR  56  25.629  -4.472 -10.253
  431    HB   THR  56           HB       THR  56  23.833  -2.936 -12.066
  432    HG1  THR  56           1HG      THR  56  23.226  -4.291  -9.714
  433   1HG2  THR  56          1HG2      THR  56  24.376  -5.879 -11.755
  434   2HG2  THR  56          2HG2      THR  56  25.019  -4.840 -13.029
  435   3HG2  THR  56          3HG2      THR  56  23.285  -5.158 -12.934
  436    H    THR  57           H        THR  57  27.555  -4.359 -10.941
  437    HA   THR  57           HA       THR  57  28.263  -2.463 -13.077
  438    HB   THR  57           HB       THR  57  30.128  -3.494 -10.917
  439    HG1  THR  57           1HG      THR  57  28.428  -1.342 -11.036
  440   1HG2  THR  57          1HG2      THR  57  31.238  -3.017 -13.065
  441   2HG2  THR  57          2HG2      THR  57  31.720  -1.873 -11.815
  442   3HG2  THR  57          3HG2      THR  57  30.556  -1.388 -13.049
  443    HA   PRO  58           HA       PRO  58  28.868  -6.229 -15.348
  444   1HB   PRO  58          2HB       PRO  58  30.422  -5.222 -17.369
  445   2HB   PRO  58          1HB       PRO  58  28.664  -5.065 -17.289
  446   1HG   PRO  58          2HG       PRO  58  30.780  -3.091 -16.537
  447   2HG   PRO  58          1HG       PRO  58  29.244  -2.824 -17.382
  448   1HD   PRO  58          2HD       PRO  58  29.554  -2.249 -14.766
  449   2HD   PRO  58          1HD       PRO  58  28.015  -2.842 -15.424
  450    H    SER  59           H        SER  59  30.254  -6.822 -13.375
  451    HA   SER  59           HA       SER  59  33.088  -6.862 -13.729
  452   1HB   SER  59          2HB       SER  59  32.837  -8.730 -11.943
  453   2HB   SER  59          1HB       SER  59  32.355  -7.091 -11.497
  454    HG   SER  59           HG       SER  59  30.759  -9.340 -12.063
  455    H    ALA  60           H        ALA  60  30.421  -8.742 -14.821
  456    HA   ALA  60           HA       ALA  60  31.783 -11.134 -15.458
  457   1HB   ALA  60          1HB       ALA  60  29.807 -11.690 -16.748
  458   2HB   ALA  60          2HB       ALA  60  29.262 -10.014 -16.667
  459   3HB   ALA  60          3HB       ALA  60  29.352 -10.985 -15.197
  460    H    ALA  61           H        ALA  61  31.817  -8.067 -16.926
  461    HA   ALA  61           HA       ALA  61  32.057  -8.929 -19.642
  462   1HB   ALA  61          1HB       ALA  61  31.069  -6.767 -19.052
  463   2HB   ALA  61          2HB       ALA  61  32.435  -6.587 -20.152
  464   3HB   ALA  61          3HB       ALA  61  32.632  -6.230 -18.436
  465    H    VAL  62           H        VAL  62  34.173  -9.267 -17.201
  466    HA   VAL  62           HA       VAL  62  36.604  -8.350 -18.338
  467    HB   VAL  62           HB       VAL  62  36.151 -10.525 -16.282
  468   1HG1  VAL  62          1HG1      VAL  62  38.678  -9.066 -17.041
  469   2HG1  VAL  62          2HG1      VAL  62  38.319 -10.764 -17.358
  470   3HG1  VAL  62          3HG1      VAL  62  38.505 -10.197 -15.698
  471   1HG2  VAL  62          1HG2      VAL  62  35.326  -8.327 -15.587
  472   2HG2  VAL  62          2HG2      VAL  62  36.896  -7.615 -15.955
  473   3HG2  VAL  62          3HG2      VAL  62  36.746  -8.796 -14.655
  474    H    SER  63           H        SER  63  34.711 -11.244 -18.691
  475    HA   SER  63           HA       SER  63  36.658 -12.910 -19.857
  476   1HB   SER  63          2HB       SER  63  33.662 -12.911 -20.281
  477   2HB   SER  63          1HB       SER  63  34.757 -14.242 -20.653
  478    HG   SER  63           HG       SER  63  33.724 -14.500 -18.617
  479    H    GLU  64           H        GLU  64  34.369 -10.590 -21.264
  480    HA   GLU  64           HA       GLU  64  35.238 -11.114 -23.947
  481   1HB   GLU  64          2HB       GLU  64  32.955 -10.270 -23.379
  482   2HB   GLU  64          1HB       GLU  64  33.691  -8.742 -22.920
  483   1HG   GLU  64          2HG       GLU  64  32.760  -8.605 -25.147
  484   2HG   GLU  64          1HG       GLU  64  34.516  -8.448 -25.201
  485    H    ALA  65           H        ALA  65  35.974  -8.815 -21.441
  486    HA   ALA  65           HA       ALA  65  37.450  -6.961 -22.938
  487   1HB   ALA  65          1HB       ALA  65  38.388  -6.230 -20.829
  488   2HB   ALA  65          2HB       ALA  65  37.851  -7.717 -20.048
  489   3HB   ALA  65          3HB       ALA  65  36.663  -6.553 -20.639
  490    H    GLU  66           H        GLU  66  38.248 -10.119 -21.778
  491    HA   GLU  66           HA       GLU  66  41.053  -9.968 -21.892
  492   1HB   GLU  66          2HB       GLU  66  39.696 -11.815 -20.866
  493   2HB   GLU  66          1HB       GLU  66  39.341 -12.383 -22.489
  494   1HG   GLU  66          2HG       GLU  66  41.583 -12.969 -22.893
  495   2HG   GLU  66          1HG       GLU  66  42.151 -12.072 -21.485
  496    H    GLN  67           H        GLN  67  38.616 -10.632 -24.358
  497    HA   GLN  67           HA       GLN  67  40.603 -10.932 -26.429
  498   1HB   GLN  67          2HB       GLN  67  37.605 -10.588 -26.562
  499   2HB   GLN  67          1HB       GLN  67  38.619 -10.720 -27.991
  500   1HG   GLN  67          2HG       GLN  67  37.863 -12.879 -27.705
  501   2HG   GLN  67          1HG       GLN  67  39.445 -12.920 -26.931
  502   1HE2  GLN  67          1HE2      GLN  67  36.511 -11.491 -25.621
  503   2HE2  GLN  67          2HE2      GLN  67  36.382 -12.582 -24.278
  504    H    ILE  68           H        ILE  68  38.479  -8.399 -25.256
  505    HA   ILE  68           HA       ILE  68  38.824  -6.514 -27.269
  506    HB   ILE  68           HB       ILE  68  38.324  -6.051 -24.330
  507   1HG1  ILE  68          2HG1      ILE  68  36.434  -6.151 -26.695
  508   2HG1  ILE  68          1HG1      ILE  68  36.621  -7.423 -25.490
  509   1HG2  ILE  68          1HG2      ILE  68  38.011  -4.152 -26.654
  510   2HG2  ILE  68          2HG2      ILE  68  39.187  -4.019 -25.348
  511   3HG2  ILE  68          3HG2      ILE  68  37.467  -3.845 -25.004
  512   1HD1  ILE  68          1HD1      ILE  68  35.818  -5.883 -23.763
  513   2HD1  ILE  68          2HD1      ILE  68  34.640  -6.103 -25.057
  514   3HD1  ILE  68          3HD1      ILE  68  35.610  -4.631 -24.989
  515    H    ARG  69           H        ARG  69  40.779  -7.013 -24.341
  516    HA   ARG  69           HA       ARG  69  42.422  -4.777 -24.605
  517   1HB   ARG  69          2HB       ARG  69  44.103  -6.083 -23.266
  518   2HB   ARG  69          1HB       ARG  69  42.498  -6.001 -22.554
  519   1HG   ARG  69          2HG       ARG  69  42.019  -8.254 -23.383
  520   2HG   ARG  69          1HG       ARG  69  43.634  -8.333 -24.084
  521   1HD   ARG  69          2HD       ARG  69  43.225  -7.800 -21.163
  522   2HD   ARG  69          1HD       ARG  69  43.231  -9.441 -21.801
  523    HE   ARG  69           HE       ARG  69  45.520  -7.639 -22.244
  524   1HH1  ARG  69          1HH1      ARG  69  44.183 -10.622 -20.996
  525   2HH1  ARG  69          2HH1      ARG  69  45.727 -11.337 -20.664
  526   1HH2  ARG  69          1HH2      ARG  69  47.581  -8.580 -21.820
  527   2HH2  ARG  69          2HH2      ARG  69  47.662 -10.183 -21.143
  528    H    GLN  70           H        GLN  70  42.803  -7.998 -26.020
  529    HA   GLN  70           HA       GLN  70  45.352  -7.367 -27.178
  530   1HB   GLN  70          2HB       GLN  70  43.912  -9.663 -26.524
  531   2HB   GLN  70          1HB       GLN  70  44.003  -9.678 -28.274
  532   1HG   GLN  70          2HG       GLN  70  46.359  -9.432 -26.420
  533   2HG   GLN  70          1HG       GLN  70  45.821 -10.919 -27.195
  534   1HE2  GLN  70          1HE2      GLN  70  46.079 -11.159 -29.408
  535   2HE2  GLN  70          2HE2      GLN  70  47.186 -10.184 -30.318
  536    H    LEU  71           H        LEU  71  42.025  -7.229 -28.126
  537    HA   LEU  71           HA       LEU  71  42.554  -7.177 -30.957
  538   1HB   LEU  71          2HB       LEU  71  40.484  -8.145 -30.063
  539   2HB   LEU  71          1HB       LEU  71  40.025  -6.581 -29.420
  540    HG   LEU  71           HG       LEU  71  39.928  -5.691 -31.733
  541   1HD1  LEU  71          1HD1      LEU  71  40.362  -8.567 -32.528
  542   2HD1  LEU  71          2HD1      LEU  71  41.498  -7.241 -32.778
  543   3HD1  LEU  71          3HD1      LEU  71  39.945  -7.240 -33.614
  544   1HD2  LEU  71          1HD2      LEU  71  38.214  -8.116 -31.215
  545   2HD2  LEU  71          2HD2      LEU  71  37.854  -6.821 -32.356
  546   3HD2  LEU  71          3HD2      LEU  71  37.909  -6.483 -30.626
  547    H    LYS  72           H        LYS  72  41.605  -4.807 -28.488
  548    HA   LYS  72           HA       LYS  72  41.339  -2.684 -30.379
  549   1HB   LYS  72          2HB       LYS  72  40.053  -2.686 -28.300
  550   2HB   LYS  72          1HB       LYS  72  41.540  -2.581 -27.368
  551   1HG   LYS  72          2HG       LYS  72  42.005  -0.399 -28.271
  552   2HG   LYS  72          1HG       LYS  72  40.603  -0.512 -29.336
  553   1HD   LYS  72          2HD       LYS  72  39.145  -0.635 -27.348
  554   2HD   LYS  72          1HD       LYS  72  40.565  -0.429 -26.323
  555   1HE   LYS  72          2HE       LYS  72  39.326   1.677 -26.687
  556   2HE   LYS  72          1HE       LYS  72  40.991   1.744 -27.267
  557   1HZ   LYS  72          1HZ       LYS  72  38.676   1.155 -29.030
  558   2HZ   LYS  72          2HZ       LYS  72  40.268   1.515 -29.499
  559   3HZ   LYS  72          3HZ       LYS  72  39.303   2.714 -28.801
  560    H    LYS  73           H        LYS  73  43.824  -3.643 -28.064
  561    HA   LYS  73           HA       LYS  73  45.543  -1.446 -28.760
  562   1HB   LYS  73          2HB       LYS  73  46.129  -3.992 -27.230
  563   2HB   LYS  73          1HB       LYS  73  47.210  -2.612 -27.361
  564   1HG   LYS  73          2HG       LYS  73  45.664  -1.214 -26.161
  565   2HG   LYS  73          1HG       LYS  73  44.460  -2.502 -26.135
  566   1HD   LYS  73          2HD       LYS  73  45.545  -2.386 -23.988
  567   2HD   LYS  73          1HD       LYS  73  46.028  -3.877 -24.797
  568   1HE   LYS  73          2HE       LYS  73  48.121  -2.806 -25.491
  569   2HE   LYS  73          1HE       LYS  73  47.636  -1.327 -24.666
  570   1HZ   LYS  73          1HZ       LYS  73  48.080  -3.956 -23.361
  571   2HZ   LYS  73          2HZ       LYS  73  47.626  -2.535 -22.572
  572   3HZ   LYS  73          3HZ       LYS  73  49.150  -2.645 -23.314
  573    H    GLU  74           H        GLU  74  46.015  -1.459 -30.876
  574    HA   GLU  74           HA       GLU  74  46.479  -3.987 -32.237
  575   1HB   GLU  74          2HB       GLU  74  46.238  -2.615 -34.290
  576   2HB   GLU  74          1HB       GLU  74  44.852  -2.493 -33.212
  577   1HG   GLU  74          2HG       GLU  74  45.754  -0.367 -32.346
  578   2HG   GLU  74          1HG       GLU  74  47.073  -0.482 -33.508
  579    H    ASN  75           H        ASN  75  48.210  -4.387 -33.583
  580    HA   ASN  75           HA       ASN  75  50.315  -4.397 -34.375
  581   1HB   ASN  75          2HB       ASN  75  49.882  -1.408 -34.465
  582   2HB   ASN  75          1HB       ASN  75  51.019  -2.336 -35.430
  583   1HD2  ASN  75          1HD2      ASN  75  48.841  -0.603 -36.266
  584   2HD2  ASN  75          2HD2      ASN  75  47.797  -1.584 -37.245
  585    H    ALA  76           H        ALA  76  52.266  -2.239 -34.171
  586    HA   ALA  76           HA       ALA  76  53.630  -3.142 -31.886
  587   1HB   ALA  76          1HB       ALA  76  55.362  -1.571 -32.515
  588   2HB   ALA  76          2HB       ALA  76  54.251  -0.759 -33.618
  589   3HB   ALA  76          3HB       ALA  76  54.758  -2.418 -33.939
  590    H    LEU  77           H        LEU  77  51.516  -0.436 -32.431
  591    HA   LEU  77           HA       LEU  77  52.500   1.257 -30.434
  592   1HB   LEU  77          2HB       LEU  77  50.416   2.460 -30.627
  593   2HB   LEU  77          1HB       LEU  77  51.054   2.061 -32.199
  594    HG   LEU  77           HG       LEU  77  49.370   0.038 -32.018
  595   1HD1  LEU  77          1HD1      LEU  77  48.648   0.465 -29.738
  596   2HD1  LEU  77          2HD1      LEU  77  47.304   0.678 -30.860
  597   3HD1  LEU  77          3HD1      LEU  77  48.124   2.088 -30.190
  598   1HD2  LEU  77          1HD2      LEU  77  49.332   1.784 -33.724
  599   2HD2  LEU  77          2HD2      LEU  77  48.492   2.860 -32.609
  600   3HD2  LEU  77          3HD2      LEU  77  47.705   1.386 -33.174
  601    H    GLN  78           H        GLN  78  50.398  -1.538 -30.230
  602    HA   GLN  78           HA       GLN  78  49.320  -1.168 -27.692
  603   1HB   GLN  78          2HB       GLN  78  48.592  -3.092 -28.853
  604   2HB   GLN  78          1HB       GLN  78  50.238  -3.654 -29.124
  605   1HG   GLN  78          2HG       GLN  78  50.497  -4.274 -26.849
  606   2HG   GLN  78          1HG       GLN  78  49.006  -3.460 -26.388
  607   1HE2  GLN  78          1HE2      GLN  78  49.248  -5.415 -29.269
  608   2HE2  GLN  78          2HE2      GLN  78  48.233  -6.695 -28.705
  609    H    ARG  79           H        ARG  79  52.457  -2.535 -28.590
  610    HA   ARG  79           HA       ARG  79  53.259  -3.002 -25.900
  611   1HB   ARG  79          2HB       ARG  79  54.737  -3.014 -28.525
  612   2HB   ARG  79          1HB       ARG  79  55.521  -3.383 -26.993
  613   1HG   ARG  79          2HG       ARG  79  54.254  -5.329 -26.687
  614   2HG   ARG  79          1HG       ARG  79  53.077  -4.857 -27.913
  615   1HD   ARG  79          2HD       ARG  79  55.967  -5.446 -28.519
  616   2HD   ARG  79          1HD       ARG  79  54.694  -6.665 -28.587
  617    HE   ARG  79           HE       ARG  79  54.304  -4.254 -30.177
  618   1HH1  ARG  79          1HH1      ARG  79  55.215  -7.630 -30.064
  619   2HH1  ARG  79          2HH1      ARG  79  55.045  -7.871 -31.781
  620   1HH2  ARG  79          1HH2      ARG  79  54.007  -4.587 -32.434
  621   2HH2  ARG  79          2HH2      ARG  79  54.294  -6.157 -33.116
  622    H    ALA  80           H        ALA  80  53.323  -0.312 -27.991
  623    HA   ALA  80           HA       ALA  80  55.435   1.093 -26.642
  624   1HB   ALA  80          1HB       ALA  80  55.011   1.497 -29.013
  625   2HB   ALA  80          2HB       ALA  80  54.834   2.981 -28.074
  626   3HB   ALA  80          3HB       ALA  80  53.402   2.107 -28.622
  627    H    ARG  81           H        ARG  81  51.931   1.088 -26.594
  628    HA   ARG  81           HA       ARG  81  51.731   3.342 -24.829
  629   1HB   ARG  81          2HB       ARG  81  49.670   1.300 -25.644
  630   2HB   ARG  81          1HB       ARG  81  49.331   2.746 -24.712
  631   1HG   ARG  81          2HG       ARG  81  50.400   2.668 -27.525
  632   2HG   ARG  81          1HG       ARG  81  48.738   3.026 -27.060
  633   1HD   ARG  81          2HD       ARG  81  51.172   4.651 -26.319
  634   2HD   ARG  81          1HD       ARG  81  50.003   5.063 -27.570
  635    HE   ARG  81           HE       ARG  81  49.703   5.386 -24.721
  636   1HH1  ARG  81          1HH1      ARG  81  48.020   5.114 -27.788
  637   2HH1  ARG  81          2HH1      ARG  81  46.593   5.939 -27.219
  638   1HH2  ARG  81          1HH2      ARG  81  47.877   6.511 -23.987
  639   2HH2  ARG  81          2HH2      ARG  81  46.535   6.771 -25.062
  640    H    THR  82           H        THR  82  51.977  -0.062 -24.481
  641    HA   THR  82           HA       THR  82  51.152  -0.164 -21.736
  642    HB   THR  82           HB       THR  82  52.830  -2.192 -23.227
  643    HG1  THR  82           1HG      THR  82  50.996  -2.025 -24.431
  644   1HG2  THR  82          1HG2      THR  82  52.712  -2.500 -20.783
  645   2HG2  THR  82          2HG2      THR  82  51.877  -3.791 -21.649
  646   3HG2  THR  82          3HG2      THR  82  50.951  -2.502 -20.881
  647    H    ARG  83           H        ARG  83  53.965   0.719 -23.423
  648    HA   ARG  83           HA       ARG  83  55.783   0.294 -21.210
  649   1HB   ARG  83          2HB       ARG  83  56.504   0.016 -23.564
  650   2HB   ARG  83          1HB       ARG  83  56.223   1.726 -23.837
  651   1HG   ARG  83          2HG       ARG  83  57.944   2.245 -22.161
  652   2HG   ARG  83          1HG       ARG  83  58.244   0.515 -21.964
  653   1HD   ARG  83          2HD       ARG  83  58.677   0.454 -24.464
  654   2HD   ARG  83          1HD       ARG  83  58.702   2.216 -24.403
  655    HE   ARG  83           HE       ARG  83  60.454   1.211 -22.455
  656   1HH1  ARG  83          1HH1      ARG  83  60.185   1.551 -25.938
  657   2HH1  ARG  83          2HH1      ARG  83  61.901   1.420 -26.201
  658   1HH2  ARG  83          1HH2      ARG  83  62.683   1.062 -22.801
  659   2HH2  ARG  83          2HH2      ARG  83  63.319   1.171 -24.413
  660    H    HIS  84           H        HIS  84  56.137   1.739 -19.660
  661    HA   HIS  84           HA       HIS  84  54.865   4.357 -19.975
  662   1HB   HIS  84          2HB       HIS  84  54.948   4.591 -17.561
  663   2HB   HIS  84          1HB       HIS  84  54.221   3.050 -17.982
  664    HD1  HIS  84           1HD      HIS  84  55.501   0.911 -17.322
  665    HD2  HIS  84           2HD      HIS  84  57.399   4.431 -16.182
  666    HE1  HIS  84           1HE      HIS  84  57.283   0.223 -15.687
  667    HE2  HIS  84           2HE      HIS  84  58.540   2.344 -15.161
  668    HA   PRO  85           HA       PRO  85  58.955   6.168 -20.089
  669   1HB   PRO  85          2HB       PRO  85  58.252   8.406 -21.362
  670   2HB   PRO  85          1HB       PRO  85  58.319   6.866 -22.227
  671   1HG   PRO  85          2HG       PRO  85  55.958   8.389 -21.246
  672   2HG   PRO  85          1HG       PRO  85  56.130   7.394 -22.701
  673   1HD   PRO  85          2HD       PRO  85  54.961   6.610 -20.257
  674   2HD   PRO  85          1HD       PRO  85  55.401   5.547 -21.605
  675    H    ALA  86           H        ALA  86  59.548   8.601 -19.510
  676    HA   ALA  86           HA       ALA  86  58.447   9.168 -16.923
  677   1HB   ALA  86          1HB       ALA  86  60.796   9.585 -17.340
  678   2HB   ALA  86          2HB       ALA  86  59.980  11.098 -16.941
  679   3HB   ALA  86          3HB       ALA  86  60.392  10.732 -18.618
  680    H    GLU  87           H        GLU  87  56.493  10.052 -16.740
  681    HA   GLU  87           HA       GLU  87  55.037  11.231 -18.795
  682   1HB   GLU  87          2HB       GLU  87  54.287  10.308 -16.482
  683   2HB   GLU  87          1HB       GLU  87  54.580  11.946 -15.912
  684   1HG   GLU  87          2HG       GLU  87  52.297  11.864 -16.396
  685   2HG   GLU  87          1HG       GLU  87  53.021  12.711 -17.760
  686    H    SER  88           H        SER  88  56.979  12.707 -16.230
  687    HA   SER  88           HA       SER  88  56.321  15.386 -16.869
  688   1HB   SER  88          2HB       SER  88  58.675  14.255 -15.352
  689   2HB   SER  88          1HB       SER  88  58.222  15.963 -15.392
  690    HG   SER  88           HG       SER  88  56.020  14.702 -14.791
  691    H    CYS  89           H        CYS  89  58.588  13.157 -18.213
  692    HA   CYS  89           HA       CYS  89  60.332  14.974 -19.494
  693   1HB   CYS  89          2HB       CYS  89  60.854  12.583 -19.288
  694   2HB   CYS  89          1HB       CYS  89  59.490  12.185 -20.322
  695    HG   CYS  89           HG       CYS  89  62.019  14.141 -21.502
  696    H    LEU  90           H        LEU  90  57.117  13.928 -20.135
  697    HA   LEU  90           HA       LEU  90  57.062  15.265 -22.732
  698   1HB   LEU  90          2HB       LEU  90  55.952  13.098 -22.556
  699   2HB   LEU  90          1HB       LEU  90  54.954  13.697 -21.246
  700    HG   LEU  90           HG       LEU  90  53.916  15.312 -22.815
  701   1HD1  LEU  90          1HD1      LEU  90  54.250  15.030 -25.211
  702   2HD1  LEU  90          2HD1      LEU  90  55.486  13.810 -24.904
  703   3HD1  LEU  90          3HD1      LEU  90  55.758  15.481 -24.410
  704   1HD2  LEU  90          1HD2      LEU  90  53.765  12.419 -23.654
  705   2HD2  LEU  90          2HD2      LEU  90  52.568  13.663 -24.013
  706   3HD2  LEU  90          3HD2      LEU  90  52.852  13.169 -22.344
  707    H    GLU  91           H        GLU  91  55.849  15.540 -19.466
  708    HA   GLU  91           HA       GLU  91  53.920  17.513 -19.814
  709   1HB   GLU  91          2HB       GLU  91  55.638  16.905 -17.411
  710   2HB   GLU  91          1HB       GLU  91  54.262  17.996 -17.382
  711   1HG   GLU  91          2HG       GLU  91  52.788  16.160 -18.023
  712   2HG   GLU  91          1HG       GLU  91  54.169  15.065 -18.057
  713    H    HIS  92           H        HIS  92  57.418  17.875 -19.486
  714    HA   HIS  92           HA       HIS  92  57.327  20.649 -18.851
  715   1HB   HIS  92          2HB       HIS  92  59.650  20.656 -18.954
  716   2HB   HIS  92          1HB       HIS  92  59.309  18.977 -18.571
  717    HD1  HIS  92           1HD      HIS  92  61.341  20.959 -20.707
  718    HD2  HIS  92           2HD      HIS  92  59.284  17.369 -21.144
  719    HE1  HIS  92           1HE      HIS  92  62.383  19.814 -22.695
  720    HE2  HIS  92           2HE      HIS  92  61.037  17.703 -23.016
  721    H    HIS  93           H        HIS  93  57.417  22.448 -20.141
  722    HA   HIS  93           HA       HIS  93  56.641  21.958 -22.906
  723   1HB   HIS  93          2HB       HIS  93  55.373  23.515 -21.282
  724   2HB   HIS  93          1HB       HIS  93  56.678  24.660 -21.579
  725    HD1  HIS  93           1HD      HIS  93  56.412  26.116 -23.601
  726    HD2  HIS  93           2HD      HIS  93  53.963  22.765 -23.736
  727    HE1  HIS  93           1HE      HIS  93  54.965  26.417 -25.630
  728    HE2  HIS  93           2HE      HIS  93  53.344  24.490 -25.558
  729    H    HIS  94           H        HIS  94  58.242  24.888 -21.851
  730    HA   HIS  94           HA       HIS  94  60.044  26.020 -22.605
  731   1HB   HIS  94          2HB       HIS  94  61.278  24.087 -21.656
  732   2HB   HIS  94          1HB       HIS  94  61.194  23.287 -23.221
  733    HD1  HIS  94           1HD      HIS  94  62.492  26.595 -21.845
  734    HD2  HIS  94           2HD      HIS  94  63.394  23.735 -24.727
  735    HE1  HIS  94           1HE      HIS  94  64.673  27.327 -22.868
  736    HE2  HIS  94           2HE      HIS  94  65.299  25.471 -24.461
  737    H    HIS  95           H        HIS  95  59.802  27.229 -24.366
  738    HA   HIS  95           HA       HIS  95  58.724  26.427 -26.784
  739   1HB   HIS  95          2HB       HIS  95  59.530  28.504 -27.741
  740   2HB   HIS  95          1HB       HIS  95  58.984  28.800 -26.098
  741    HD1  HIS  95           1HD      HIS  95  61.912  29.148 -28.319
  742    HD2  HIS  95           2HD      HIS  95  61.146  29.226 -24.221
  743    HE1  HIS  95           1HE      HIS  95  63.935  30.206 -27.261
  744    HE2  HIS  95           2HE      HIS  95  63.468  30.214 -24.779
  745    H    HIS  96           H        HIS  96  59.418  25.143 -28.355
  746    HA   HIS  96           HA       HIS  96  62.217  24.464 -28.546
  747   1HB   HIS  96          2HB       HIS  96  61.611  22.968 -30.354
  748   2HB   HIS  96          1HB       HIS  96  60.486  22.748 -29.025
  749    HD1  HIS  96           1HD      HIS  96  60.548  22.975 -32.558
  750    HD2  HIS  96           2HD      HIS  96  57.967  24.330 -29.592
  751    HE1  HIS  96           1HE      HIS  96  58.351  23.400 -33.707
  752    HE2  HIS  96           2HE      HIS  96  56.750  23.968 -31.845
  753    H    HIS  97           H        HIS  97  63.678  25.387 -29.803
  754    HA   HIS  97           HA       HIS  97  64.668  26.898 -31.178
  755   1HB   HIS  97          2HB       HIS  97  63.242  26.328 -33.033
  756   2HB   HIS  97          1HB       HIS  97  61.893  27.221 -32.343
  757    HD1  HIS  97           1HD      HIS  97  61.724  29.678 -32.881
  758    HD2  HIS  97           2HD      HIS  97  65.334  28.006 -34.091
  759    HE1  HIS  97           1HE      HIS  97  62.841  31.427 -34.306
  760    HE2  HIS  97           2HE      HIS  97  65.106  30.467 -34.854
  Start of MODEL   10
    1   1H    MET   1          1HT       MET   1  -7.007  12.447  -4.946
    2   2H    MET   1          2HT       MET   1  -7.227  11.784  -3.405
    3   3H    MET   1          3HT       MET   1  -6.790  10.783  -4.702
    4    HA   MET   1           HA       MET   1  -5.146  12.926  -3.491
    5   1HB   MET   1          2HB       MET   1  -4.893   9.913  -3.466
    6   2HB   MET   1          1HB       MET   1  -3.629  11.010  -2.924
    7   1HG   MET   1          2HG       MET   1  -6.391  10.771  -1.743
    8   2HG   MET   1          1HG       MET   1  -4.906  10.111  -1.056
    9   1HE   MET   1          1HE       MET   1  -5.793  13.033   1.394
   10   2HE   MET   1          2HE       MET   1  -5.428  11.315   1.251
   11   3HE   MET   1          3HE       MET   1  -6.919  11.957   0.564
   12    HA   PRO   2           HA       PRO   2  -3.696  12.854  -7.779
   13   1HB   PRO   2          2HB       PRO   2  -2.275  15.277  -6.941
   14   2HB   PRO   2          1HB       PRO   2  -3.462  15.070  -8.232
   15   1HG   PRO   2          2HG       PRO   2  -4.048  16.415  -5.980
   16   2HG   PRO   2          1HG       PRO   2  -5.254  15.427  -6.824
   17   1HD   PRO   2          2HD       PRO   2  -3.654  14.776  -4.375
   18   2HD   PRO   2          1HD       PRO   2  -5.374  14.479  -4.708
   19    H    THR   3           H        THR   3  -1.743  13.736  -4.997
   20    HA   THR   3           HA       THR   3   0.608  12.487  -6.191
   21    HB   THR   3           HB       THR   3   1.761  13.365  -4.119
   22    HG1  THR   3           1HG      THR   3  -0.090  13.602  -2.813
   23   1HG2  THR   3          1HG2      THR   3   1.795  15.696  -4.897
   24   2HG2  THR   3          2HG2      THR   3   0.361  15.382  -5.875
   25   3HG2  THR   3          3HG2      THR   3   1.879  14.566  -6.249
   26    H    LYS   4           H        LYS   4   0.646  10.343  -5.928
   27    HA   LYS   4           HA       LYS   4  -0.194   9.219  -3.375
   28   1HB   LYS   4          2HB       LYS   4  -1.589   8.519  -5.227
   29   2HB   LYS   4          1HB       LYS   4  -0.172   8.056  -6.160
   30   1HG   LYS   4          2HG       LYS   4   0.333   6.416  -4.307
   31   2HG   LYS   4          1HG       LYS   4  -1.298   6.751  -3.716
   32   1HD   LYS   4          2HD       LYS   4  -0.668   5.871  -6.511
   33   2HD   LYS   4          1HD       LYS   4  -1.094   4.786  -5.209
   34   1HE   LYS   4          2HE       LYS   4  -3.229   6.018  -4.926
   35   2HE   LYS   4          1HE       LYS   4  -2.801   6.994  -6.329
   36   1HZ   LYS   4          1HZ       LYS   4  -3.379   4.085  -6.253
   37   2HZ   LYS   4          2HZ       LYS   4  -2.688   4.852  -7.598
   38   3HZ   LYS   4          3HZ       LYS   4  -4.233   5.293  -7.077
   39    H    THR   5           H        THR   5   1.464   8.725  -2.216
   40    HA   THR   5           HA       THR   5   4.012   7.995  -3.467
   41    HB   THR   5           HB       THR   5   3.721   8.470  -0.525
   42    HG1  THR   5           1HG      THR   5   2.685  10.268  -1.416
   43   1HG2  THR   5          1HG2      THR   5   5.880   7.736  -1.419
   44   2HG2  THR   5          2HG2      THR   5   5.986   9.379  -0.786
   45   3HG2  THR   5          3HG2      THR   5   5.892   9.109  -2.527
   46    H    TYR   6           H        TYR   6   5.250   6.235  -2.510
   47    HA   TYR   6           HA       TYR   6   3.624   4.212  -1.170
   48   1HB   TYR   6          2HB       TYR   6   4.960   2.554  -2.730
   49   2HB   TYR   6          1HB       TYR   6   3.455   3.287  -3.267
   50    HD1  TYR   6           1HD      TYR   6   3.439   4.954  -5.024
   51    HD2  TYR   6           2HD      TYR   6   7.103   3.249  -3.690
   52    HE1  TYR   6           1HE      TYR   6   4.576   5.853  -7.009
   53    HE2  TYR   6           2HE      TYR   6   8.250   4.144  -5.670
   54    HH   TYR   6           HH       TYR   6   6.850   6.483  -7.694
   55    H    SER   7           H        SER   7   4.590   4.040   0.720
   56    HA   SER   7           HA       SER   7   7.385   4.441   1.133
   57   1HB   SER   7          2HB       SER   7   5.324   3.195   2.971
   58   2HB   SER   7          1HB       SER   7   6.896   3.835   3.451
   59    HG   SER   7           HG       SER   7   6.178   5.898   2.702
   60    H    GLU   8           H        GLU   8   8.761   2.762   2.248
   61    HA   GLU   8           HA       GLU   8   9.100   0.505   0.636
   62   1HB   GLU   8          2HB       GLU   8  10.076   0.922   3.466
   63   2HB   GLU   8          1HB       GLU   8  10.641  -0.338   2.383
   64   1HG   GLU   8          2HG       GLU   8  12.283   1.305   2.292
   65   2HG   GLU   8          1HG       GLU   8  11.339   1.539   0.822
   66    H    GLU   9           H        GLU   9   7.334   0.923   3.639
   67    HA   GLU   9           HA       GLU   9   6.857  -1.756   4.237
   68   1HB   GLU   9          2HB       GLU   9   5.375   0.788   4.853
   69   2HB   GLU   9          1HB       GLU   9   4.843  -0.769   5.447
   70   1HG   GLU   9          2HG       GLU   9   7.476   0.555   6.016
   71   2HG   GLU   9          1HG       GLU   9   6.131   0.346   7.140
   72    H    PHE  10           H        PHE  10   5.302   0.421   1.977
   73    HA   PHE  10           HA       PHE  10   3.023  -1.248   1.522
   74   1HB   PHE  10          2HB       PHE  10   3.080   1.210   1.062
   75   2HB   PHE  10          1HB       PHE  10   4.184   0.897  -0.273
   76    HD1  PHE  10           1HD      PHE  10   0.784   0.091   0.986
   77    HD2  PHE  10           2HD      PHE  10   3.351   0.415  -2.394
   78    HE1  PHE  10           1HE      PHE  10  -1.143  -0.247  -0.505
   79    HE2  PHE  10           2HE      PHE  10   1.426   0.076  -3.890
   80    HZ   PHE  10           HZ       PHE  10  -0.824  -0.255  -2.945
   81    H    LYS  11           H        LYS  11   6.214  -0.890   0.142
   82    HA   LYS  11           HA       LYS  11   5.768  -2.638  -2.080
   83   1HB   LYS  11          2HB       LYS  11   8.392  -1.807  -0.825
   84   2HB   LYS  11          1HB       LYS  11   8.165  -2.471  -2.437
   85   1HG   LYS  11          2HG       LYS  11   6.949  -0.494  -3.118
   86   2HG   LYS  11          1HG       LYS  11   7.070   0.167  -1.485
   87   1HD   LYS  11          2HD       LYS  11   9.545   0.111  -1.714
   88   2HD   LYS  11          1HD       LYS  11   9.338  -0.399  -3.388
   89   1HE   LYS  11          2HE       LYS  11   8.168   1.656  -3.902
   90   2HE   LYS  11          1HE       LYS  11   8.259   2.158  -2.215
   91   1HZ   LYS  11          1HZ       LYS  11  10.649   2.283  -2.386
   92   2HZ   LYS  11          2HZ       LYS  11   9.947   3.236  -3.598
   93   3HZ   LYS  11          3HZ       LYS  11  10.608   1.722  -3.984
   94    H    ARG  12           H        ARG  12   7.219  -2.966   1.141
   95    HA   ARG  12           HA       ARG  12   7.980  -5.684   0.774
   96   1HB   ARG  12          2HB       ARG  12   8.471  -5.716   3.141
   97   2HB   ARG  12          1HB       ARG  12   9.034  -4.201   2.466
   98   1HG   ARG  12          2HG       ARG  12   8.075  -3.444   4.385
   99   2HG   ARG  12          1HG       ARG  12   6.680  -3.362   3.310
  100   1HD   ARG  12          2HD       ARG  12   5.976  -5.588   4.113
  101   2HD   ARG  12          1HD       ARG  12   7.323  -5.576   5.251
  102    HE   ARG  12           HE       ARG  12   6.244  -3.538   6.226
  103   1HH1  ARG  12          1HH1      ARG  12   4.365  -5.940   4.504
  104   2HH1  ARG  12          2HH1      ARG  12   2.862  -5.506   5.251
  105   1HH2  ARG  12          1HH2      ARG  12   4.300  -2.986   7.256
  106   2HH2  ARG  12          2HH2      ARG  12   2.824  -3.803   6.834
  107    H    ASP  13           H        ASP  13   5.029  -4.114   1.600
  108    HA   ASP  13           HA       ASP  13   3.727  -6.327   2.831
  109   1HB   ASP  13          2HB       ASP  13   3.008  -3.881   2.932
  110   2HB   ASP  13          1HB       ASP  13   2.379  -4.093   1.301
  111    H    ALA  14           H        ALA  14   3.923  -5.062  -0.463
  112    HA   ALA  14           HA       ALA  14   2.273  -6.928  -1.742
  113   1HB   ALA  14          1HB       ALA  14   4.730  -5.548  -2.826
  114   2HB   ALA  14          2HB       ALA  14   3.090  -4.900  -2.834
  115   3HB   ALA  14          3HB       ALA  14   3.475  -6.333  -3.785
  116    H    VAL  15           H        VAL  15   5.702  -7.052  -0.893
  117    HA   VAL  15           HA       VAL  15   6.341  -9.492  -2.136
  118    HB   VAL  15           HB       VAL  15   7.530  -8.371   0.413
  119   1HG1  VAL  15          1HG1      VAL  15   8.614 -10.374  -1.562
  120   2HG1  VAL  15          2HG1      VAL  15   8.105 -10.702   0.094
  121   3HG1  VAL  15          3HG1      VAL  15   9.514  -9.685  -0.210
  122   1HG2  VAL  15          1HG2      VAL  15   9.256  -7.422  -1.057
  123   2HG2  VAL  15          2HG2      VAL  15   7.660  -6.739  -1.360
  124   3HG2  VAL  15          3HG2      VAL  15   8.325  -7.945  -2.458
  125    H    ALA  16           H        ALA  16   5.169  -8.787   1.141
  126    HA   ALA  16           HA       ALA  16   5.132 -11.469   2.045
  127   1HB   ALA  16          1HB       ALA  16   3.744 -10.651   3.868
  128   2HB   ALA  16          2HB       ALA  16   3.456  -9.145   2.993
  129   3HB   ALA  16          3HB       ALA  16   5.078  -9.543   3.559
  130    H    LEU  17           H        LEU  17   2.856  -9.515   0.254
  131    HA   LEU  17           HA       LEU  17   0.626 -11.242   0.490
  132   1HB   LEU  17          2HB       LEU  17   1.370  -9.140  -1.530
  133   2HB   LEU  17          1HB       LEU  17  -0.126 -10.047  -1.636
  134    HG   LEU  17           HG       LEU  17   0.657  -8.356   0.737
  135   1HD1  LEU  17          1HD1      LEU  17  -1.006  -6.755  -0.100
  136   2HD1  LEU  17          2HD1      LEU  17  -1.173  -7.713  -1.573
  137   3HD1  LEU  17          3HD1      LEU  17   0.364  -6.931  -1.196
  138   1HD2  LEU  17          1HD2      LEU  17  -1.973  -9.617  -0.038
  139   2HD2  LEU  17          2HD2      LEU  17  -1.680  -8.600   1.373
  140   3HD2  LEU  17          3HD2      LEU  17  -0.897 -10.175   1.246
  141    H    TYR  18           H        TYR  18   3.368 -11.159  -1.706
  142    HA   TYR  18           HA       TYR  18   2.319 -13.047  -3.556
  143   1HB   TYR  18          2HB       TYR  18   4.170 -11.479  -4.101
  144   2HB   TYR  18          1HB       TYR  18   5.218 -12.373  -3.003
  145    HD1  TYR  18           1HD      TYR  18   6.573 -14.029  -3.899
  146    HD2  TYR  18           2HD      TYR  18   3.007 -12.968  -5.957
  147    HE1  TYR  18           1HE      TYR  18   7.164 -15.581  -5.712
  148    HE2  TYR  18           2HE      TYR  18   3.594 -14.507  -7.783
  149    HH   TYR  18           HH       TYR  18   6.041 -16.843  -7.499
  150    H    GLU  19           H        GLU  19   3.946 -13.300  -0.502
  151    HA   GLU  19           HA       GLU  19   4.587 -16.078  -0.694
  152   1HB   GLU  19          2HB       GLU  19   4.409 -14.101   1.550
  153   2HB   GLU  19          1HB       GLU  19   4.531 -15.815   1.916
  154   1HG   GLU  19          2HG       GLU  19   6.485 -14.282   0.219
  155   2HG   GLU  19          1HG       GLU  19   6.706 -14.662   1.929
  156    H    ASN  20           H        ASN  20   1.723 -14.334  -0.199
  157    HA   ASN  20           HA       ASN  20   0.338 -16.744   0.754
  158   1HB   ASN  20          2HB       ASN  20  -0.330 -13.813   1.026
  159   2HB   ASN  20          1HB       ASN  20  -1.485 -15.089   1.371
  160   1HD2  ASN  20          1HD2      ASN  20   1.421 -13.496   2.393
  161   2HD2  ASN  20          2HD2      ASN  20   1.496 -14.204   3.968
  162    H    SER  21           H        SER  21   1.166 -16.252  -1.939
  163    HA   SER  21           HA       SER  21  -0.890 -15.200  -3.558
  164   1HB   SER  21          2HB       SER  21   0.362 -16.545  -5.361
  165   2HB   SER  21          1HB       SER  21   1.245 -15.282  -4.510
  166    HG   SER  21           HG       SER  21   2.530 -16.727  -3.702
  167    H    ASP  22           H        ASP  22  -0.626 -18.119  -1.904
  168    HA   ASP  22           HA       ASP  22  -1.957 -19.977  -3.461
  169   1HB   ASP  22          2HB       ASP  22  -0.914 -20.451  -1.256
  170   2HB   ASP  22          1HB       ASP  22  -2.247 -19.611  -0.470
  171    H    GLY  23           H        GLY  23  -3.231 -17.261  -1.690
  172   1HA   GLY  23          2HA       GLY  23  -5.907 -17.903  -2.768
  173   2HA   GLY  23          1HA       GLY  23  -5.672 -17.126  -1.210
  174    H    ALA  24           H        ALA  24  -3.468 -16.128  -3.601
  175    HA   ALA  24           HA       ALA  24  -4.988 -14.037  -4.787
  176   1HB   ALA  24          1HB       ALA  24  -4.892 -13.129  -2.512
  177   2HB   ALA  24          2HB       ALA  24  -3.988 -12.128  -3.649
  178   3HB   ALA  24          3HB       ALA  24  -3.131 -13.215  -2.559
  179    H    SER  25           H        SER  25  -4.015 -14.631  -6.670
  180    HA   SER  25           HA       SER  25  -1.215 -15.024  -6.947
  181   1HB   SER  25          2HB       SER  25  -3.282 -14.541  -9.104
  182   2HB   SER  25          1HB       SER  25  -1.683 -15.260  -9.320
  183    HG   SER  25           HG       SER  25  -3.758 -16.625  -8.965
  184    H    LEU  26           H        LEU  26  -0.177 -13.788  -8.957
  185    HA   LEU  26           HA       LEU  26   0.637 -11.322  -8.013
  186   1HB   LEU  26          2HB       LEU  26   1.612 -12.915  -9.839
  187   2HB   LEU  26          1HB       LEU  26   0.667 -11.943 -10.946
  188    HG   LEU  26           HG       LEU  26   3.054 -11.280 -10.807
  189   1HD1  LEU  26          1HD1      LEU  26   1.088  -9.198  -9.878
  190   2HD1  LEU  26          2HD1      LEU  26   1.422  -9.656 -11.549
  191   3HD1  LEU  26          3HD1      LEU  26   2.672  -8.873 -10.581
  192   1HD2  LEU  26          1HD2      LEU  26   2.338 -10.431  -8.007
  193   2HD2  LEU  26          2HD2      LEU  26   3.859 -10.104  -8.839
  194   3HD2  LEU  26          3HD2      LEU  26   3.409 -11.763  -8.444
  195    H    GLN  27           H        GLN  27  -1.679 -11.936 -10.667
  196    HA   GLN  27           HA       GLN  27  -2.229  -9.204 -11.132
  197   1HB   GLN  27          2HB       GLN  27  -2.688 -10.963 -12.798
  198   2HB   GLN  27          1HB       GLN  27  -3.956 -11.603 -11.763
  199   1HG   GLN  27          2HG       GLN  27  -4.899 -10.267 -13.555
  200   2HG   GLN  27          1HG       GLN  27  -5.208  -9.526 -11.987
  201   1HE2  GLN  27          1HE2      GLN  27  -4.210  -7.595 -11.460
  202   2HE2  GLN  27          2HE2      GLN  27  -3.418  -6.609 -12.642
  203    H    GLN  28           H        GLN  28  -3.573 -11.562  -8.953
  204    HA   GLN  28           HA       GLN  28  -5.976 -10.237  -8.294
  205   1HB   GLN  28          2HB       GLN  28  -4.927 -12.666  -7.727
  206   2HB   GLN  28          1HB       GLN  28  -4.617 -11.847  -6.205
  207   1HG   GLN  28          2HG       GLN  28  -7.330 -11.935  -7.483
  208   2HG   GLN  28          1HG       GLN  28  -6.756 -13.165  -6.363
  209   1HE2  GLN  28          1HE2      GLN  28  -8.996 -11.331  -6.143
  210   2HE2  GLN  28          2HE2      GLN  28  -8.739 -10.431  -4.691
  211    H    ILE  29           H        ILE  29  -2.749 -10.229  -6.837
  212    HA   ILE  29           HA       ILE  29  -3.307  -8.418  -4.743
  213    HB   ILE  29           HB       ILE  29  -0.686  -9.019  -6.125
  214   1HG1  ILE  29          2HG1      ILE  29  -1.723 -10.997  -5.120
  215   2HG1  ILE  29          1HG1      ILE  29  -0.286 -10.517  -4.217
  216   1HG2  ILE  29          1HG2      ILE  29  -1.197  -7.659  -3.485
  217   2HG2  ILE  29          2HG2      ILE  29  -0.534  -6.910  -4.937
  218   3HG2  ILE  29          3HG2      ILE  29   0.384  -8.156  -4.089
  219   1HD1  ILE  29          1HD1      ILE  29  -3.134  -9.919  -3.436
  220   2HD1  ILE  29          2HD1      ILE  29  -1.689  -9.481  -2.525
  221   3HD1  ILE  29          3HD1      ILE  29  -2.110 -11.179  -2.746
  222    H    ALA  30           H        ALA  30  -1.796  -7.917  -7.930
  223    HA   ALA  30           HA       ALA  30  -1.352  -5.167  -7.711
  224   1HB   ALA  30          1HB       ALA  30  -0.361  -6.585  -9.455
  225   2HB   ALA  30          2HB       ALA  30  -1.157  -5.161 -10.127
  226   3HB   ALA  30          3HB       ALA  30  -1.949  -6.732 -10.213
  227    H    ASN  31           H        ASN  31  -4.210  -6.954  -8.617
  228    HA   ASN  31           HA       ASN  31  -5.667  -4.849  -9.803
  229   1HB   ASN  31          2HB       ASN  31  -6.058  -7.464  -9.753
  230   2HB   ASN  31          1HB       ASN  31  -7.034  -7.082  -8.341
  231   1HD2  ASN  31          1HD2      ASN  31  -7.816  -8.179 -10.894
  232   2HD2  ASN  31          2HD2      ASN  31  -9.001  -7.110 -11.555
  233    H    ASP  32           H        ASP  32  -5.383  -6.006  -6.487
  234    HA   ASP  32           HA       ASP  32  -7.484  -4.324  -5.487
  235   1HB   ASP  32          2HB       ASP  32  -6.834  -6.491  -4.412
  236   2HB   ASP  32          1HB       ASP  32  -5.317  -5.744  -3.920
  237    H    LEU  33           H        LEU  33  -3.960  -4.220  -5.558
  238    HA   LEU  33           HA       LEU  33  -3.725  -1.889  -3.948
  239   1HB   LEU  33          2HB       LEU  33  -1.886  -3.457  -5.695
  240   2HB   LEU  33          1HB       LEU  33  -1.400  -1.848  -5.203
  241    HG   LEU  33           HG       LEU  33  -1.591  -2.522  -2.837
  242   1HD1  LEU  33          1HD1      LEU  33  -3.287  -4.247  -3.038
  243   2HD1  LEU  33          2HD1      LEU  33  -1.838  -4.891  -2.264
  244   3HD1  LEU  33          3HD1      LEU  33  -2.174  -5.260  -3.956
  245   1HD2  LEU  33          1HD2      LEU  33   0.375  -3.969  -2.799
  246   2HD2  LEU  33          2HD2      LEU  33   0.545  -2.683  -3.993
  247   3HD2  LEU  33          3HD2      LEU  33   0.150  -4.321  -4.514
  248    H    GLY  34           H        GLY  34  -4.286  -2.421  -7.330
  249   1HA   GLY  34          2HA       GLY  34  -5.145  -0.859  -8.829
  250   2HA   GLY  34          1HA       GLY  34  -4.810   0.411  -7.661
  251    H    ILE  35           H        ILE  35  -2.562  -1.986  -8.892
  252    HA   ILE  35           HA       ILE  35  -1.196   0.072 -10.468
  253    HB   ILE  35           HB       ILE  35   0.989  -0.845  -9.689
  254   1HG1  ILE  35          2HG1      ILE  35  -0.690  -2.128  -7.527
  255   2HG1  ILE  35          1HG1      ILE  35   0.135  -2.989  -8.817
  256   1HG2  ILE  35          1HG2      ILE  35   0.168   1.270  -8.828
  257   2HG2  ILE  35          2HG2      ILE  35   1.032   0.387  -7.568
  258   3HG2  ILE  35          3HG2      ILE  35  -0.732   0.428  -7.568
  259   1HD1  ILE  35          1HD1      ILE  35   2.285  -2.216  -7.950
  260   2HD1  ILE  35          2HD1      ILE  35   1.378  -3.137  -6.750
  261   3HD1  ILE  35          3HD1      ILE  35   1.446  -1.377  -6.645
  262    H    ASN  36           H        ASN  36   0.119  -0.773 -12.140
  263    HA   ASN  36           HA       ASN  36  -0.956  -3.075 -13.385
  264   1HB   ASN  36          2HB       ASN  36   0.994  -1.034 -14.020
  265   2HB   ASN  36          1HB       ASN  36   1.497  -2.609 -14.589
  266   1HD2  ASN  36          1HD2      ASN  36   0.311  -3.641 -16.193
  267   2HD2  ASN  36          2HD2      ASN  36  -0.906  -2.823 -17.112
  268    H    ARG  37           H        ARG  37  -0.045  -5.076 -13.771
  269    HA   ARG  37           HA       ARG  37   1.092  -6.180 -11.444
  270   1HB   ARG  37          2HB       ARG  37   0.950  -8.286 -12.621
  271   2HB   ARG  37          1HB       ARG  37  -0.516  -7.361 -12.833
  272   1HG   ARG  37          2HG       ARG  37   0.285  -6.690 -15.074
  273   2HG   ARG  37          1HG       ARG  37   1.676  -7.756 -14.851
  274   1HD   ARG  37          2HD       ARG  37   0.162  -9.660 -14.555
  275   2HD   ARG  37          1HD       ARG  37  -1.221  -8.594 -14.787
  276    HE   ARG  37           HE       ARG  37   0.786  -8.919 -16.921
  277   1HH1  ARG  37          1HH1      ARG  37  -2.510  -9.141 -15.757
  278   2HH1  ARG  37          2HH1      ARG  37  -3.174  -9.567 -17.306
  279   1HH2  ARG  37          1HH2      ARG  37  -0.070  -9.434 -18.966
  280   2HH2  ARG  37          2HH2      ARG  37  -1.771  -9.748 -19.147
  281    H    VAL  38           H        VAL  38   2.436  -5.071 -14.429
  282    HA   VAL  38           HA       VAL  38   4.939  -6.366 -14.271
  283    HB   VAL  38           HB       VAL  38   4.304  -3.672 -15.492
  284   1HG1  VAL  38          1HG1      VAL  38   6.697  -3.946 -15.151
  285   2HG1  VAL  38          2HG1      VAL  38   6.306  -4.052 -16.866
  286   3HG1  VAL  38          3HG1      VAL  38   6.650  -5.519 -15.949
  287   1HG2  VAL  38          1HG2      VAL  38   4.087  -4.860 -17.595
  288   2HG2  VAL  38          2HG2      VAL  38   2.943  -5.498 -16.414
  289   3HG2  VAL  38          3HG2      VAL  38   4.415  -6.394 -16.788
  290    H    THR  39           H        THR  39   3.796  -3.235 -13.040
  291    HA   THR  39           HA       THR  39   6.261  -2.412 -11.936
  292    HB   THR  39           HB       THR  39   3.507  -1.606 -10.977
  293    HG1  THR  39           1HG      THR  39   3.787   0.092 -12.611
  294   1HG2  THR  39          1HG2      THR  39   6.146  -0.132 -11.032
  295   2HG2  THR  39          2HG2      THR  39   5.369  -0.810  -9.601
  296   3HG2  THR  39          3HG2      THR  39   4.609   0.525 -10.467
  297    H    LEU  40           H        LEU  40   3.502  -4.184 -10.622
  298    HA   LEU  40           HA       LEU  40   4.336  -4.317  -7.943
  299   1HB   LEU  40          2HB       LEU  40   2.067  -4.887  -8.692
  300   2HB   LEU  40          1HB       LEU  40   2.694  -6.295  -9.528
  301    HG   LEU  40           HG       LEU  40   3.480  -7.150  -7.286
  302   1HD1  LEU  40          1HD1      LEU  40   1.726  -4.908  -6.294
  303   2HD1  LEU  40          2HD1      LEU  40   3.470  -5.053  -6.065
  304   3HD1  LEU  40          3HD1      LEU  40   2.378  -6.212  -5.304
  305   1HD2  LEU  40          1HD2      LEU  40   1.491  -8.025  -8.371
  306   2HD2  LEU  40          2HD2      LEU  40   0.524  -6.722  -7.678
  307   3HD2  LEU  40          3HD2      LEU  40   1.257  -7.932  -6.626
  308    H    LYS  41           H        LYS  41   4.832  -6.551 -10.652
  309    HA   LYS  41           HA       LYS  41   6.194  -8.585  -9.332
  310   1HB   LYS  41          2HB       LYS  41   5.310  -8.457 -11.746
  311   2HB   LYS  41          1HB       LYS  41   6.844  -7.701 -12.136
  312   1HG   LYS  41          2HG       LYS  41   8.040  -9.677 -11.395
  313   2HG   LYS  41          1HG       LYS  41   6.522 -10.438 -10.920
  314   1HD   LYS  41          2HD       LYS  41   5.772 -10.246 -13.295
  315   2HD   LYS  41          1HD       LYS  41   7.391  -9.679 -13.708
  316   1HE   LYS  41          2HE       LYS  41   8.337 -11.782 -12.881
  317   2HE   LYS  41          1HE       LYS  41   6.720 -12.347 -12.463
  318   1HZ   LYS  41          1HZ       LYS  41   6.126 -12.185 -14.828
  319   2HZ   LYS  41          2HZ       LYS  41   7.401 -13.270 -14.569
  320   3HZ   LYS  41          3HZ       LYS  41   7.715 -11.727 -15.198
  321    H    ASN  42           H        ASN  42   7.355  -5.592 -10.741
  322    HA   ASN  42           HA       ASN  42  10.109  -5.982 -10.494
  323   1HB   ASN  42          2HB       ASN  42   8.333  -3.612 -10.737
  324   2HB   ASN  42          1HB       ASN  42   9.972  -3.323 -10.159
  325   1HD2  ASN  42          1HD2      ASN  42   8.022  -4.441 -12.832
  326   2HD2  ASN  42          2HD2      ASN  42   9.270  -4.349 -14.026
  327    H    TRP  43           H        TRP  43   7.836  -4.487  -8.178
  328    HA   TRP  43           HA       TRP  43   9.725  -3.801  -6.233
  329   1HB   TRP  43          2HB       TRP  43   6.794  -4.471  -6.022
  330   2HB   TRP  43          1HB       TRP  43   7.746  -4.035  -4.609
  331    HD1  TRP  43           HD       TRP  43   9.268  -1.836  -6.895
  332    HE1  TRP  43           1HE      TRP  43   8.099   0.455  -7.028
  333    HE3  TRP  43           3HE      TRP  43   4.815  -3.076  -4.721
  334    HZ2  TRP  43           2HZ      TRP  43   5.612   1.586  -6.297
  335    HZ3  TRP  43           3HZ      TRP  43   3.095  -1.338  -4.469
  336    HH2  TRP  43           HH       TRP  43   3.487   0.947  -5.242
  337    H    ILE  44           H        ILE  44   7.845  -6.777  -6.602
  338    HA   ILE  44           HA       ILE  44   8.627  -8.014  -4.219
  339    HB   ILE  44           HB       ILE  44   7.886  -9.342  -6.833
  340   1HG1  ILE  44          2HG1      ILE  44   6.161  -8.554  -4.466
  341   2HG1  ILE  44          1HG1      ILE  44   6.187  -7.731  -6.023
  342   1HG2  ILE  44          1HG2      ILE  44   8.971 -10.864  -5.251
  343   2HG2  ILE  44          2HG2      ILE  44   7.261 -11.253  -5.443
  344   3HG2  ILE  44          3HG2      ILE  44   7.813 -10.396  -4.003
  345   1HD1  ILE  44          1HD1      ILE  44   4.263  -9.230  -5.763
  346   2HD1  ILE  44          2HD1      ILE  44   5.368 -10.596  -5.595
  347   3HD1  ILE  44          3HD1      ILE  44   5.301  -9.695  -7.109
  348    H    ILE  45           H        ILE  45  10.049  -8.187  -7.467
  349    HA   ILE  45           HA       ILE  45  12.078 -10.043  -6.738
  350    HB   ILE  45           HB       ILE  45  12.008  -8.138  -9.082
  351   1HG1  ILE  45          2HG1      ILE  45  11.178 -11.043  -8.884
  352   2HG1  ILE  45          1HG1      ILE  45  10.074  -9.680  -8.988
  353   1HG2  ILE  45          1HG2      ILE  45  13.630  -9.613 -10.117
  354   2HG2  ILE  45          2HG2      ILE  45  13.635 -10.652  -8.693
  355   3HG2  ILE  45          3HG2      ILE  45  14.260  -9.005  -8.587
  356   1HD1  ILE  45          1HD1      ILE  45  10.913  -9.149 -11.206
  357   2HD1  ILE  45          2HD1      ILE  45  10.313 -10.807 -11.121
  358   3HD1  ILE  45          3HD1      ILE  45  12.048 -10.495 -11.100
  359    H    LYS  46           H        LYS  46  11.914  -6.524  -6.817
  360    HA   LYS  46           HA       LYS  46  14.688  -6.045  -6.593
  361   1HB   LYS  46          2HB       LYS  46  12.225  -4.413  -6.151
  362   2HB   LYS  46          1HB       LYS  46  13.780  -3.785  -5.655
  363   1HG   LYS  46          2HG       LYS  46  14.579  -4.108  -7.996
  364   2HG   LYS  46          1HG       LYS  46  12.924  -4.540  -8.435
  365   1HD   LYS  46          2HD       LYS  46  12.127  -2.375  -7.736
  366   2HD   LYS  46          1HD       LYS  46  13.727  -1.938  -7.136
  367   1HE   LYS  46          2HE       LYS  46  14.586  -2.180  -9.466
  368   2HE   LYS  46          1HE       LYS  46  12.924  -2.426 -10.001
  369   1HZ   LYS  46          1HZ       LYS  46  13.717  -0.110 -10.241
  370   2HZ   LYS  46          2HZ       LYS  46  13.869  -0.008  -8.555
  371   3HZ   LYS  46          3HZ       LYS  46  12.345  -0.243  -9.253
  372    H    TYR  47           H        TYR  47  12.095  -6.218  -4.160
  373    HA   TYR  47           HA       TYR  47  14.082  -5.642  -2.089
  374   1HB   TYR  47          2HB       TYR  47  11.061  -5.695  -1.964
  375   2HB   TYR  47          1HB       TYR  47  12.121  -5.281  -0.623
  376    HD1  TYR  47           1HD      TYR  47  13.405  -3.180  -0.650
  377    HD2  TYR  47           2HD      TYR  47  10.665  -4.135  -3.756
  378    HE1  TYR  47           1HE      TYR  47  13.436  -0.835  -1.394
  379    HE2  TYR  47           2HE      TYR  47  10.682  -1.798  -4.505
  380    HH   TYR  47           HH       TYR  47  12.991   0.457  -3.443
  381    H    GLY  48           H        GLY  48  11.810  -8.157  -3.068
  382   1HA   GLY  48          2HA       GLY  48  12.414  -9.701  -0.659
  383   2HA   GLY  48          1HA       GLY  48  11.186 -10.079  -1.856
  384    H    SER  49           H        SER  49  14.568  -9.345  -2.520
  385    HA   SER  49           HA       SER  49  14.871 -11.499  -4.305
  386   1HB   SER  49          2HB       SER  49  17.125 -10.052  -2.916
  387   2HB   SER  49          1HB       SER  49  17.135 -10.793  -4.514
  388    HG   SER  49           HG       SER  49  15.359  -9.164  -4.941
  389    H    ASN  50           H        ASN  50  15.247 -11.297  -0.887
  390    HA   ASN  50           HA       ASN  50  16.921 -13.703  -0.771
  391   1HB   ASN  50          2HB       ASN  50  17.421 -11.560   0.525
  392   2HB   ASN  50          1HB       ASN  50  16.063 -11.988   1.548
  393   1HD2  ASN  50          1HD2      ASN  50  18.301 -14.281   0.111
  394   2HD2  ASN  50          2HD2      ASN  50  19.001 -14.807   1.599
  395    H    HIS  51           H        HIS  51  13.763 -13.042  -0.917
  396    HA   HIS  51           HA       HIS  51  13.014 -15.143   1.018
  397   1HB   HIS  51          2HB       HIS  51  11.393 -12.701   0.253
  398   2HB   HIS  51          1HB       HIS  51  10.855 -13.984   1.331
  399    HD1  HIS  51           1HD      HIS  51  11.974 -14.107   3.689
  400    HD2  HIS  51           2HD      HIS  51  13.105 -10.828   1.388
  401    HE1  HIS  51           1HE      HIS  51  13.116 -12.520   5.274
  402    HE2  HIS  51           2HE      HIS  51  13.986 -10.655   3.814
  403    H    ASN  52           H        ASN  52  10.538 -15.704   0.446
  404    HA   ASN  52           HA       ASN  52   9.128 -16.855  -0.850
  405   1HB   ASN  52          2HB       ASN  52   8.879 -14.906  -2.206
  406   2HB   ASN  52          1HB       ASN  52  10.387 -15.239  -3.051
  407   1HD2  ASN  52          1HD2      ASN  52   7.151 -16.474  -2.445
  408   2HD2  ASN  52          2HD2      ASN  52   6.984 -17.292  -3.965
  409    H    VAL  53           H        VAL  53   9.688 -18.880  -0.570
  410    HA   VAL  53           HA       VAL  53  11.916 -20.075  -1.963
  411    HB   VAL  53           HB       VAL  53   9.744 -21.426  -0.347
  412   1HG1  VAL  53          1HG1      VAL  53  12.479 -22.388  -1.178
  413   2HG1  VAL  53          2HG1      VAL  53  10.933 -22.955  -1.813
  414   3HG1  VAL  53          3HG1      VAL  53  11.357 -23.254  -0.127
  415   1HG2  VAL  53          1HG2      VAL  53  10.918 -19.776   1.006
  416   2HG2  VAL  53          2HG2      VAL  53  12.468 -20.475   0.537
  417   3HG2  VAL  53          3HG2      VAL  53  11.335 -21.412   1.511
  418    H    GLN  54           H        GLN  54   8.441 -19.865  -2.243
  419    HA   GLN  54           HA       GLN  54   6.918 -20.614  -3.750
  420   1HB   GLN  54          2HB       GLN  54   8.472 -19.319  -5.277
  421   2HB   GLN  54          1HB       GLN  54   9.237 -20.850  -5.678
  422   1HG   GLN  54          2HG       GLN  54   7.679 -20.248  -7.401
  423   2HG   GLN  54          1HG       GLN  54   7.085 -21.669  -6.545
  424   1HE2  GLN  54          1HE2      GLN  54   5.215 -21.550  -5.394
  425   2HE2  GLN  54          2HE2      GLN  54   4.164 -20.180  -5.418
  426    H    GLY  55           H        GLY  55   6.858 -22.477  -2.311
  427   1HA   GLY  55          2HA       GLY  55   8.443 -24.790  -2.948
  428   2HA   GLY  55          1HA       GLY  55   7.236 -24.668  -1.682
  429    H    THR  56           H        THR  56   5.709 -26.112  -1.926
  430    HA   THR  56           HA       THR  56   4.263 -27.604  -2.813
  431    HB   THR  56           HB       THR  56   4.462 -26.284  -5.470
  432    HG1  THR  56           1HG      THR  56   3.913 -24.518  -4.363
  433   1HG2  THR  56          1HG2      THR  56   2.193 -27.643  -4.030
  434   2HG2  THR  56          2HG2      THR  56   3.159 -28.339  -5.333
  435   3HG2  THR  56          3HG2      THR  56   2.113 -26.955  -5.651
  436    H    THR  57           H        THR  57   5.150 -29.511  -2.934
  437    HA   THR  57           HA       THR  57   6.906 -30.140  -5.201
  438    HB   THR  57           HB       THR  57   7.427 -30.959  -2.334
  439    HG1  THR  57           1HG      THR  57   8.150 -28.783  -3.791
  440   1HG2  THR  57          1HG2      THR  57   8.118 -32.676  -3.941
  441   2HG2  THR  57          2HG2      THR  57   9.517 -31.898  -3.203
  442   3HG2  THR  57          3HG2      THR  57   9.034 -31.467  -4.844
  443    HA   PRO  58           HA       PRO  58   3.854 -33.461  -5.324
  444   1HB   PRO  58          2HB       PRO  58   5.130 -34.080  -7.881
  445   2HB   PRO  58          1HB       PRO  58   3.470 -33.579  -7.558
  446   1HG   PRO  58          2HG       PRO  58   5.245 -31.970  -8.799
  447   2HG   PRO  58          1HG       PRO  58   3.967 -31.343  -7.741
  448   1HD   PRO  58          2HD       PRO  58   6.873 -31.776  -7.150
  449   2HD   PRO  58          1HD       PRO  58   5.825 -30.409  -6.709
  450    H    SER  59           H        SER  59   3.991 -35.803  -5.569
  451    HA   SER  59           HA       SER  59   6.211 -36.904  -4.218
  452   1HB   SER  59          2HB       SER  59   5.086 -39.119  -4.993
  453   2HB   SER  59          1HB       SER  59   4.209 -38.053  -3.895
  454    HG   SER  59           HG       SER  59   3.803 -38.514  -6.650
  455    H    ALA  60           H        ALA  60   5.512 -36.483  -7.589
  456    HA   ALA  60           HA       ALA  60   7.405 -38.327  -8.600
  457   1HB   ALA  60          1HB       ALA  60   6.311 -35.829  -9.883
  458   2HB   ALA  60          2HB       ALA  60   5.578 -37.433  -9.957
  459   3HB   ALA  60          3HB       ALA  60   7.146 -37.146 -10.711
  460    H    ALA  61           H        ALA  61   7.665 -35.158  -7.259
  461    HA   ALA  61           HA       ALA  61  10.232 -34.606  -8.465
  462   1HB   ALA  61          1HB       ALA  61   8.679 -33.089  -6.379
  463   2HB   ALA  61          2HB       ALA  61   8.726 -32.747  -8.110
  464   3HB   ALA  61          3HB       ALA  61  10.177 -32.540  -7.126
  465    H    VAL  62           H        VAL  62   9.194 -36.457  -5.951
  466    HA   VAL  62           HA       VAL  62  11.379 -36.051  -4.136
  467    HB   VAL  62           HB       VAL  62   9.533 -38.436  -4.377
  468   1HG1  VAL  62          1HG1      VAL  62  10.203 -38.933  -2.082
  469   2HG1  VAL  62          2HG1      VAL  62  11.331 -37.577  -2.115
  470   3HG1  VAL  62          3HG1      VAL  62  11.583 -38.962  -3.178
  471   1HG2  VAL  62          1HG2      VAL  62   8.290 -37.431  -2.529
  472   2HG2  VAL  62          2HG2      VAL  62   8.306 -36.372  -3.938
  473   3HG2  VAL  62          3HG2      VAL  62   9.358 -36.028  -2.565
  474    H    SER  63           H        SER  63  10.609 -38.226  -6.758
  475    HA   SER  63           HA       SER  63  12.985 -39.780  -6.633
  476   1HB   SER  63          2HB       SER  63  11.195 -39.243  -9.018
  477   2HB   SER  63          1HB       SER  63  12.331 -40.577  -8.842
  478    HG   SER  63           HG       SER  63   9.987 -40.961  -8.359
  479    H    GLU  64           H        GLU  64  12.086 -36.755  -8.050
  480    HA   GLU  64           HA       GLU  64  14.319 -36.408  -9.765
  481   1HB   GLU  64          2HB       GLU  64  12.068 -35.155  -9.744
  482   2HB   GLU  64          1HB       GLU  64  12.766 -34.184  -8.458
  483   1HG   GLU  64          2HG       GLU  64  13.063 -32.967 -10.448
  484   2HG   GLU  64          1HG       GLU  64  14.642 -33.639 -10.044
  485    H    ALA  65           H        ALA  65  13.651 -35.699  -6.431
  486    HA   ALA  65           HA       ALA  65  15.773 -33.961  -5.852
  487   1HB   ALA  65          1HB       ALA  65  15.335 -34.482  -3.518
  488   2HB   ALA  65          2HB       ALA  65  14.376 -35.882  -3.996
  489   3HB   ALA  65          3HB       ALA  65  13.823 -34.255  -4.395
  490    H    GLU  66           H        GLU  66  15.710 -37.359  -6.326
  491    HA   GLU  66           HA       GLU  66  17.834 -38.252  -4.770
  492   1HB   GLU  66          2HB       GLU  66  16.215 -39.646  -6.118
  493   2HB   GLU  66          1HB       GLU  66  17.131 -39.214  -7.549
  494   1HG   GLU  66          2HG       GLU  66  17.783 -41.395  -6.822
  495   2HG   GLU  66          1HG       GLU  66  19.123 -40.279  -6.571
  496    H    GLN  67           H        GLN  67  17.863 -37.172  -8.161
  497    HA   GLN  67           HA       GLN  67  20.746 -37.208  -8.245
  498   1HB   GLN  67          2HB       GLN  67  20.496 -36.430 -10.552
  499   2HB   GLN  67          1HB       GLN  67  19.478 -37.827 -10.235
  500   1HG   GLN  67          2HG       GLN  67  17.578 -36.228  -9.876
  501   2HG   GLN  67          1HG       GLN  67  18.635 -34.956 -10.488
  502   1HE2  GLN  67          1HE2      GLN  67  16.834 -37.799 -11.255
  503   2HE2  GLN  67          2HE2      GLN  67  16.911 -37.650 -12.975
  504    H    ILE  68           H        ILE  68  18.211 -34.829  -7.800
  505    HA   ILE  68           HA       ILE  68  19.662 -32.506  -8.390
  506    HB   ILE  68           HB       ILE  68  17.382 -32.920  -6.459
  507   1HG1  ILE  68          2HG1      ILE  68  17.497 -31.727  -9.237
  508   2HG1  ILE  68          1HG1      ILE  68  16.874 -33.321  -8.831
  509   1HG2  ILE  68          1HG2      ILE  68  18.542 -30.301  -7.417
  510   2HG2  ILE  68          2HG2      ILE  68  18.658 -30.946  -5.779
  511   3HG2  ILE  68          3HG2      ILE  68  17.086 -30.503  -6.442
  512   1HD1  ILE  68          1HD1      ILE  68  15.089 -32.308  -7.530
  513   2HD1  ILE  68          2HD1      ILE  68  15.085 -31.706  -9.187
  514   3HD1  ILE  68          3HD1      ILE  68  15.727 -30.704  -7.886
  515    H    ARG  69           H        ARG  69  19.229 -34.153  -5.240
  516    HA   ARG  69           HA       ARG  69  20.670 -32.251  -3.753
  517   1HB   ARG  69          2HB       ARG  69  20.717 -33.842  -1.969
  518   2HB   ARG  69          1HB       ARG  69  19.178 -34.033  -2.797
  519   1HG   ARG  69          2HG       ARG  69  19.983 -36.002  -3.929
  520   2HG   ARG  69          1HG       ARG  69  21.587 -35.781  -3.231
  521   1HD   ARG  69          2HD       ARG  69  20.508 -35.992  -0.970
  522   2HD   ARG  69          1HD       ARG  69  19.032 -36.481  -1.806
  523    HE   ARG  69           HE       ARG  69  21.558 -37.980  -1.692
  524   1HH1  ARG  69          1HH1      ARG  69  18.161 -37.815  -2.553
  525   2HH1  ARG  69          2HH1      ARG  69  18.073 -39.485  -3.030
  526   1HH2  ARG  69          1HH2      ARG  69  21.436 -40.165  -2.270
  527   2HH2  ARG  69          2HH2      ARG  69  19.938 -40.826  -2.859
  528    H    GLN  70           H        GLN  70  21.714 -35.057  -5.581
  529    HA   GLN  70           HA       GLN  70  24.378 -35.092  -4.551
  530   1HB   GLN  70          2HB       GLN  70  22.849 -36.933  -5.730
  531   2HB   GLN  70          1HB       GLN  70  23.682 -36.348  -7.161
  532   1HG   GLN  70          2HG       GLN  70  25.129 -37.266  -4.703
  533   2HG   GLN  70          1HG       GLN  70  24.658 -38.351  -6.005
  534   1HE2  GLN  70          1HE2      GLN  70  25.710 -38.214  -7.984
  535   2HE2  GLN  70          2HE2      GLN  70  27.199 -37.356  -8.185
  536    H    LEU  71           H        LEU  71  22.931 -34.113  -7.659
  537    HA   LEU  71           HA       LEU  71  25.334 -33.258  -8.854
  538   1HB   LEU  71          2HB       LEU  71  22.717 -33.553  -9.647
  539   2HB   LEU  71          1HB       LEU  71  22.917 -31.814  -9.677
  540    HG   LEU  71           HG       LEU  71  23.331 -32.825 -11.870
  541   1HD1  LEU  71          1HD1      LEU  71  25.522 -31.806 -12.318
  542   2HD1  LEU  71          2HD1      LEU  71  25.792 -31.657 -10.581
  543   3HD1  LEU  71          3HD1      LEU  71  24.480 -30.763 -11.352
  544   1HD2  LEU  71          1HD2      LEU  71  24.151 -34.994 -11.152
  545   2HD2  LEU  71          2HD2      LEU  71  25.607 -34.243 -10.493
  546   3HD2  LEU  71          3HD2      LEU  71  25.309 -34.219 -12.232
  547    H    LYS  72           H        LYS  72  23.197 -31.744  -6.591
  548    HA   LYS  72           HA       LYS  72  24.133 -29.067  -7.011
  549   1HB   LYS  72          2HB       LYS  72  21.883 -29.784  -6.057
  550   2HB   LYS  72          1HB       LYS  72  22.729 -30.136  -4.559
  551   1HG   LYS  72          2HG       LYS  72  23.057 -27.432  -5.748
  552   2HG   LYS  72          1HG       LYS  72  21.520 -27.828  -4.987
  553   1HD   LYS  72          2HD       LYS  72  24.167 -28.208  -3.604
  554   2HD   LYS  72          1HD       LYS  72  23.254 -26.704  -3.519
  555   1HE   LYS  72          2HE       LYS  72  22.700 -27.933  -1.577
  556   2HE   LYS  72          1HE       LYS  72  21.317 -28.056  -2.661
  557   1HZ   LYS  72          1HZ       LYS  72  21.832 -30.180  -1.642
  558   2HZ   LYS  72          2HZ       LYS  72  23.401 -30.134  -2.282
  559   3HZ   LYS  72          3HZ       LYS  72  22.074 -30.254  -3.316
  560    H    LYS  73           H        LYS  73  25.486 -31.779  -5.526
  561    HA   LYS  73           HA       LYS  73  26.870 -30.400  -3.401
  562   1HB   LYS  73          2HB       LYS  73  27.214 -33.181  -4.542
  563   2HB   LYS  73          1HB       LYS  73  28.094 -32.568  -3.149
  564   1HG   LYS  73          2HG       LYS  73  26.057 -32.344  -1.894
  565   2HG   LYS  73          1HG       LYS  73  25.096 -32.779  -3.306
  566   1HD   LYS  73          2HD       LYS  73  25.181 -34.725  -1.987
  567   2HD   LYS  73          1HD       LYS  73  26.342 -34.996  -3.285
  568   1HE   LYS  73          2HE       LYS  73  27.181 -33.894  -0.618
  569   2HE   LYS  73          1HE       LYS  73  27.023 -35.627  -0.890
  570   1HZ   LYS  73          1HZ       LYS  73  29.277 -35.019  -1.234
  571   2HZ   LYS  73          2HZ       LYS  73  28.864 -33.757  -2.286
  572   3HZ   LYS  73          3HZ       LYS  73  28.621 -35.366  -2.761
  573    H    GLU  74           H        GLU  74  27.446 -28.910  -5.484
  574    HA   GLU  74           HA       GLU  74  30.144 -29.726  -6.307
  575   1HB   GLU  74          2HB       GLU  74  29.840 -28.033  -8.164
  576   2HB   GLU  74          1HB       GLU  74  28.845 -29.476  -8.261
  577   1HG   GLU  74          2HG       GLU  74  27.291 -27.896  -8.768
  578   2HG   GLU  74          1HG       GLU  74  27.100 -27.946  -7.017
  579    H    ASN  75           H        ASN  75  28.360 -27.475  -4.477
  580    HA   ASN  75           HA       ASN  75  29.108 -26.198  -2.746
  581   1HB   ASN  75          2HB       ASN  75  31.028 -27.838  -2.723
  582   2HB   ASN  75          1HB       ASN  75  31.932 -26.672  -3.676
  583   1HD2  ASN  75          1HD2      ASN  75  33.464 -26.289  -2.104
  584   2HD2  ASN  75          2HD2      ASN  75  33.113 -25.450  -0.628
  585    H    ALA  76           H        ALA  76  30.342 -25.613  -5.912
  586    HA   ALA  76           HA       ALA  76  31.531 -23.110  -5.557
  587   1HB   ALA  76          1HB       ALA  76  30.233 -24.237  -8.028
  588   2HB   ALA  76          2HB       ALA  76  31.910 -24.472  -7.537
  589   3HB   ALA  76          3HB       ALA  76  31.337 -22.864  -7.981
  590    H    LEU  77           H        LEU  77  28.198 -23.992  -5.695
  591    HA   LEU  77           HA       LEU  77  26.918 -21.744  -6.589
  592   1HB   LEU  77          2HB       LEU  77  26.223 -23.510  -4.248
  593   2HB   LEU  77          1HB       LEU  77  25.143 -22.306  -4.910
  594    HG   LEU  77           HG       LEU  77  26.208 -24.693  -6.411
  595   1HD1  LEU  77          1HD1      LEU  77  23.469 -24.143  -5.282
  596   2HD1  LEU  77          2HD1      LEU  77  24.628 -25.324  -4.670
  597   3HD1  LEU  77          3HD1      LEU  77  23.922 -25.529  -6.273
  598   1HD2  LEU  77          1HD2      LEU  77  24.572 -24.053  -8.123
  599   2HD2  LEU  77          2HD2      LEU  77  25.797 -22.806  -7.886
  600   3HD2  LEU  77          3HD2      LEU  77  24.185 -22.599  -7.202
  601    H    GLN  78           H        GLN  78  28.212 -22.256  -3.310
  602    HA   GLN  78           HA       GLN  78  27.384 -19.682  -2.371
  603   1HB   GLN  78          2HB       GLN  78  29.334 -21.704  -1.273
  604   2HB   GLN  78          1HB       GLN  78  28.974 -20.185  -0.470
  605   1HG   GLN  78          2HG       GLN  78  26.625 -20.845  -0.292
  606   2HG   GLN  78          1HG       GLN  78  27.010 -22.381  -1.073
  607   1HE2  GLN  78          1HE2      GLN  78  29.182 -20.809   1.147
  608   2HE2  GLN  78          2HE2      GLN  78  29.021 -21.962   2.431
  609    H    ARG  79           H        ARG  79  30.255 -20.977  -3.860
  610    HA   ARG  79           HA       ARG  79  31.922 -18.778  -3.107
  611   1HB   ARG  79          2HB       ARG  79  32.296 -21.210  -4.814
  612   2HB   ARG  79          1HB       ARG  79  33.473 -19.903  -4.890
  613   1HG   ARG  79          2HG       ARG  79  34.228 -21.575  -3.334
  614   2HG   ARG  79          1HG       ARG  79  33.811 -20.106  -2.453
  615   1HD   ARG  79          2HD       ARG  79  31.461 -21.348  -2.281
  616   2HD   ARG  79          1HD       ARG  79  32.490 -22.768  -2.462
  617    HE   ARG  79           HE       ARG  79  33.597 -21.106  -0.501
  618   1HH1  ARG  79          1HH1      ARG  79  30.825 -23.189  -0.974
  619   2HH1  ARG  79          2HH1      ARG  79  30.581 -23.456   0.720
  620   1HH2  ARG  79          1HH2      ARG  79  33.280 -21.451   1.727
  621   2HH2  ARG  79          2HH2      ARG  79  31.961 -22.455   2.262
  622    H    ALA  80           H        ALA  80  29.664 -19.329  -5.560
  623    HA   ALA  80           HA       ALA  80  30.664 -17.663  -7.600
  624   1HB   ALA  80          1HB       ALA  80  28.344 -17.526  -8.374
  625   2HB   ALA  80          2HB       ALA  80  27.790 -18.231  -6.855
  626   3HB   ALA  80          3HB       ALA  80  28.781 -19.183  -7.960
  627    H    ARG  81           H        ARG  81  29.305 -17.006  -4.517
  628    HA   ARG  81           HA       ARG  81  28.542 -14.294  -5.009
  629   1HB   ARG  81          2HB       ARG  81  29.038 -15.847  -2.474
  630   2HB   ARG  81          1HB       ARG  81  28.565 -14.154  -2.479
  631   1HG   ARG  81          2HG       ARG  81  26.517 -14.790  -3.731
  632   2HG   ARG  81          1HG       ARG  81  26.991 -16.482  -3.550
  633   1HD   ARG  81          2HD       ARG  81  26.868 -16.316  -1.156
  634   2HD   ARG  81          1HD       ARG  81  26.572 -14.580  -1.249
  635    HE   ARG  81           HE       ARG  81  24.673 -16.659  -2.148
  636   1HH1  ARG  81          1HH1      ARG  81  25.371 -13.466  -0.905
  637   2HH1  ARG  81          2HH1      ARG  81  23.710 -13.069  -0.610
  638   1HH2  ARG  81          1HH2      ARG  81  22.472 -16.136  -1.789
  639   2HH2  ARG  81          2HH2      ARG  81  22.051 -14.569  -1.150
  640    H    THR  82           H        THR  82  31.465 -15.911  -4.254
  641    HA   THR  82           HA       THR  82  32.915 -13.726  -3.174
  642    HB   THR  82           HB       THR  82  34.063 -16.095  -4.665
  643    HG1  THR  82           1HG      THR  82  32.803 -15.893  -2.205
  644   1HG2  THR  82          1HG2      THR  82  35.661 -14.298  -4.192
  645   2HG2  THR  82          2HG2      THR  82  36.007 -15.726  -3.216
  646   3HG2  THR  82          3HG2      THR  82  35.201 -14.335  -2.488
  647    H    ARG  83           H        ARG  83  32.162 -14.820  -6.357
  648    HA   ARG  83           HA       ARG  83  32.154 -13.822  -8.363
  649   1HB   ARG  83          2HB       ARG  83  31.287 -11.894  -7.182
  650   2HB   ARG  83          1HB       ARG  83  32.919 -11.377  -6.781
  651   1HG   ARG  83          2HG       ARG  83  33.371 -11.175  -9.211
  652   2HG   ARG  83          1HG       ARG  83  31.660 -11.491  -9.504
  653   1HD   ARG  83          2HD       ARG  83  32.764  -9.227  -7.844
  654   2HD   ARG  83          1HD       ARG  83  32.166  -9.085  -9.497
  655    HE   ARG  83           HE       ARG  83  30.074 -10.181  -8.159
  656   1HH1  ARG  83          1HH1      ARG  83  32.075  -7.379  -7.538
  657   2HH1  ARG  83          2HH1      ARG  83  30.778  -6.448  -6.839
  658   1HH2  ARG  83          1HH2      ARG  83  28.368  -8.966  -7.250
  659   2HH2  ARG  83          2HH2      ARG  83  28.658  -7.333  -6.721
  660    H    HIS  84           H        HIS  84  33.507 -14.030  -9.973
  661    HA   HIS  84           HA       HIS  84  36.362 -13.501  -9.554
  662   1HB   HIS  84          2HB       HIS  84  34.846 -15.170 -11.553
  663   2HB   HIS  84          1HB       HIS  84  36.498 -14.653 -11.884
  664    HD1  HIS  84           1HD      HIS  84  34.591 -17.280 -10.239
  665    HD2  HIS  84           2HD      HIS  84  38.373 -15.593  -9.838
  666    HE1  HIS  84           1HE      HIS  84  35.941 -18.941  -8.923
  667    HE2  HIS  84           2HE      HIS  84  38.282 -18.000  -8.900
  668    HA   PRO  85           HA       PRO  85  36.122  -9.815 -11.963
  669   1HB   PRO  85          2HB       PRO  85  38.522  -9.796 -13.240
  670   2HB   PRO  85          1HB       PRO  85  38.342  -9.447 -11.516
  671   1HG   PRO  85          2HG       PRO  85  39.187 -11.983 -12.857
  672   2HG   PRO  85          1HG       PRO  85  39.847 -11.207 -11.405
  673   1HD   PRO  85          2HD       PRO  85  38.139 -13.312 -11.290
  674   2HD   PRO  85          1HD       PRO  85  38.187 -12.047 -10.045
  675    H    ALA  86           H        ALA  86  36.464  -8.971 -14.264
  676    HA   ALA  86           HA       ALA  86  35.831 -11.062 -16.232
  677   1HB   ALA  86          1HB       ALA  86  34.431  -8.400 -15.957
  678   2HB   ALA  86          2HB       ALA  86  33.746  -9.976 -15.557
  679   3HB   ALA  86          3HB       ALA  86  34.147  -9.586 -17.230
  680    H    GLU  87           H        GLU  87  38.264  -9.572 -15.550
  681    HA   GLU  87           HA       GLU  87  38.725  -7.524 -17.465
  682   1HB   GLU  87          2HB       GLU  87  40.734  -9.202 -15.948
  683   2HB   GLU  87          1HB       GLU  87  41.051  -7.664 -16.746
  684   1HG   GLU  87          2HG       GLU  87  39.665  -6.490 -15.207
  685   2HG   GLU  87          1HG       GLU  87  39.075  -7.995 -14.504
  686    H    SER  88           H        SER  88  38.863 -10.959 -17.548
  687    HA   SER  88           HA       SER  88  40.622 -11.273 -19.755
  688   1HB   SER  88          2HB       SER  88  39.399 -13.561 -19.851
  689   2HB   SER  88          1HB       SER  88  40.333 -13.178 -18.403
  690    HG   SER  88           HG       SER  88  38.194 -14.004 -17.976
  691    H    CYS  89           H        CYS  89  37.253 -10.499 -19.449
  692    HA   CYS  89           HA       CYS  89  36.458 -11.300 -22.069
  693   1HB   CYS  89          2HB       CYS  89  34.862 -11.099 -20.191
  694   2HB   CYS  89          1HB       CYS  89  35.130  -9.360 -20.162
  695    HG   CYS  89           HG       CYS  89  34.334  -9.773 -23.172
  696    H    LEU  90           H        LEU  90  38.038  -8.567 -20.766
  697    HA   LEU  90           HA       LEU  90  37.197  -6.514 -22.452
  698   1HB   LEU  90          2HB       LEU  90  38.524  -6.136 -20.437
  699   2HB   LEU  90          1HB       LEU  90  39.900  -6.929 -21.178
  700    HG   LEU  90           HG       LEU  90  39.986  -5.125 -22.877
  701   1HD1  LEU  90          1HD1      LEU  90  38.700  -3.079 -22.498
  702   2HD1  LEU  90          2HD1      LEU  90  37.851  -3.861 -21.165
  703   3HD1  LEU  90          3HD1      LEU  90  37.639  -4.454 -22.812
  704   1HD2  LEU  90          1HD2      LEU  90  40.842  -3.392 -21.347
  705   2HD2  LEU  90          2HD2      LEU  90  41.406  -5.007 -20.916
  706   3HD2  LEU  90          3HD2      LEU  90  40.107  -4.251 -19.995
  707    H    GLU  91           H        GLU  91  39.729  -8.952 -22.927
  708    HA   GLU  91           HA       GLU  91  40.783  -7.742 -25.276
  709   1HB   GLU  91          2HB       GLU  91  42.143  -9.272 -23.952
  710   2HB   GLU  91          1HB       GLU  91  41.023 -10.588 -24.289
  711   1HG   GLU  91          2HG       GLU  91  41.559 -10.431 -26.669
  712   2HG   GLU  91          1HG       GLU  91  42.701  -9.131 -26.324
  713    H    HIS  92           H        HIS  92  38.251 -10.110 -24.689
  714    HA   HIS  92           HA       HIS  92  37.864 -10.308 -27.606
  715   1HB   HIS  92          2HB       HIS  92  37.197 -12.346 -25.472
  716   2HB   HIS  92          1HB       HIS  92  36.740 -12.493 -27.164
  717    HD1  HIS  92           1HD      HIS  92  39.106 -13.774 -24.949
  718    HD2  HIS  92           2HD      HIS  92  39.364 -12.211 -28.793
  719    HE1  HIS  92           1HE      HIS  92  41.241 -14.691 -25.909
  720    HE2  HIS  92           2HE      HIS  92  41.493 -13.528 -28.134
  721    H    HIS  93           H        HIS  93  36.460  -8.581 -27.807
  722    HA   HIS  93           HA       HIS  93  34.119  -8.275 -26.226
  723   1HB   HIS  93          2HB       HIS  93  34.906  -7.238 -28.951
  724   2HB   HIS  93          1HB       HIS  93  33.347  -6.868 -28.219
  725    HD1  HIS  93           1HD      HIS  93  37.017  -6.146 -27.880
  726    HD2  HIS  93           2HD      HIS  93  33.409  -5.032 -26.140
  727    HE1  HIS  93           1HE      HIS  93  37.547  -4.157 -26.434
  728    HE2  HIS  93           2HE      HIS  93  35.393  -3.639 -25.228
  729    H    HIS  94           H        HIS  94  32.189  -9.250 -26.374
  730    HA   HIS  94           HA       HIS  94  32.185 -11.714 -27.841
  731   1HB   HIS  94          2HB       HIS  94  30.226 -12.304 -26.606
  732   2HB   HIS  94          1HB       HIS  94  31.320 -11.494 -25.495
  733    HD1  HIS  94           1HD      HIS  94  27.876 -11.597 -26.402
  734    HD2  HIS  94           2HD      HIS  94  30.506  -8.585 -25.246
  735    HE1  HIS  94           1HE      HIS  94  26.433  -9.698 -25.611
  736    HE2  HIS  94           2HE      HIS  94  28.043  -7.971 -24.734
  737    H    HIS  95           H        HIS  95  31.298 -12.163 -29.688
  738    HA   HIS  95           HA       HIS  95  29.128 -10.464 -30.690
  739   1HB   HIS  95          2HB       HIS  95  29.955 -10.961 -33.021
  740   2HB   HIS  95          1HB       HIS  95  30.996  -9.904 -32.079
  741    HD1  HIS  95           1HD      HIS  95  31.114 -12.821 -34.199
  742    HD2  HIS  95           2HD      HIS  95  33.302 -11.414 -30.947
  743    HE1  HIS  95           1HE      HIS  95  33.307 -14.056 -34.261
  744    HE2  HIS  95           2HE      HIS  95  34.574 -13.262 -32.227
  745    H    HIS  96           H        HIS  96  27.438 -11.647 -30.288
  746    HA   HIS  96           HA       HIS  96  27.413 -14.425 -29.950
  747   1HB   HIS  96          2HB       HIS  96  25.025 -14.230 -29.740
  748   2HB   HIS  96          1HB       HIS  96  25.758 -12.816 -28.992
  749    HD1  HIS  96           1HD      HIS  96  23.412 -13.843 -31.653
  750    HD2  HIS  96           2HD      HIS  96  25.433 -10.392 -30.507
  751    HE1  HIS  96           1HE      HIS  96  22.298 -11.958 -32.892
  752    HE2  HIS  96           2HE      HIS  96  23.397  -9.870 -32.008
  753    H    HIS  97           H        HIS  97  26.126 -16.003 -31.117
  754    HA   HIS  97           HA       HIS  97  26.134 -15.578 -34.018
  755   1HB   HIS  97          2HB       HIS  97  25.852 -18.114 -32.381
  756   2HB   HIS  97          1HB       HIS  97  25.734 -18.054 -34.135
  757    HD1  HIS  97           1HD      HIS  97  27.972 -17.388 -35.431
  758    HD2  HIS  97           2HD      HIS  97  28.407 -18.243 -31.380
  759    HE1  HIS  97           1HE      HIS  97  30.431 -17.768 -35.072
  760    HE2  HIS  97           2HE      HIS  97  30.683 -18.212 -32.608
  Start of MODEL   11
    1   1H    MET   1          1HT       MET   1   7.618  14.480  -3.564
    2   2H    MET   1          2HT       MET   1   8.318  13.432  -4.693
    3   3H    MET   1          3HT       MET   1   7.657  12.816  -3.255
    4    HA   MET   1           HA       MET   1   6.161  14.128  -5.447
    5   1HB   MET   1          2HB       MET   1   6.994  11.797  -5.881
    6   2HB   MET   1          1HB       MET   1   6.066  11.261  -4.489
    7   1HG   MET   1          2HG       MET   1   4.002  11.905  -5.560
    8   2HG   MET   1          1HG       MET   1   4.894  12.581  -6.925
    9   1HE   MET   1          1HE       MET   1   3.520  11.234  -8.671
   10   2HE   MET   1          2HE       MET   1   2.531  10.539  -7.388
   11   3HE   MET   1          3HE       MET   1   3.258   9.491  -8.608
   12    HA   PRO   2           HA       PRO   2   3.785  14.947  -1.677
   13   1HB   PRO   2          2HB       PRO   2   2.530  17.072  -3.186
   14   2HB   PRO   2          1HB       PRO   2   3.610  17.195  -1.799
   15   1HG   PRO   2          2HG       PRO   2   4.312  17.977  -4.315
   16   2HG   PRO   2          1HG       PRO   2   5.478  17.403  -3.107
   17   1HD   PRO   2          2HD       PRO   2   4.261  15.936  -5.415
   18   2HD   PRO   2          1HD       PRO   2   5.934  15.907  -4.817
   19    H    THR   3           H        THR   3   2.518  14.937  -4.934
   20    HA   THR   3           HA       THR   3  -0.140  14.206  -3.997
   21    HB   THR   3           HB       THR   3  -0.632  14.289  -6.525
   22    HG1  THR   3           1HG      THR   3   1.544  14.247  -7.228
   23   1HG2  THR   3          1HG2      THR   3  -0.842  16.720  -6.484
   24   2HG2  THR   3          2HG2      THR   3   0.258  16.803  -5.107
   25   3HG2  THR   3          3HG2      THR   3  -1.317  16.027  -4.934
   26    H    LYS   4           H        LYS   4  -0.658  12.168  -3.756
   27    HA   LYS   4           HA       LYS   4  -0.780   9.929  -3.939
   28   1HB   LYS   4          2HB       LYS   4  -1.276  10.514  -6.321
   29   2HB   LYS   4          1HB       LYS   4   0.429  10.310  -6.684
   30   1HG   LYS   4          2HG       LYS   4  -1.134   8.069  -5.465
   31   2HG   LYS   4          1HG       LYS   4  -1.225   8.394  -7.197
   32   1HD   LYS   4          2HD       LYS   4   1.274   8.276  -7.250
   33   2HD   LYS   4          1HD       LYS   4   1.221   7.719  -5.579
   34   1HE   LYS   4          2HE       LYS   4  -0.097   5.792  -6.237
   35   2HE   LYS   4          1HE       LYS   4  -0.122   6.355  -7.909
   36   1HZ   LYS   4          1HZ       LYS   4   2.269   5.520  -6.366
   37   2HZ   LYS   4          2HZ       LYS   4   2.319   6.177  -7.923
   38   3HZ   LYS   4          3HZ       LYS   4   1.559   4.684  -7.661
   39    H    THR   5           H        THR   5   0.690   9.600  -2.285
   40    HA   THR   5           HA       THR   5   3.422   8.879  -3.150
   41    HB   THR   5           HB       THR   5   2.805   9.571  -0.305
   42    HG1  THR   5           1HG      THR   5   3.594  11.573  -2.164
   43   1HG2  THR   5          1HG2      THR   5   5.139  10.356  -0.350
   44   2HG2  THR   5          2HG2      THR   5   5.237   9.930  -2.059
   45   3HG2  THR   5          3HG2      THR   5   5.000   8.670  -0.847
   46    H    TYR   6           H        TYR   6   4.400   7.108  -1.964
   47    HA   TYR   6           HA       TYR   6   2.546   5.396  -0.509
   48   1HB   TYR   6          2HB       TYR   6   3.460   3.418  -1.684
   49   2HB   TYR   6          1HB       TYR   6   2.580   4.487  -2.760
   50    HD1  TYR   6           1HD      TYR   6   6.096   3.988  -1.565
   51    HD2  TYR   6           2HD      TYR   6   3.515   4.835  -4.837
   52    HE1  TYR   6           1HE      TYR   6   8.027   3.992  -3.075
   53    HE2  TYR   6           2HE      TYR   6   5.447   4.842  -6.360
   54    HH   TYR   6           HH       TYR   6   7.924   5.197  -6.204
   55    H    SER   7           H        SER   7   3.820   3.596   0.605
   56    HA   SER   7           HA       SER   7   6.389   4.679   1.550
   57   1HB   SER   7          2HB       SER   7   4.498   2.773   2.953
   58   2HB   SER   7          1HB       SER   7   5.984   3.444   3.626
   59    HG   SER   7           HG       SER   7   5.027   5.312   3.951
   60    H    GLU   8           H        GLU   8   8.190   3.327   1.666
   61    HA   GLU   8           HA       GLU   8   8.409   1.187  -0.143
   62   1HB   GLU   8          2HB       GLU   8  10.576   0.741   0.927
   63   2HB   GLU   8          1HB       GLU   8  10.347   2.458   0.629
   64   1HG   GLU   8          2HG       GLU   8   9.948   2.907   2.902
   65   2HG   GLU   8          1HG       GLU   8   9.753   1.196   3.283
   66    H    GLU   9           H        GLU   9   7.515   1.319   3.207
   67    HA   GLU   9           HA       GLU   9   7.784  -1.339   3.953
   68   1HB   GLU   9          2HB       GLU   9   5.702   0.678   4.811
   69   2HB   GLU   9          1HB       GLU   9   6.172  -0.763   5.687
   70   1HG   GLU   9          2HG       GLU   9   8.411   0.119   6.005
   71   2HG   GLU   9          1HG       GLU   9   7.983   1.550   5.069
   72    H    PHE  10           H        PHE  10   5.340   0.327   2.112
   73    HA   PHE  10           HA       PHE  10   3.399  -1.754   2.133
   74   1HB   PHE  10          2HB       PHE  10   2.859   0.628   1.692
   75   2HB   PHE  10          1HB       PHE  10   3.755   0.532   0.182
   76    HD1  PHE  10           1HD      PHE  10   0.857  -0.936   1.978
   77    HD2  PHE  10           2HD      PHE  10   2.687  -0.113  -1.773
   78    HE1  PHE  10           1HE      PHE  10  -1.196  -1.653   0.825
   79    HE2  PHE  10           2HE      PHE  10   0.639  -0.830  -2.934
   80    HZ   PHE  10           HZ       PHE  10  -1.307  -1.601  -1.634
   81    H    LYS  11           H        LYS  11   6.128  -0.900   0.086
   82    HA   LYS  11           HA       LYS  11   5.547  -2.689  -2.028
   83   1HB   LYS  11          2HB       LYS  11   8.184  -1.541  -1.097
   84   2HB   LYS  11          1HB       LYS  11   7.994  -2.502  -2.556
   85   1HG   LYS  11          2HG       LYS  11   6.367  -0.799  -3.380
   86   2HG   LYS  11          1HG       LYS  11   6.781   0.188  -1.974
   87   1HD   LYS  11          2HD       LYS  11   9.102   0.275  -2.691
   88   2HD   LYS  11          1HD       LYS  11   8.734  -0.777  -4.062
   89   1HE   LYS  11          2HE       LYS  11   7.236   0.910  -4.973
   90   2HE   LYS  11          1HE       LYS  11   7.550   1.954  -3.590
   91   1HZ   LYS  11          1HZ       LYS  11   8.910   2.750  -5.294
   92   2HZ   LYS  11          2HZ       LYS  11   9.402   1.202  -5.773
   93   3HZ   LYS  11          3HZ       LYS  11   9.965   1.853  -4.311
   94    H    ARG  12           H        ARG  12   7.443  -3.027   0.955
   95    HA   ARG  12           HA       ARG  12   8.233  -5.709   0.390
   96   1HB   ARG  12          2HB       ARG  12   9.481  -4.305   1.991
   97   2HB   ARG  12          1HB       ARG  12   8.093  -4.308   3.072
   98   1HG   ARG  12          2HG       ARG  12   8.288  -6.674   3.418
   99   2HG   ARG  12          1HG       ARG  12   9.556  -6.791   2.198
  100   1HD   ARG  12          2HD       ARG  12  11.018  -5.406   3.590
  101   2HD   ARG  12          1HD       ARG  12   9.745  -5.289   4.808
  102    HE   ARG  12           HE       ARG  12   9.931  -7.781   4.986
  103   1HH1  ARG  12          1HH1      ARG  12  12.660  -5.854   3.892
  104   2HH1  ARG  12          2HH1      ARG  12  13.834  -7.062   4.328
  105   1HH2  ARG  12          1HH2      ARG  12  11.484  -9.341   5.568
  106   2HH2  ARG  12          2HH2      ARG  12  13.167  -9.017   5.300
  107    H    ASP  13           H        ASP  13   5.475  -4.237   1.967
  108    HA   ASP  13           HA       ASP  13   4.369  -6.596   3.064
  109   1HB   ASP  13          2HB       ASP  13   3.565  -4.415   3.776
  110   2HB   ASP  13          1HB       ASP  13   3.012  -4.055   2.144
  111    H    ALA  14           H        ALA  14   4.122  -5.061  -0.094
  112    HA   ALA  14           HA       ALA  14   2.204  -6.790  -1.203
  113   1HB   ALA  14          1HB       ALA  14   4.450  -5.322  -2.575
  114   2HB   ALA  14          2HB       ALA  14   2.837  -4.688  -2.254
  115   3HB   ALA  14          3HB       ALA  14   3.048  -6.035  -3.374
  116    H    VAL  15           H        VAL  15   5.701  -7.077  -0.824
  117    HA   VAL  15           HA       VAL  15   6.040  -9.436  -2.355
  118    HB   VAL  15           HB       VAL  15   7.678  -8.559   0.041
  119   1HG1  VAL  15          1HG1      VAL  15   9.454  -9.904  -1.009
  120   2HG1  VAL  15          2HG1      VAL  15   8.327 -10.393  -2.270
  121   3HG1  VAL  15          3HG1      VAL  15   8.050 -10.893  -0.602
  122   1HG2  VAL  15          1HG2      VAL  15   7.610  -6.780  -1.606
  123   2HG2  VAL  15          2HG2      VAL  15   7.991  -7.921  -2.892
  124   3HG2  VAL  15          3HG2      VAL  15   9.190  -7.564  -1.653
  125    H    ALA  16           H        ALA  16   5.354  -8.858   1.071
  126    HA   ALA  16           HA       ALA  16   5.286 -11.566   1.862
  127   1HB   ALA  16          1HB       ALA  16   3.871  -9.186   3.060
  128   2HB   ALA  16          2HB       ALA  16   5.493  -9.746   3.466
  129   3HB   ALA  16          3HB       ALA  16   4.092 -10.750   3.845
  130    H    LEU  17           H        LEU  17   2.853  -9.374   0.558
  131    HA   LEU  17           HA       LEU  17   0.635 -11.108   0.805
  132   1HB   LEU  17          2HB       LEU  17   0.599  -8.633   0.322
  133   2HB   LEU  17          1HB       LEU  17   1.090  -9.010  -1.317
  134    HG   LEU  17           HG       LEU  17  -0.987 -10.255  -1.673
  135   1HD1  LEU  17          1HD1      LEU  17  -1.344 -11.030   0.622
  136   2HD1  LEU  17          2HD1      LEU  17  -2.770 -10.201  -0.004
  137   3HD1  LEU  17          3HD1      LEU  17  -1.697  -9.377   1.125
  138   1HD2  LEU  17          1HD2      LEU  17  -2.529  -8.358  -1.624
  139   2HD2  LEU  17          2HD2      LEU  17  -0.932  -7.873  -2.197
  140   3HD2  LEU  17          3HD2      LEU  17  -1.431  -7.492  -0.548
  141    H    TYR  18           H        TYR  18   3.086 -10.642  -1.685
  142    HA   TYR  18           HA       TYR  18   2.096 -12.394  -3.628
  143   1HB   TYR  18          2HB       TYR  18   3.866 -10.966  -4.268
  144   2HB   TYR  18          1HB       TYR  18   4.879 -11.481  -2.926
  145    HD1  TYR  18           1HD      TYR  18   3.273 -12.841  -6.016
  146    HD2  TYR  18           2HD      TYR  18   6.547 -13.027  -3.307
  147    HE1  TYR  18           1HE      TYR  18   4.375 -14.492  -7.467
  148    HE2  TYR  18           2HE      TYR  18   7.657 -14.677  -4.750
  149    HH   TYR  18           HH       TYR  18   7.131 -16.284  -6.442
  150    H    GLU  19           H        GLU  19   4.043 -13.010  -0.750
  151    HA   GLU  19           HA       GLU  19   4.624 -15.710  -1.194
  152   1HB   GLU  19          2HB       GLU  19   4.149 -14.154   1.345
  153   2HB   GLU  19          1HB       GLU  19   4.635 -15.844   1.349
  154   1HG   GLU  19          2HG       GLU  19   6.198 -13.644   0.021
  155   2HG   GLU  19          1HG       GLU  19   6.491 -14.218   1.662
  156    H    ASN  20           H        ASN  20   1.665 -14.142  -0.292
  157    HA   ASN  20           HA       ASN  20   0.411 -16.706   0.379
  158   1HB   ASN  20          2HB       ASN  20  -0.467 -13.848   0.814
  159   2HB   ASN  20          1HB       ASN  20  -1.491 -15.236   1.151
  160   1HD2  ASN  20          1HD2      ASN  20   1.251 -13.385   2.138
  161   2HD2  ASN  20          2HD2      ASN  20   1.460 -14.136   3.682
  162    H    SER  21           H        SER  21   1.111 -15.635  -2.378
  163    HA   SER  21           HA       SER  21  -1.282 -14.879  -3.680
  164   1HB   SER  21          2HB       SER  21  -0.046 -15.503  -5.774
  165   2HB   SER  21          1HB       SER  21   0.794 -14.362  -4.728
  166    HG   SER  21           HG       SER  21   2.260 -15.824  -4.240
  167    H    ASP  22           H        ASP  22  -0.220 -17.894  -2.542
  168    HA   ASP  22           HA       ASP  22  -1.615 -19.625  -4.256
  169   1HB   ASP  22          2HB       ASP  22  -0.027 -20.414  -2.536
  170   2HB   ASP  22          1HB       ASP  22  -1.162 -19.928  -1.279
  171    H    GLY  23           H        GLY  23  -2.664 -17.437  -1.793
  172   1HA   GLY  23          2HA       GLY  23  -5.403 -18.492  -1.902
  173   2HA   GLY  23          1HA       GLY  23  -4.798 -17.319  -0.738
  174    H    ALA  24           H        ALA  24  -3.462 -15.950  -3.162
  175    HA   ALA  24           HA       ALA  24  -5.826 -14.733  -4.367
  176   1HB   ALA  24          1HB       ALA  24  -5.373 -13.386  -2.376
  177   2HB   ALA  24          2HB       ALA  24  -5.043 -12.471  -3.848
  178   3HB   ALA  24          3HB       ALA  24  -3.710 -13.146  -2.910
  179    H    SER  25           H        SER  25  -5.517 -14.590  -6.472
  180    HA   SER  25           HA       SER  25  -3.139 -15.485  -7.676
  181   1HB   SER  25          2HB       SER  25  -5.415 -13.956  -8.953
  182   2HB   SER  25          1HB       SER  25  -4.249 -14.988  -9.783
  183    HG   SER  25           HG       SER  25  -5.153 -16.573  -8.024
  184    H    LEU  26           H        LEU  26  -1.689 -14.433  -9.069
  185    HA   LEU  26           HA       LEU  26  -0.419 -12.226  -8.037
  186   1HB   LEU  26          2HB       LEU  26  -0.062 -13.973 -10.209
  187   2HB   LEU  26          1HB       LEU  26   0.004 -12.358 -10.886
  188    HG   LEU  26           HG       LEU  26   1.722 -13.325  -8.596
  189   1HD1  LEU  26          1HD1      LEU  26   3.541 -13.310 -10.232
  190   2HD1  LEU  26          2HD1      LEU  26   2.386 -12.927 -11.509
  191   3HD1  LEU  26          3HD1      LEU  26   2.288 -14.472 -10.664
  192   1HD2  LEU  26          1HD2      LEU  26   1.796 -10.790 -10.228
  193   2HD2  LEU  26          2HD2      LEU  26   2.983 -11.263  -9.014
  194   3HD2  LEU  26          3HD2      LEU  26   1.321 -10.927  -8.534
  195    H    GLN  27           H        GLN  27  -2.745 -12.285 -10.750
  196    HA   GLN  27           HA       GLN  27  -2.618  -9.541 -11.331
  197   1HB   GLN  27          2HB       GLN  27  -3.730 -11.143 -12.822
  198   2HB   GLN  27          1HB       GLN  27  -4.997 -11.383 -11.626
  199   1HG   GLN  27          2HG       GLN  27  -5.749  -9.868 -13.382
  200   2HG   GLN  27          1HG       GLN  27  -5.650  -9.042 -11.834
  201   1HE2  GLN  27          1HE2      GLN  27  -5.566  -7.065 -12.954
  202   2HE2  GLN  27          2HE2      GLN  27  -4.101  -6.517 -13.689
  203    H    GLN  28           H        GLN  28  -4.690 -11.314  -9.071
  204    HA   GLN  28           HA       GLN  28  -6.329  -9.176  -8.313
  205   1HB   GLN  28          2HB       GLN  28  -6.887 -11.497  -7.784
  206   2HB   GLN  28          1HB       GLN  28  -5.498 -11.602  -6.714
  207   1HG   GLN  28          2HG       GLN  28  -7.647 -11.307  -5.530
  208   2HG   GLN  28          1HG       GLN  28  -6.466 -10.044  -5.184
  209   1HE2  GLN  28          1HE2      GLN  28  -8.032  -8.584  -4.544
  210   2HE2  GLN  28          2HE2      GLN  28  -9.076  -7.798  -5.685
  211    H    ILE  29           H        ILE  29  -3.208 -10.259  -7.081
  212    HA   ILE  29           HA       ILE  29  -2.990  -8.589  -4.853
  213    HB   ILE  29           HB       ILE  29  -0.719  -9.330  -6.709
  214   1HG1  ILE  29          2HG1      ILE  29  -1.973 -11.336  -6.034
  215   2HG1  ILE  29          1HG1      ILE  29  -0.383 -11.298  -5.275
  216   1HG2  ILE  29          1HG2      ILE  29   0.668  -9.120  -4.696
  217   2HG2  ILE  29          2HG2      ILE  29  -0.750  -8.609  -3.777
  218   3HG2  ILE  29          3HG2      ILE  29  -0.144  -7.606  -5.096
  219   1HD1  ILE  29          1HD1      ILE  29  -1.426 -10.471  -3.208
  220   2HD1  ILE  29          2HD1      ILE  29  -2.045 -12.047  -3.703
  221   3HD1  ILE  29          3HD1      ILE  29  -3.011 -10.597  -3.979
  222    H    ALA  30           H        ALA  30  -1.835  -7.972  -8.177
  223    HA   ALA  30           HA       ALA  30  -1.107  -5.269  -7.650
  224   1HB   ALA  30          1HB       ALA  30  -0.096  -6.602  -9.439
  225   2HB   ALA  30          2HB       ALA  30  -0.790  -5.105 -10.061
  226   3HB   ALA  30          3HB       ALA  30  -1.643  -6.632 -10.287
  227    H    ASN  31           H        ASN  31  -4.005  -6.848  -8.793
  228    HA   ASN  31           HA       ASN  31  -5.381  -4.603  -9.811
  229   1HB   ASN  31          2HB       ASN  31  -5.961  -7.026 -10.180
  230   2HB   ASN  31          1HB       ASN  31  -6.568  -7.080  -8.532
  231   1HD2  ASN  31          1HD2      ASN  31  -7.103  -5.971 -11.747
  232   2HD2  ASN  31          2HD2      ASN  31  -8.740  -5.474 -11.532
  233    H    ASP  32           H        ASP  32  -5.274  -6.091  -6.609
  234    HA   ASP  32           HA       ASP  32  -7.201  -4.371  -5.420
  235   1HB   ASP  32          2HB       ASP  32  -6.511  -6.639  -4.572
  236   2HB   ASP  32          1HB       ASP  32  -4.997  -5.913  -4.041
  237    H    LEU  33           H        LEU  33  -3.676  -4.387  -5.581
  238    HA   LEU  33           HA       LEU  33  -3.294  -2.137  -3.891
  239   1HB   LEU  33          2HB       LEU  33  -1.591  -3.747  -5.715
  240   2HB   LEU  33          1HB       LEU  33  -1.017  -2.150  -5.280
  241    HG   LEU  33           HG       LEU  33  -1.031  -2.747  -2.919
  242   1HD1  LEU  33          1HD1      LEU  33  -1.997  -5.454  -3.833
  243   2HD1  LEU  33          2HD1      LEU  33  -2.918  -4.279  -2.894
  244   3HD1  LEU  33          3HD1      LEU  33  -1.489  -5.039  -2.194
  245   1HD2  LEU  33          1HD2      LEU  33   0.767  -4.392  -2.959
  246   2HD2  LEU  33          2HD2      LEU  33   0.965  -3.200  -4.244
  247   3HD2  LEU  33          3HD2      LEU  33   0.355  -4.810  -4.623
  248    H    GLY  34           H        GLY  34  -3.881  -2.517  -7.306
  249   1HA   GLY  34          2HA       GLY  34  -4.815  -0.821  -8.652
  250   2HA   GLY  34          1HA       GLY  34  -4.245   0.378  -7.503
  251    H    ILE  35           H        ILE  35  -2.231  -2.171  -8.808
  252    HA   ILE  35           HA       ILE  35  -0.858  -0.192 -10.494
  253    HB   ILE  35           HB       ILE  35   1.299  -1.302  -9.896
  254   1HG1  ILE  35          2HG1      ILE  35  -0.348  -2.525  -7.674
  255   2HG1  ILE  35          1HG1      ILE  35   0.346  -3.405  -9.034
  256   1HG2  ILE  35          1HG2      ILE  35   0.652   0.843  -8.927
  257   2HG2  ILE  35          2HG2      ILE  35   1.586  -0.120  -7.783
  258   3HG2  ILE  35          3HG2      ILE  35  -0.165   0.005  -7.607
  259   1HD1  ILE  35          1HD1      ILE  35   1.690  -3.718  -7.058
  260   2HD1  ILE  35          2HD1      ILE  35   1.862  -1.974  -6.861
  261   3HD1  ILE  35          3HD1      ILE  35   2.594  -2.780  -8.248
  262    H    ASN  36           H        ASN  36   0.759  -1.415 -11.993
  263    HA   ASN  36           HA       ASN  36  -0.713  -3.442 -13.388
  264   1HB   ASN  36          2HB       ASN  36   0.701  -1.627 -14.461
  265   2HB   ASN  36          1HB       ASN  36   2.112  -2.537 -13.934
  266   1HD2  ASN  36          1HD2      ASN  36  -0.654  -2.485 -16.020
  267   2HD2  ASN  36          2HD2      ASN  36  -0.132  -3.761 -17.063
  268    H    ARG  37           H        ARG  37   0.061  -5.540 -13.872
  269    HA   ARG  37           HA       ARG  37   0.945  -7.007 -11.665
  270   1HB   ARG  37          2HB       ARG  37  -0.357  -7.912 -13.592
  271   2HB   ARG  37          1HB       ARG  37   1.093  -7.810 -14.580
  272   1HG   ARG  37          2HG       ARG  37   2.203  -9.393 -13.050
  273   2HG   ARG  37          1HG       ARG  37   0.695  -9.534 -12.143
  274   1HD   ARG  37          2HD       ARG  37   1.161 -10.286 -15.024
  275   2HD   ARG  37          1HD       ARG  37   0.875 -11.383 -13.675
  276    HE   ARG  37           HE       ARG  37  -1.272  -9.542 -13.968
  277   1HH1  ARG  37          1HH1      ARG  37   0.093 -12.440 -15.370
  278   2HH1  ARG  37          2HH1      ARG  37  -1.423 -13.009 -15.995
  279   1HH2  ARG  37          1HH2      ARG  37  -3.255 -10.271 -14.798
  280   2HH2  ARG  37          2HH2      ARG  37  -3.339 -11.783 -15.656
  281    H    VAL  38           H        VAL  38   2.678  -5.598 -14.372
  282    HA   VAL  38           HA       VAL  38   5.165  -6.905 -13.806
  283    HB   VAL  38           HB       VAL  38   4.704  -4.389 -15.424
  284   1HG1  VAL  38          1HG1      VAL  38   6.997  -6.346 -15.433
  285   2HG1  VAL  38          2HG1      VAL  38   7.034  -4.709 -14.777
  286   3HG1  VAL  38          3HG1      VAL  38   6.816  -4.959 -16.508
  287   1HG2  VAL  38          1HG2      VAL  38   4.690  -5.874 -17.375
  288   2HG2  VAL  38          2HG2      VAL  38   3.363  -6.234 -16.272
  289   3HG2  VAL  38          3HG2      VAL  38   4.784  -7.272 -16.303
  290    H    THR  39           H        THR  39   3.795  -3.714 -13.094
  291    HA   THR  39           HA       THR  39   5.976  -2.556 -11.805
  292    HB   THR  39           HB       THR  39   3.094  -2.210 -10.956
  293    HG1  THR  39           1HG      THR  39   4.376  -0.695 -12.992
  294   1HG2  THR  39          1HG2      THR  39   4.760  -1.091  -9.552
  295   2HG2  THR  39          2HG2      THR  39   3.805   0.084 -10.457
  296   3HG2  THR  39          3HG2      THR  39   5.445  -0.312 -10.976
  297    H    LEU  40           H        LEU  40   3.419  -4.663 -10.565
  298    HA   LEU  40           HA       LEU  40   4.167  -4.702  -7.869
  299   1HB   LEU  40          2HB       LEU  40   2.039  -5.569  -8.663
  300   2HB   LEU  40          1HB       LEU  40   2.861  -6.827  -9.567
  301    HG   LEU  40           HG       LEU  40   3.688  -7.748  -7.391
  302   1HD1  LEU  40          1HD1      LEU  40   2.553  -7.046  -5.343
  303   2HD1  LEU  40          2HD1      LEU  40   1.753  -5.752  -6.233
  304   3HD1  LEU  40          3HD1      LEU  40   3.506  -5.738  -6.043
  305   1HD2  LEU  40          1HD2      LEU  40   1.766  -8.703  -8.539
  306   2HD2  LEU  40          2HD2      LEU  40   0.702  -7.553  -7.731
  307   3HD2  LEU  40          3HD2      LEU  40   1.556  -8.774  -6.789
  308    H    LYS  41           H        LYS  41   5.121  -6.804 -10.570
  309    HA   LYS  41           HA       LYS  41   6.723  -8.575  -9.105
  310   1HB   LYS  41          2HB       LYS  41   5.951  -8.861 -11.487
  311   2HB   LYS  41          1HB       LYS  41   7.200  -7.725 -11.962
  312   1HG   LYS  41          2HG       LYS  41   8.905  -9.205 -11.038
  313   2HG   LYS  41          1HG       LYS  41   7.653 -10.358 -10.579
  314   1HD   LYS  41          2HD       LYS  41   7.026 -10.585 -12.951
  315   2HD   LYS  41          1HD       LYS  41   8.327  -9.475 -13.385
  316   1HE   LYS  41          2HE       LYS  41   9.963 -11.014 -12.423
  317   2HE   LYS  41          1HE       LYS  41   8.667 -12.120 -11.980
  318   1HZ   LYS  41          1HZ       LYS  41   9.708 -12.849 -13.999
  319   2HZ   LYS  41          2HZ       LYS  41   9.461 -11.341 -14.731
  320   3HZ   LYS  41          3HZ       LYS  41   8.132 -12.327 -14.356
  321    H    ASN  42           H        ASN  42   7.487  -5.558 -10.751
  322    HA   ASN  42           HA       ASN  42  10.246  -5.506 -10.372
  323   1HB   ASN  42          2HB       ASN  42   8.227  -3.270 -10.537
  324   2HB   ASN  42          1HB       ASN  42   9.957  -2.970 -10.434
  325   1HD2  ASN  42          1HD2      ASN  42   8.146  -2.298 -12.575
  326   2HD2  ASN  42          2HD2      ASN  42   8.729  -3.103 -13.989
  327    H    TRP  43           H        TRP  43   7.659  -4.496  -8.177
  328    HA   TRP  43           HA       TRP  43   9.345  -3.473  -6.144
  329   1HB   TRP  43          2HB       TRP  43   6.541  -4.604  -6.043
  330   2HB   TRP  43          1HB       TRP  43   7.344  -3.890  -4.649
  331    HD1  TRP  43           HD       TRP  43   8.357  -1.879  -7.522
  332    HE1  TRP  43           1HE      TRP  43   6.925   0.249  -7.724
  333    HE3  TRP  43           3HE      TRP  43   4.566  -3.154  -4.339
  334    HZ2  TRP  43           2HZ      TRP  43   4.502   1.256  -6.663
  335    HZ3  TRP  43           3HZ      TRP  43   2.731  -1.557  -3.988
  336    HH2  TRP  43           HH       TRP  43   2.700   0.602  -5.128
  337    H    ILE  44           H        ILE  44   8.005  -6.655  -6.799
  338    HA   ILE  44           HA       ILE  44   8.887  -7.947  -4.459
  339    HB   ILE  44           HB       ILE  44   8.390  -9.136  -7.197
  340   1HG1  ILE  44          2HG1      ILE  44   6.536  -8.939  -4.812
  341   2HG1  ILE  44          1HG1      ILE  44   6.471  -7.876  -6.215
  342   1HG2  ILE  44          1HG2      ILE  44   8.511 -10.450  -4.482
  343   2HG2  ILE  44          2HG2      ILE  44   9.682 -10.640  -5.785
  344   3HG2  ILE  44          3HG2      ILE  44   8.038 -11.245  -5.983
  345   1HD1  ILE  44          1HD1      ILE  44   6.052 -10.852  -6.239
  346   2HD1  ILE  44          2HD1      ILE  44   5.977  -9.784  -7.640
  347   3HD1  ILE  44          3HD1      ILE  44   4.792  -9.623  -6.345
  348    H    ILE  45           H        ILE  45  10.401  -7.451  -7.611
  349    HA   ILE  45           HA       ILE  45  12.658  -9.075  -7.229
  350    HB   ILE  45           HB       ILE  45  12.395  -6.542  -8.865
  351   1HG1  ILE  45          2HG1      ILE  45  12.227  -9.455  -9.670
  352   2HG1  ILE  45          1HG1      ILE  45  10.849  -8.377  -9.485
  353   1HG2  ILE  45          1HG2      ILE  45  14.741  -7.018  -8.414
  354   2HG2  ILE  45          2HG2      ILE  45  14.361  -7.347 -10.104
  355   3HG2  ILE  45          3HG2      ILE  45  14.528  -8.681  -8.961
  356   1HD1  ILE  45          1HD1      ILE  45  13.073  -8.056 -11.480
  357   2HD1  ILE  45          2HD1      ILE  45  11.678  -6.993 -11.309
  358   3HD1  ILE  45          3HD1      ILE  45  11.458  -8.667 -11.818
  359    H    LYS  46           H        LYS  46  12.135  -5.640  -6.520
  360    HA   LYS  46           HA       LYS  46  14.791  -5.138  -5.677
  361   1HB   LYS  46          2HB       LYS  46  13.279  -3.365  -6.460
  362   2HB   LYS  46          1HB       LYS  46  12.259  -3.609  -5.049
  363   1HG   LYS  46          2HG       LYS  46  14.009  -2.850  -3.588
  364   2HG   LYS  46          1HG       LYS  46  15.139  -2.744  -4.938
  365   1HD   LYS  46          2HD       LYS  46  13.699  -1.019  -5.968
  366   2HD   LYS  46          1HD       LYS  46  12.637  -1.094  -4.561
  367   1HE   LYS  46          2HE       LYS  46  14.468  -0.377  -3.123
  368   2HE   LYS  46          1HE       LYS  46  15.564  -0.355  -4.503
  369   1HZ   LYS  46          1HZ       LYS  46  13.154   1.365  -4.193
  370   2HZ   LYS  46          2HZ       LYS  46  14.238   1.402  -5.490
  371   3HZ   LYS  46          3HZ       LYS  46  14.756   1.863  -3.943
  372    H    TYR  47           H        TYR  47  11.787  -5.568  -3.772
  373    HA   TYR  47           HA       TYR  47  13.359  -5.442  -1.335
  374   1HB   TYR  47          2HB       TYR  47  10.388  -5.585  -1.838
  375   2HB   TYR  47          1HB       TYR  47  11.091  -5.622  -0.223
  376    HD1  TYR  47           1HD      TYR  47  11.775  -3.625   0.846
  377    HD2  TYR  47           2HD      TYR  47  10.800  -3.575  -3.296
  378    HE1  TYR  47           1HE      TYR  47  11.892  -1.165   0.852
  379    HE2  TYR  47           2HE      TYR  47  10.914  -1.123  -3.299
  380    HH   TYR  47           HH       TYR  47  12.193   0.674  -0.644
  381    H    GLY  48           H        GLY  48  12.006  -7.881  -3.343
  382   1HA   GLY  48          2HA       GLY  48  11.819  -9.922  -1.350
  383   2HA   GLY  48          1HA       GLY  48  11.834 -10.164  -3.093
  384    H    SER  49           H        SER  49  14.384  -8.725  -3.416
  385    HA   SER  49           HA       SER  49  16.137 -10.944  -2.895
  386   1HB   SER  49          2HB       SER  49  16.818  -8.210  -4.019
  387   2HB   SER  49          1HB       SER  49  17.800  -9.666  -4.132
  388    HG   SER  49           HG       SER  49  15.398  -9.017  -5.464
  389    H    ASN  50           H        ASN  50  16.283  -7.493  -2.055
  390    HA   ASN  50           HA       ASN  50  16.507  -7.548   0.630
  391   1HB   ASN  50          2HB       ASN  50  18.486  -9.050   0.363
  392   2HB   ASN  50          1HB       ASN  50  19.314  -7.752  -0.492
  393   1HD2  ASN  50          1HD2      ASN  50  20.928  -7.420   0.956
  394   2HD2  ASN  50          2HD2      ASN  50  20.674  -6.812   2.565
  395    H    HIS  51           H        HIS  51  18.893  -6.306  -1.688
  396    HA   HIS  51           HA       HIS  51  17.790  -3.624  -1.437
  397   1HB   HIS  51          2HB       HIS  51  20.110  -4.486   0.007
  398   2HB   HIS  51          1HB       HIS  51  20.579  -3.273  -1.174
  399    HD1  HIS  51           1HD      HIS  51  20.958  -1.342   0.406
  400    HD2  HIS  51           2HD      HIS  51  17.212  -3.100   0.855
  401    HE1  HIS  51           1HE      HIS  51  19.665   0.181   1.943
  402    HE2  HIS  51           2HE      HIS  51  17.363  -0.836   2.099
  403    H    ASN  52           H        ASN  52  17.641  -2.867  -3.364
  404    HA   ASN  52           HA       ASN  52  19.800  -2.915  -5.260
  405   1HB   ASN  52          2HB       ASN  52  18.668  -5.131  -5.644
  406   2HB   ASN  52          1HB       ASN  52  17.188  -4.258  -6.022
  407   1HD2  ASN  52          1HD2      ASN  52  20.329  -5.169  -7.106
  408   2HD2  ASN  52          2HD2      ASN  52  20.157  -4.621  -8.733
  409    H    VAL  53           H        VAL  53  19.754  -0.753  -5.561
  410    HA   VAL  53           HA       VAL  53  17.389   0.766  -5.182
  411    HB   VAL  53           HB       VAL  53  19.925   1.694  -6.538
  412   1HG1  VAL  53          1HG1      VAL  53  17.770   3.180  -5.050
  413   2HG1  VAL  53          2HG1      VAL  53  18.080   3.237  -6.786
  414   3HG1  VAL  53          3HG1      VAL  53  19.264   3.895  -5.655
  415   1HG2  VAL  53          1HG2      VAL  53  20.669   2.416  -4.312
  416   2HG2  VAL  53          2HG2      VAL  53  20.479   0.666  -4.399
  417   3HG2  VAL  53          3HG2      VAL  53  19.254   1.646  -3.596
  418    H    GLN  54           H        GLN  54  19.390   0.721  -8.122
  419    HA   GLN  54           HA       GLN  54  17.154  -0.019  -9.790
  420   1HB   GLN  54          2HB       GLN  54  18.395   2.731  -9.909
  421   2HB   GLN  54          1HB       GLN  54  17.589   2.013 -11.294
  422   1HG   GLN  54          2HG       GLN  54  15.505   2.116 -10.297
  423   2HG   GLN  54          1HG       GLN  54  16.176   2.255  -8.671
  424   1HE2  GLN  54          1HE2      GLN  54  18.158   4.218  -9.547
  425   2HE2  GLN  54          2HE2      GLN  54  17.296   5.704  -9.725
  426    H    GLY  55           H        GLY  55  18.063  -1.506 -11.104
  427   1HA   GLY  55          2HA       GLY  55  19.370  -1.825 -13.091
  428   2HA   GLY  55          1HA       GLY  55  20.582  -0.749 -12.412
  429    H    THR  56           H        THR  56  20.795  -3.461 -13.479
  430    HA   THR  56           HA       THR  56  22.528  -4.492 -11.436
  431    HB   THR  56           HB       THR  56  20.620  -6.457 -12.578
  432    HG1  THR  56           1HG      THR  56  19.991  -4.544 -10.754
  433   1HG2  THR  56          1HG2      THR  56  22.640  -7.300 -11.535
  434   2HG2  THR  56          2HG2      THR  56  21.235  -7.732 -10.563
  435   3HG2  THR  56          3HG2      THR  56  22.270  -6.397 -10.060
  436    H    THR  57           H        THR  57  24.274  -4.575 -12.625
  437    HA   THR  57           HA       THR  57  24.202  -6.066 -15.138
  438    HB   THR  57           HB       THR  57  23.996  -3.721 -15.776
  439    HG1  THR  57           1HG      THR  57  25.102  -4.725 -17.320
  440   1HG2  THR  57          1HG2      THR  57  26.629  -3.306 -14.360
  441   2HG2  THR  57          2HG2      THR  57  25.066  -2.663 -13.859
  442   3HG2  THR  57          3HG2      THR  57  25.801  -2.116 -15.366
  443    HA   PRO  58           HA       PRO  58  28.033  -7.482 -13.297
  444   1HB   PRO  58          2HB       PRO  58  27.890  -9.966 -14.350
  445   2HB   PRO  58          1HB       PRO  58  26.907  -9.459 -12.974
  446   1HG   PRO  58          2HG       PRO  58  26.085 -10.039 -15.722
  447   2HG   PRO  58          1HG       PRO  58  25.088  -9.874 -14.268
  448   1HD   PRO  58          2HD       PRO  58  25.638  -7.910 -16.359
  449   2HD   PRO  58          1HD       PRO  58  24.429  -7.851 -15.060
  450    H    SER  59           H        SER  59  29.657  -6.360 -14.379
  451    HA   SER  59           HA       SER  59  30.189  -6.822 -17.171
  452   1HB   SER  59          2HB       SER  59  31.902  -5.381 -15.140
  453   2HB   SER  59          1HB       SER  59  32.003  -5.246 -16.896
  454    HG   SER  59           HG       SER  59  29.648  -4.570 -16.634
  455    H    ALA  60           H        ALA  60  31.849  -7.602 -14.112
  456    HA   ALA  60           HA       ALA  60  33.979  -8.972 -15.473
  457   1HB   ALA  60          1HB       ALA  60  33.304  -8.899 -12.534
  458   2HB   ALA  60          2HB       ALA  60  34.380  -7.785 -13.376
  459   3HB   ALA  60          3HB       ALA  60  34.809  -9.488 -13.237
  460    H    ALA  61           H        ALA  61  30.893  -9.848 -14.257
  461    HA   ALA  61           HA       ALA  61  31.481 -12.601 -13.771
  462   1HB   ALA  61          1HB       ALA  61  28.799 -11.286 -14.156
  463   2HB   ALA  61          2HB       ALA  61  29.654 -11.445 -12.624
  464   3HB   ALA  61          3HB       ALA  61  29.091 -12.886 -13.468
  465    H    VAL  62           H        VAL  62  31.260 -10.910 -16.583
  466    HA   VAL  62           HA       VAL  62  29.888 -12.794 -18.225
  467    HB   VAL  62           HB       VAL  62  31.879 -10.659 -19.016
  468   1HG1  VAL  62          1HG1      VAL  62  29.916 -12.192 -20.719
  469   2HG1  VAL  62          2HG1      VAL  62  31.669 -12.386 -20.729
  470   3HG1  VAL  62          3HG1      VAL  62  30.944 -10.868 -21.267
  471   1HG2  VAL  62          1HG2      VAL  62  29.920  -9.731 -17.906
  472   2HG2  VAL  62          2HG2      VAL  62  28.863 -10.618 -19.002
  473   3HG2  VAL  62          3HG2      VAL  62  29.904  -9.338 -19.625
  474    H    SER  63           H        SER  63  33.317 -12.040 -17.749
  475    HA   SER  63           HA       SER  63  34.183 -14.356 -19.207
  476   1HB   SER  63          2HB       SER  63  35.743 -12.524 -17.367
  477   2HB   SER  63          1HB       SER  63  36.437 -13.708 -18.477
  478    HG   SER  63           HG       SER  63  34.803 -11.498 -19.213
  479    H    GLU  64           H        GLU  64  33.561 -13.546 -15.872
  480    HA   GLU  64           HA       GLU  64  34.830 -15.790 -14.707
  481   1HB   GLU  64          2HB       GLU  64  34.047 -13.624 -13.571
  482   2HB   GLU  64          1HB       GLU  64  32.454 -14.365 -13.534
  483   1HG   GLU  64          2HG       GLU  64  33.443 -14.752 -11.428
  484   2HG   GLU  64          1HG       GLU  64  33.479 -16.285 -12.299
  485    H    ALA  65           H        ALA  65  31.805 -15.327 -16.281
  486    HA   ALA  65           HA       ALA  65  30.288 -17.418 -15.212
  487   1HB   ALA  65          1HB       ALA  65  30.212 -16.350 -18.028
  488   2HB   ALA  65          2HB       ALA  65  29.357 -15.663 -16.648
  489   3HB   ALA  65          3HB       ALA  65  28.942 -17.276 -17.228
  490    H    GLU  66           H        GLU  66  32.911 -17.461 -17.482
  491    HA   GLU  66           HA       GLU  66  32.618 -19.965 -18.660
  492   1HB   GLU  66          2HB       GLU  66  34.774 -18.043 -18.039
  493   2HB   GLU  66          1HB       GLU  66  35.296 -19.682 -18.330
  494   1HG   GLU  66          2HG       GLU  66  33.726 -17.919 -20.195
  495   2HG   GLU  66          1HG       GLU  66  35.412 -18.403 -20.366
  496    H    GLN  67           H        GLN  67  34.299 -18.937 -15.777
  497    HA   GLN  67           HA       GLN  67  35.134 -21.580 -15.040
  498   1HB   GLN  67          2HB       GLN  67  36.475 -19.509 -14.812
  499   2HB   GLN  67          1HB       GLN  67  35.340 -18.940 -13.604
  500   1HG   GLN  67          2HG       GLN  67  36.057 -20.489 -12.030
  501   2HG   GLN  67          1HG       GLN  67  36.816 -21.512 -13.259
  502   1HE2  GLN  67          1HE2      GLN  67  36.976 -18.359 -11.738
  503   2HE2  GLN  67          2HE2      GLN  67  38.659 -18.110 -12.009
  504    H    ILE  68           H        ILE  68  32.675 -19.275 -14.044
  505    HA   ILE  68           HA       ILE  68  31.797 -20.641 -11.740
  506    HB   ILE  68           HB       ILE  68  30.255 -18.880 -13.661
  507   1HG1  ILE  68          2HG1      ILE  68  31.437 -18.307 -10.932
  508   2HG1  ILE  68          1HG1      ILE  68  32.110 -17.777 -12.469
  509   1HG2  ILE  68          1HG2      ILE  68  29.417 -19.842 -10.934
  510   2HG2  ILE  68          2HG2      ILE  68  28.711 -20.342 -12.469
  511   3HG2  ILE  68          3HG2      ILE  68  28.549 -18.671 -11.926
  512   1HD1  ILE  68          1HD1      ILE  68  30.935 -15.970 -11.380
  513   2HD1  ILE  68          2HD1      ILE  68  29.465 -16.939 -11.303
  514   3HD1  ILE  68          3HD1      ILE  68  30.101 -16.428 -12.864
  515    H    ARG  69           H        ARG  69  30.922 -20.935 -15.162
  516    HA   ARG  69           HA       ARG  69  28.939 -22.892 -14.920
  517   1HB   ARG  69          2HB       ARG  69  29.493 -21.682 -17.018
  518   2HB   ARG  69          1HB       ARG  69  30.976 -22.620 -17.137
  519   1HG   ARG  69          2HG       ARG  69  29.509 -24.682 -17.138
  520   2HG   ARG  69          1HG       ARG  69  28.143 -23.589 -17.365
  521   1HD   ARG  69          2HD       ARG  69  28.767 -24.318 -19.522
  522   2HD   ARG  69          1HD       ARG  69  29.373 -22.669 -19.368
  523    HE   ARG  69           HE       ARG  69  31.062 -25.075 -19.088
  524   1HH1  ARG  69          1HH1      ARG  69  30.599 -21.751 -20.061
  525   2HH1  ARG  69          2HH1      ARG  69  32.188 -21.590 -20.752
  526   1HH2  ARG  69          1HH2      ARG  69  33.142 -24.902 -20.027
  527   2HH2  ARG  69          2HH2      ARG  69  33.629 -23.402 -20.752
  528    H    GLN  70           H        GLN  70  32.440 -23.162 -15.199
  529    HA   GLN  70           HA       GLN  70  32.711 -25.922 -15.388
  530   1HB   GLN  70          2HB       GLN  70  34.448 -24.084 -15.680
  531   2HB   GLN  70          1HB       GLN  70  34.589 -24.071 -13.936
  532   1HG   GLN  70          2HG       GLN  70  34.912 -26.671 -15.305
  533   2HG   GLN  70          1HG       GLN  70  36.199 -25.479 -15.483
  534   1HE2  GLN  70          1HE2      GLN  70  37.391 -24.856 -13.660
  535   2HE2  GLN  70          2HE2      GLN  70  37.363 -25.785 -12.195
  536    H    LEU  71           H        LEU  71  32.762 -23.826 -12.548
  537    HA   LEU  71           HA       LEU  71  33.058 -25.876 -10.629
  538   1HB   LEU  71          2HB       LEU  71  33.558 -23.524 -10.172
  539   2HB   LEU  71          1HB       LEU  71  31.861 -23.119 -10.341
  540    HG   LEU  71           HG       LEU  71  31.363 -24.556  -8.376
  541   1HD1  LEU  71          1HD1      LEU  71  34.362 -24.700  -8.118
  542   2HD1  LEU  71          2HD1      LEU  71  33.294 -26.043  -8.522
  543   3HD1  LEU  71          3HD1      LEU  71  33.189 -25.281  -6.935
  544   1HD2  LEU  71          1HD2      LEU  71  32.253 -23.004  -6.708
  545   2HD2  LEU  71          2HD2      LEU  71  31.628 -22.151  -8.118
  546   3HD2  LEU  71          3HD2      LEU  71  33.366 -22.354  -7.909
  547    H    LYS  72           H        LYS  72  30.214 -24.330 -12.045
  548    HA   LYS  72           HA       LYS  72  28.349 -25.562 -10.285
  549   1HB   LYS  72          2HB       LYS  72  27.889 -23.472 -11.537
  550   2HB   LYS  72          1HB       LYS  72  27.860 -24.399 -13.030
  551   1HG   LYS  72          2HG       LYS  72  25.940 -25.653 -12.244
  552   2HG   LYS  72          1HG       LYS  72  25.993 -24.800 -10.701
  553   1HD   LYS  72          2HD       LYS  72  25.641 -22.671 -11.943
  554   2HD   LYS  72          1HD       LYS  72  25.428 -23.618 -13.417
  555   1HE   LYS  72          2HE       LYS  72  23.516 -24.755 -12.442
  556   2HE   LYS  72          1HE       LYS  72  23.751 -23.895 -10.921
  557   1HZ   LYS  72          1HZ       LYS  72  22.024 -22.827 -12.137
  558   2HZ   LYS  72          2HZ       LYS  72  22.974 -22.719 -13.537
  559   3HZ   LYS  72          3HZ       LYS  72  23.372 -21.799 -12.165
  560    H    LYS  73           H        LYS  73  29.113 -26.180 -13.697
  561    HA   LYS  73           HA       LYS  73  28.251 -28.963 -13.307
  562   1HB   LYS  73          2HB       LYS  73  26.499 -27.677 -14.520
  563   2HB   LYS  73          1HB       LYS  73  27.683 -27.269 -15.754
  564   1HG   LYS  73          2HG       LYS  73  27.926 -29.613 -16.326
  565   2HG   LYS  73          1HG       LYS  73  26.795 -30.057 -15.049
  566   1HD   LYS  73          2HD       LYS  73  26.154 -28.339 -17.444
  567   2HD   LYS  73          1HD       LYS  73  25.728 -30.041 -17.258
  568   1HE   LYS  73          2HE       LYS  73  24.785 -27.768 -15.512
  569   2HE   LYS  73          1HE       LYS  73  23.833 -28.593 -16.744
  570   1HZ   LYS  73          1HZ       LYS  73  24.923 -29.813 -14.258
  571   2HZ   LYS  73          2HZ       LYS  73  24.077 -30.655 -15.464
  572   3HZ   LYS  73          3HZ       LYS  73  23.294 -29.443 -14.567
  573    H    GLU  74           H        GLU  74  29.647 -30.439 -14.068
  574    HA   GLU  74           HA       GLU  74  32.279 -29.675 -14.491
  575   1HB   GLU  74          2HB       GLU  74  30.859 -32.279 -14.990
  576   2HB   GLU  74          1HB       GLU  74  32.603 -32.090 -15.167
  577   1HG   GLU  74          2HG       GLU  74  32.882 -31.568 -12.881
  578   2HG   GLU  74          1HG       GLU  74  31.149 -31.348 -12.648
  579    H    ASN  75           H        ASN  75  33.417 -29.060 -16.098
  580    HA   ASN  75           HA       ASN  75  32.236 -28.111 -18.445
  581   1HB   ASN  75          2HB       ASN  75  34.319 -27.271 -17.283
  582   2HB   ASN  75          1HB       ASN  75  35.181 -28.608 -18.027
  583   1HD2  ASN  75          1HD2      ASN  75  36.515 -27.337 -19.236
  584   2HD2  ASN  75          2HD2      ASN  75  35.958 -26.393 -20.580
  585    H    ALA  76           H        ALA  76  33.774 -31.120 -17.738
  586    HA   ALA  76           HA       ALA  76  34.569 -31.999 -20.239
  587   1HB   ALA  76          1HB       ALA  76  33.398 -33.672 -18.027
  588   2HB   ALA  76          2HB       ALA  76  35.084 -33.178 -18.161
  589   3HB   ALA  76          3HB       ALA  76  34.383 -34.261 -19.364
  590    H    LEU  77           H        LEU  77  31.357 -31.673 -18.980
  591    HA   LEU  77           HA       LEU  77  30.072 -33.485 -20.753
  592   1HB   LEU  77          2HB       LEU  77  29.014 -31.150 -19.166
  593   2HB   LEU  77          1HB       LEU  77  28.014 -32.308 -20.014
  594    HG   LEU  77           HG       LEU  77  29.864 -32.956 -17.721
  595   1HD1  LEU  77          1HD1      LEU  77  27.805 -33.314 -16.451
  596   2HD1  LEU  77          2HD1      LEU  77  26.858 -32.760 -17.833
  597   3HD1  LEU  77          3HD1      LEU  77  27.947 -31.646 -17.006
  598   1HD2  LEU  77          1HD2      LEU  77  27.875 -34.670 -19.206
  599   2HD2  LEU  77          2HD2      LEU  77  28.771 -35.146 -17.763
  600   3HD2  LEU  77          3HD2      LEU  77  29.632 -34.817 -19.266
  601    H    GLN  78           H        GLN  78  31.072 -30.148 -21.003
  602    HA   GLN  78           HA       GLN  78  29.361 -29.600 -23.268
  603   1HB   GLN  78          2HB       GLN  78  31.515 -28.017 -21.889
  604   2HB   GLN  78          1HB       GLN  78  30.776 -27.469 -23.387
  605   1HG   GLN  78          2HG       GLN  78  29.391 -27.965 -20.761
  606   2HG   GLN  78          1HG       GLN  78  29.705 -26.404 -21.519
  607   1HE2  GLN  78          1HE2      GLN  78  27.167 -27.462 -20.706
  608   2HE2  GLN  78          2HE2      GLN  78  26.185 -27.600 -22.130
  609    H    ARG  79           H        ARG  79  32.541 -30.822 -22.745
  610    HA   ARG  79           HA       ARG  79  33.634 -30.095 -25.264
  611   1HB   ARG  79          2HB       ARG  79  34.462 -32.038 -23.137
  612   2HB   ARG  79          1HB       ARG  79  35.293 -31.997 -24.688
  613   1HG   ARG  79          2HG       ARG  79  35.691 -29.562 -24.328
  614   2HG   ARG  79          1HG       ARG  79  35.026 -29.753 -22.708
  615   1HD   ARG  79          2HD       ARG  79  36.800 -31.142 -22.030
  616   2HD   ARG  79          1HD       ARG  79  37.321 -31.421 -23.693
  617    HE   ARG  79           HE       ARG  79  37.579 -28.735 -23.387
  618   1HH1  ARG  79          1HH1      ARG  79  38.757 -31.452 -21.506
  619   2HH1  ARG  79          2HH1      ARG  79  40.239 -30.658 -21.059
  620   1HH2  ARG  79          1HH2      ARG  79  39.528 -27.703 -22.828
  621   2HH2  ARG  79          2HH2      ARG  79  40.681 -28.532 -21.822
  622    H    ALA  80           H        ALA  80  31.374 -32.426 -24.387
  623    HA   ALA  80           HA       ALA  80  31.858 -34.430 -26.312
  624   1HB   ALA  80          1HB       ALA  80  29.243 -33.550 -25.091
  625   2HB   ALA  80          2HB       ALA  80  30.333 -34.775 -24.445
  626   3HB   ALA  80          3HB       ALA  80  29.508 -35.048 -25.979
  627    H    ARG  81           H        ARG  81  30.724 -31.220 -26.589
  628    HA   ARG  81           HA       ARG  81  29.121 -31.460 -28.921
  629   1HB   ARG  81          2HB       ARG  81  30.531 -29.125 -27.657
  630   2HB   ARG  81          1HB       ARG  81  29.541 -28.974 -29.095
  631   1HG   ARG  81          2HG       ARG  81  27.632 -29.899 -27.794
  632   2HG   ARG  81          1HG       ARG  81  28.655 -29.845 -26.356
  633   1HD   ARG  81          2HD       ARG  81  28.957 -27.421 -26.708
  634   2HD   ARG  81          1HD       ARG  81  27.851 -27.504 -28.077
  635    HE   ARG  81           HE       ARG  81  27.095 -28.036 -25.272
  636   1HH1  ARG  81          1HH1      ARG  81  26.321 -26.972 -28.522
  637   2HH1  ARG  81          2HH1      ARG  81  24.723 -26.422 -28.103
  638   1HH2  ARG  81          1HH2      ARG  81  24.997 -27.325 -24.707
  639   2HH2  ARG  81          2HH2      ARG  81  23.977 -26.607 -25.922
  640    H    THR  82           H        THR  82  32.470 -31.507 -28.447
  641    HA   THR  82           HA       THR  82  33.505 -30.391 -30.761
  642    HB   THR  82           HB       THR  82  34.547 -32.912 -29.463
  643    HG1  THR  82           1HG      THR  82  34.671 -31.638 -27.758
  644   1HG2  THR  82          1HG2      THR  82  35.640 -32.324 -31.568
  645   2HG2  THR  82          2HG2      THR  82  36.731 -32.079 -30.203
  646   3HG2  THR  82          3HG2      THR  82  35.944 -30.695 -30.964
  647    H    ARG  83           H        ARG  83  32.042 -33.496 -30.229
  648    HA   ARG  83           HA       ARG  83  31.206 -35.105 -31.535
  649   1HB   ARG  83          2HB       ARG  83  30.025 -33.105 -32.416
  650   2HB   ARG  83          1HB       ARG  83  31.208 -33.036 -33.708
  651   1HG   ARG  83          2HG       ARG  83  30.526 -35.248 -34.442
  652   2HG   ARG  83          1HG       ARG  83  29.335 -35.316 -33.144
  653   1HD   ARG  83          2HD       ARG  83  28.290 -33.256 -34.089
  654   2HD   ARG  83          1HD       ARG  83  29.388 -33.384 -35.461
  655    HE   ARG  83           HE       ARG  83  28.272 -35.733 -35.634
  656   1HH1  ARG  83          1HH1      ARG  83  26.707 -32.727 -34.731
  657   2HH1  ARG  83          2HH1      ARG  83  25.176 -33.167 -35.423
  658   1HH2  ARG  83          1HH2      ARG  83  26.242 -36.334 -36.530
  659   2HH2  ARG  83          2HH2      ARG  83  24.900 -35.226 -36.415
  660    H    HIS  84           H        HIS  84  32.384 -36.733 -32.008
  661    HA   HIS  84           HA       HIS  84  34.600 -36.435 -33.938
  662   1HB   HIS  84          2HB       HIS  84  35.467 -36.678 -31.653
  663   2HB   HIS  84          1HB       HIS  84  34.532 -38.153 -31.443
  664    HD1  HIS  84           1HD      HIS  84  35.651 -40.294 -32.083
  665    HD2  HIS  84           2HD      HIS  84  37.593 -36.956 -33.636
  666    HE1  HIS  84           1HE      HIS  84  37.786 -41.158 -33.098
  667    HE2  HIS  84           2HE      HIS  84  39.016 -39.105 -33.898
  668    HA   PRO  85           HA       PRO  85  32.183 -39.853 -35.679
  669   1HB   PRO  85          2HB       PRO  85  32.456 -39.175 -38.239
  670   2HB   PRO  85          1HB       PRO  85  31.352 -38.286 -37.181
  671   1HG   PRO  85          2HG       PRO  85  34.077 -37.530 -38.149
  672   2HG   PRO  85          1HG       PRO  85  32.647 -36.508 -37.909
  673   1HD   PRO  85          2HD       PRO  85  34.788 -36.782 -36.131
  674   2HD   PRO  85          1HD       PRO  85  33.194 -36.109 -35.737
  675    H    ALA  86           H        ALA  86  32.920 -41.170 -37.841
  676    HA   ALA  86           HA       ALA  86  35.808 -41.678 -37.596
  677   1HB   ALA  86          1HB       ALA  86  35.390 -44.051 -37.936
  678   2HB   ALA  86          2HB       ALA  86  33.653 -43.749 -38.024
  679   3HB   ALA  86          3HB       ALA  86  34.523 -43.468 -36.515
  680    H    GLU  87           H        GLU  87  36.892 -42.232 -39.494
  681    HA   GLU  87           HA       GLU  87  36.059 -40.993 -41.855
  682   1HB   GLU  87          2HB       GLU  87  37.921 -42.230 -42.947
  683   2HB   GLU  87          1HB       GLU  87  38.404 -41.432 -41.456
  684   1HG   GLU  87          2HG       GLU  87  38.381 -43.509 -40.268
  685   2HG   GLU  87          1HG       GLU  87  37.688 -44.347 -41.655
  686    H    SER  88           H        SER  88  35.592 -44.254 -40.714
  687    HA   SER  88           HA       SER  88  34.770 -45.512 -43.071
  688   1HB   SER  88          2HB       SER  88  33.685 -46.066 -40.300
  689   2HB   SER  88          1HB       SER  88  33.865 -47.206 -41.635
  690    HG   SER  88           HG       SER  88  35.820 -47.556 -40.995
  691    H    CYS  89           H        CYS  89  32.999 -43.553 -40.735
  692    HA   CYS  89           HA       CYS  89  30.427 -44.161 -41.857
  693   1HB   CYS  89          2HB       CYS  89  30.719 -43.682 -39.444
  694   2HB   CYS  89          1HB       CYS  89  31.205 -42.038 -39.842
  695    HG   CYS  89           HG       CYS  89  28.542 -41.897 -41.289
  696    H    LEU  90           H        LEU  90  32.885 -41.847 -42.409
  697    HA   LEU  90           HA       LEU  90  31.409 -39.635 -43.273
  698   1HB   LEU  90          2HB       LEU  90  33.804 -39.571 -42.762
  699   2HB   LEU  90          1HB       LEU  90  34.139 -40.561 -44.170
  700    HG   LEU  90           HG       LEU  90  33.284 -38.751 -45.621
  701   1HD1  LEU  90          1HD1      LEU  90  33.151 -37.150 -43.072
  702   2HD1  LEU  90          2HD1      LEU  90  31.759 -37.725 -43.991
  703   3HD1  LEU  90          3HD1      LEU  90  32.866 -36.549 -44.707
  704   1HD2  LEU  90          1HD2      LEU  90  35.669 -38.938 -45.134
  705   2HD2  LEU  90          2HD2      LEU  90  35.461 -37.909 -43.716
  706   3HD2  LEU  90          3HD2      LEU  90  35.182 -37.254 -45.330
  707    H    GLU  91           H        GLU  91  32.540 -42.472 -45.053
  708    HA   GLU  91           HA       GLU  91  31.843 -41.553 -47.629
  709   1HB   GLU  91          2HB       GLU  91  32.757 -44.041 -46.439
  710   2HB   GLU  91          1HB       GLU  91  31.592 -44.317 -47.726
  711   1HG   GLU  91          2HG       GLU  91  33.829 -44.355 -48.609
  712   2HG   GLU  91          1HG       GLU  91  32.956 -42.958 -49.236
  713    H    HIS  92           H        HIS  92  30.041 -43.369 -45.201
  714    HA   HIS  92           HA       HIS  92  27.845 -43.901 -46.973
  715   1HB   HIS  92          2HB       HIS  92  28.519 -45.368 -45.024
  716   2HB   HIS  92          1HB       HIS  92  27.851 -44.134 -43.962
  717    HD1  HIS  92           1HD      HIS  92  25.242 -43.845 -43.968
  718    HD2  HIS  92           2HD      HIS  92  26.671 -46.970 -46.315
  719    HE1  HIS  92           1HE      HIS  92  23.236 -45.270 -44.502
  720    HE2  HIS  92           2HE      HIS  92  24.095 -47.006 -46.118
  721    H    HIS  93           H        HIS  93  26.692 -42.204 -47.658
  722    HA   HIS  93           HA       HIS  93  25.724 -40.315 -45.614
  723   1HB   HIS  93          2HB       HIS  93  27.371 -39.237 -47.087
  724   2HB   HIS  93          1HB       HIS  93  26.420 -39.696 -48.494
  725    HD1  HIS  93           1HD      HIS  93  25.025 -37.857 -49.359
  726    HD2  HIS  93           2HD      HIS  93  25.668 -37.514 -45.262
  727    HE1  HIS  93           1HE      HIS  93  23.855 -35.738 -48.661
  728    HE2  HIS  93           2HE      HIS  93  24.169 -35.601 -46.158
  729    H    HIS  94           H        HIS  94  23.778 -41.223 -45.258
  730    HA   HIS  94           HA       HIS  94  22.042 -42.284 -47.185
  731   1HB   HIS  94          2HB       HIS  94  21.781 -42.763 -44.810
  732   2HB   HIS  94          1HB       HIS  94  21.422 -41.073 -44.479
  733    HD1  HIS  94           1HD      HIS  94  19.015 -40.658 -44.163
  734    HD2  HIS  94           2HD      HIS  94  19.700 -43.813 -46.789
  735    HE1  HIS  94           1HE      HIS  94  16.737 -41.493 -44.840
  736    HE2  HIS  94           2HE      HIS  94  17.174 -43.464 -46.351
  737    H    HIS  95           H        HIS  95  20.810 -41.378 -48.675
  738    HA   HIS  95           HA       HIS  95  19.712 -38.723 -48.262
  739   1HB   HIS  95          2HB       HIS  95  20.522 -37.832 -50.396
  740   2HB   HIS  95          1HB       HIS  95  21.868 -38.238 -49.343
  741    HD1  HIS  95           1HD      HIS  95  21.326 -38.219 -52.706
  742    HD2  HIS  95           2HD      HIS  95  22.445 -41.299 -50.144
  743    HE1  HIS  95           1HE      HIS  95  22.443 -39.940 -54.159
  744    HE2  HIS  95           2HE      HIS  95  23.304 -41.680 -52.558
  745    H    HIS  96           H        HIS  96  17.861 -38.321 -49.491
  746    HA   HIS  96           HA       HIS  96  16.965 -40.390 -51.329
  747   1HB   HIS  96          2HB       HIS  96  16.191 -41.227 -49.170
  748   2HB   HIS  96          1HB       HIS  96  15.431 -39.682 -48.817
  749    HD1  HIS  96           1HD      HIS  96  15.165 -42.430 -51.433
  750    HD2  HIS  96           2HD      HIS  96  12.814 -39.589 -49.510
  751    HE1  HIS  96           1HE      HIS  96  12.815 -42.850 -52.222
  752    HE2  HIS  96           2HE      HIS  96  11.459 -40.963 -51.237
  753    H    HIS  97           H        HIS  97  16.228 -39.373 -53.048
  754    HA   HIS  97           HA       HIS  97  14.510 -37.038 -52.694
  755   1HB   HIS  97          2HB       HIS  97  16.772 -36.143 -53.094
  756   2HB   HIS  97          1HB       HIS  97  16.895 -37.104 -54.563
  757    HD1  HIS  97           1HD      HIS  97  16.493 -35.778 -56.588
  758    HD2  HIS  97           2HD      HIS  97  14.327 -34.318 -53.349
  759    HE1  HIS  97           1HE      HIS  97  15.240 -33.776 -57.456
  760    HE2  HIS  97           2HE      HIS  97  14.050 -32.825 -55.445
  Start of MODEL   12
    1   1H    MET   1          1HT       MET   1 -10.089  12.742  -3.117
    2   2H    MET   1          2HT       MET   1 -10.211  12.336  -1.475
    3   3H    MET   1          3HT       MET   1 -10.906  11.331  -2.654
    4    HA   MET   1           HA       MET   1  -8.850  10.399  -1.797
    5   1HB   MET   1          2HB       MET   1  -9.541   9.960  -4.130
    6   2HB   MET   1          1HB       MET   1  -8.655  11.384  -4.656
    7   1HG   MET   1          2HG       MET   1  -6.568  10.359  -3.899
    8   2HG   MET   1          1HG       MET   1  -7.461   8.925  -3.396
    9   1HE   MET   1          1HE       MET   1  -5.878   7.380  -4.818
   10   2HE   MET   1          2HE       MET   1  -4.947   8.783  -5.341
   11   3HE   MET   1          3HE       MET   1  -5.540   7.623  -6.531
   12    HA   PRO   2           HA       PRO   2  -6.039  13.716  -0.572
   13   1HB   PRO   2          2HB       PRO   2  -4.505  11.383   0.408
   14   2HB   PRO   2          1HB       PRO   2  -5.017  12.835   1.275
   15   1HG   PRO   2          2HG       PRO   2  -6.213  10.488   1.709
   16   2HG   PRO   2          1HG       PRO   2  -7.138  12.001   1.695
   17   1HD   PRO   2          2HD       PRO   2  -6.919   9.893  -0.417
   18   2HD   PRO   2          1HD       PRO   2  -8.336  10.829   0.099
   19    H    THR   3           H        THR   3  -4.509  10.665  -1.374
   20    HA   THR   3           HA       THR   3  -3.467  11.423  -3.866
   21    HB   THR   3           HB       THR   3  -2.039  12.921  -2.472
   22    HG1  THR   3           1HG      THR   3  -0.269  12.474  -3.648
   23   1HG2  THR   3          1HG2      THR   3  -1.032  10.336  -1.281
   24   2HG2  THR   3          2HG2      THR   3  -1.923  11.602  -0.436
   25   3HG2  THR   3          3HG2      THR   3  -0.298  11.921  -1.043
   26    H    LYS   4           H        LYS   4  -1.394   9.819  -4.234
   27    HA   LYS   4           HA       LYS   4  -2.031   7.246  -2.964
   28   1HB   LYS   4          2HB       LYS   4  -2.910   7.689  -5.425
   29   2HB   LYS   4          1HB       LYS   4  -1.252   7.306  -5.850
   30   1HG   LYS   4          2HG       LYS   4  -3.090   5.505  -4.285
   31   2HG   LYS   4          1HG       LYS   4  -2.774   5.379  -6.014
   32   1HD   LYS   4          2HD       LYS   4  -0.368   5.038  -5.492
   33   2HD   LYS   4          1HD       LYS   4  -0.779   5.028  -3.777
   34   1HE   LYS   4          2HE       LYS   4  -0.595   2.756  -4.565
   35   2HE   LYS   4          1HE       LYS   4  -2.280   3.104  -4.186
   36   1HZ   LYS   4          1HZ       LYS   4  -1.102   3.176  -6.914
   37   2HZ   LYS   4          2HZ       LYS   4  -2.734   3.405  -6.525
   38   3HZ   LYS   4          3HZ       LYS   4  -2.011   1.892  -6.287
   39    H    THR   5           H        THR   5  -0.237   7.450  -1.656
   40    HA   THR   5           HA       THR   5   2.371   7.853  -2.916
   41    HB   THR   5           HB       THR   5   2.048   7.398   0.017
   42    HG1  THR   5           1HG      THR   5   0.430   8.916  -0.431
   43   1HG2  THR   5          1HG2      THR   5   4.283   7.705  -0.909
   44   2HG2  THR   5          2HG2      THR   5   3.849   9.060   0.132
   45   3HG2  THR   5          3HG2      THR   5   3.786   9.240  -1.621
   46    H    TYR   6           H        TYR   6   4.093   6.407  -2.572
   47    HA   TYR   6           HA       TYR   6   3.401   3.729  -1.664
   48   1HB   TYR   6          2HB       TYR   6   4.572   2.735  -3.558
   49   2HB   TYR   6          1HB       TYR   6   3.240   3.726  -4.116
   50    HD1  TYR   6           1HD      TYR   6   6.608   2.907  -4.607
   51    HD2  TYR   6           2HD      TYR   6   3.933   6.213  -4.776
   52    HE1  TYR   6           1HE      TYR   6   8.164   4.079  -6.104
   53    HE2  TYR   6           2HE      TYR   6   5.483   7.392  -6.280
   54    HH   TYR   6           HH       TYR   6   7.871   7.389  -6.838
   55    H    SER   7           H        SER   7   4.596   3.612   0.121
   56    HA   SER   7           HA       SER   7   7.346   4.627   0.062
   57   1HB   SER   7          2HB       SER   7   5.734   3.766   2.475
   58   2HB   SER   7          1HB       SER   7   7.231   4.699   2.465
   59    HG   SER   7           HG       SER   7   4.874   5.695   2.529
   60    H    GLU   8           H        GLU   8   8.772   3.269   1.708
   61    HA   GLU   8           HA       GLU   8   9.309   0.748   0.710
   62   1HB   GLU   8          2HB       GLU   8  10.481   0.343   2.898
   63   2HB   GLU   8          1HB       GLU   8  10.926   1.846   2.098
   64   1HG   GLU   8          2HG       GLU   8   9.449   3.087   3.596
   65   2HG   GLU   8          1HG       GLU   8   8.982   1.581   4.385
   66    H    GLU   9           H        GLU   9   7.044   1.727   3.157
   67    HA   GLU   9           HA       GLU   9   6.318  -0.679   4.310
   68   1HB   GLU   9          2HB       GLU   9   5.519   1.391   5.192
   69   2HB   GLU   9          1HB       GLU   9   4.741   1.809   3.676
   70   1HG   GLU   9          2HG       GLU   9   3.143  -0.012   3.998
   71   2HG   GLU   9          1HG       GLU   9   3.921  -0.409   5.531
   72    H    PHE  10           H        PHE  10   4.867   0.910   1.470
   73    HA   PHE  10           HA       PHE  10   2.997  -1.156   0.985
   74   1HB   PHE  10          2HB       PHE  10   2.811   1.243   0.205
   75   2HB   PHE  10          1HB       PHE  10   4.009   0.861  -1.028
   76    HD1  PHE  10           1HD      PHE  10   0.721  -0.306   0.265
   77    HD2  PHE  10           2HD      PHE  10   3.292   0.135  -3.094
   78    HE1  PHE  10           1HE      PHE  10  -1.080  -1.093  -1.213
   79    HE2  PHE  10           2HE      PHE  10   1.497  -0.649  -4.576
   80    HZ   PHE  10           HZ       PHE  10  -0.691  -1.264  -3.638
   81    H    LYS  11           H        LYS  11   6.143  -0.384  -0.428
   82    HA   LYS  11           HA       LYS  11   6.226  -2.388  -2.378
   83   1HB   LYS  11          2HB       LYS  11   8.509  -1.194  -0.785
   84   2HB   LYS  11          1HB       LYS  11   8.685  -2.118  -2.269
   85   1HG   LYS  11          2HG       LYS  11   7.522  -0.410  -3.521
   86   2HG   LYS  11          1HG       LYS  11   7.200   0.492  -2.037
   87   1HD   LYS  11          2HD       LYS  11   9.574   0.849  -1.702
   88   2HD   LYS  11          1HD       LYS  11   9.946  -0.132  -3.121
   89   1HE   LYS  11          2HE       LYS  11   8.777   1.481  -4.538
   90   2HE   LYS  11          1HE       LYS  11   8.402   2.459  -3.120
   91   1HZ   LYS  11          1HZ       LYS  11  10.742   2.849  -2.773
   92   2HZ   LYS  11          2HZ       LYS  11  10.341   3.286  -4.363
   93   3HZ   LYS  11          3HZ       LYS  11  11.151   1.828  -4.065
   94    H    ARG  12           H        ARG  12   7.248  -2.425   1.008
   95    HA   ARG  12           HA       ARG  12   8.308  -5.045   1.033
   96   1HB   ARG  12          2HB       ARG  12   8.730  -3.231   2.714
   97   2HB   ARG  12          1HB       ARG  12   7.109  -3.492   3.331
   98   1HG   ARG  12          2HG       ARG  12   7.759  -5.832   3.873
   99   2HG   ARG  12          1HG       ARG  12   9.413  -5.426   3.397
  100   1HD   ARG  12          2HD       ARG  12   9.312  -3.540   5.048
  101   2HD   ARG  12          1HD       ARG  12   7.784  -4.208   5.615
  102    HE   ARG  12           HE       ARG  12   9.995  -6.076   5.631
  103   1HH1  ARG  12          1HH1      ARG  12   8.099  -3.733   7.421
  104   2HH1  ARG  12          2HH1      ARG  12   8.731  -4.211   8.975
  105   1HH2  ARG  12          1HH2      ARG  12  10.859  -6.687   7.689
  106   2HH2  ARG  12          2HH2      ARG  12  10.290  -5.881   9.123
  107    H    ASP  13           H        ASP  13   5.154  -3.715   1.902
  108    HA   ASP  13           HA       ASP  13   3.991  -6.092   2.860
  109   1HB   ASP  13          2HB       ASP  13   3.155  -3.706   3.154
  110   2HB   ASP  13          1HB       ASP  13   2.517  -3.822   1.520
  111    H    ALA  14           H        ALA  14   4.125  -4.650  -0.351
  112    HA   ALA  14           HA       ALA  14   2.362  -6.368  -1.678
  113   1HB   ALA  14          1HB       ALA  14   3.471  -5.646  -3.724
  114   2HB   ALA  14          2HB       ALA  14   4.812  -4.997  -2.779
  115   3HB   ALA  14          3HB       ALA  14   3.205  -4.282  -2.638
  116    H    VAL  15           H        VAL  15   5.838  -6.676  -1.058
  117    HA   VAL  15           HA       VAL  15   6.219  -9.053  -2.556
  118    HB   VAL  15           HB       VAL  15   7.822  -8.045  -0.191
  119   1HG1  VAL  15          1HG1      VAL  15   8.252 -10.395  -0.665
  120   2HG1  VAL  15          2HG1      VAL  15   9.640  -9.406  -1.126
  121   3HG1  VAL  15          3HG1      VAL  15   8.535 -10.013  -2.362
  122   1HG2  VAL  15          1HG2      VAL  15   7.715  -6.381  -1.972
  123   2HG2  VAL  15          2HG2      VAL  15   8.215  -7.595  -3.151
  124   3HG2  VAL  15          3HG2      VAL  15   9.329  -7.089  -1.881
  125    H    ALA  16           H        ALA  16   5.411  -8.406   0.828
  126    HA   ALA  16           HA       ALA  16   5.544 -11.100   1.702
  127   1HB   ALA  16          1HB       ALA  16   5.630  -9.178   3.242
  128   2HB   ALA  16          2HB       ALA  16   4.367 -10.329   3.681
  129   3HB   ALA  16          3HB       ALA  16   3.941  -8.824   2.868
  130    H    LEU  17           H        LEU  17   2.945  -9.095   0.396
  131    HA   LEU  17           HA       LEU  17   0.813 -10.892   0.836
  132   1HB   LEU  17          2HB       LEU  17   0.826  -8.382   0.149
  133   2HB   LEU  17          1HB       LEU  17   0.949  -8.982  -1.489
  134    HG   LEU  17           HG       LEU  17  -1.360  -8.347  -0.762
  135   1HD1  LEU  17          1HD1      LEU  17  -0.956 -11.224  -1.549
  136   2HD1  LEU  17          2HD1      LEU  17  -1.052  -9.842  -2.639
  137   3HD1  LEU  17          3HD1      LEU  17  -2.463 -10.323  -1.700
  138   1HD2  LEU  17          1HD2      LEU  17  -2.583  -9.872   0.696
  139   2HD2  LEU  17          2HD2      LEU  17  -1.231  -9.113   1.542
  140   3HD2  LEU  17          3HD2      LEU  17  -1.101 -10.783   0.986
  141    H    TYR  18           H        TYR  18   3.215 -10.610  -1.700
  142    HA   TYR  18           HA       TYR  18   1.953 -12.216  -3.634
  143   1HB   TYR  18          2HB       TYR  18   3.871 -10.700  -4.082
  144   2HB   TYR  18          1HB       TYR  18   4.921 -11.826  -3.228
  145    HD1  TYR  18           1HD      TYR  18   5.965 -13.541  -4.398
  146    HD2  TYR  18           2HD      TYR  18   2.564 -11.649  -6.111
  147    HE1  TYR  18           1HE      TYR  18   6.321 -14.799  -6.479
  148    HE2  TYR  18           2HE      TYR  18   2.909 -12.904  -8.198
  149    HH   TYR  18           HH       TYR  18   4.979 -15.549  -8.446
  150    H    GLU  19           H        GLU  19   3.730 -13.043  -0.769
  151    HA   GLU  19           HA       GLU  19   4.304 -15.739  -1.506
  152   1HB   GLU  19          2HB       GLU  19   4.047 -14.571   1.270
  153   2HB   GLU  19          1HB       GLU  19   4.836 -16.081   0.842
  154   1HG   GLU  19          2HG       GLU  19   6.434 -14.740  -0.547
  155   2HG   GLU  19          1HG       GLU  19   5.728 -13.290   0.165
  156    H    ASN  20           H        ASN  20   1.509 -14.091  -0.536
  157    HA   ASN  20           HA       ASN  20   0.155 -16.491   0.442
  158   1HB   ASN  20          2HB       ASN  20  -0.637 -13.571   0.394
  159   2HB   ASN  20          1HB       ASN  20  -1.687 -14.860   0.972
  160   1HD2  ASN  20          1HD2      ASN  20   1.216 -13.033   1.587
  161   2HD2  ASN  20          2HD2      ASN  20   1.395 -13.495   3.242
  162    H    SER  21           H        SER  21   0.948 -15.865  -2.393
  163    HA   SER  21           HA       SER  21  -1.294 -15.148  -3.913
  164   1HB   SER  21          2HB       SER  21   0.039 -16.342  -5.765
  165   2HB   SER  21          1HB       SER  21   0.756 -14.939  -4.977
  166    HG   SER  21           HG       SER  21   2.284 -16.153  -4.209
  167    H    ASP  22           H        ASP  22  -0.572 -18.049  -2.315
  168    HA   ASP  22           HA       ASP  22  -1.839 -19.996  -3.827
  169   1HB   ASP  22          2HB       ASP  22  -0.625 -20.520  -1.764
  170   2HB   ASP  22          1HB       ASP  22  -1.862 -19.698  -0.815
  171    H    GLY  23           H        GLY  23  -3.186 -17.465  -1.850
  172   1HA   GLY  23          2HA       GLY  23  -5.884 -18.307  -2.712
  173   2HA   GLY  23          1HA       GLY  23  -5.571 -17.582  -1.143
  174    H    ALA  24           H        ALA  24  -3.764 -16.356  -3.784
  175    HA   ALA  24           HA       ALA  24  -5.642 -14.313  -4.544
  176   1HB   ALA  24          1HB       ALA  24  -4.332 -12.415  -3.751
  177   2HB   ALA  24          2HB       ALA  24  -3.199 -13.511  -2.960
  178   3HB   ALA  24          3HB       ALA  24  -4.870 -13.415  -2.405
  179    H    SER  25           H        SER  25  -5.304 -14.694  -6.666
  180    HA   SER  25           HA       SER  25  -2.801 -15.300  -7.811
  181   1HB   SER  25          2HB       SER  25  -5.296 -14.203  -9.128
  182   2HB   SER  25          1HB       SER  25  -3.941 -14.973  -9.961
  183    HG   SER  25           HG       SER  25  -4.431 -16.812  -8.452
  184    H    LEU  26           H        LEU  26  -1.449 -14.059  -9.125
  185    HA   LEU  26           HA       LEU  26  -0.656 -11.612  -8.109
  186   1HB   LEU  26          2HB       LEU  26   0.499 -13.302  -9.735
  187   2HB   LEU  26          1HB       LEU  26  -0.200 -12.307 -10.994
  188    HG   LEU  26           HG       LEU  26   1.654 -11.238  -8.862
  189   1HD1  LEU  26          1HD1      LEU  26   2.279 -12.079 -11.689
  190   2HD1  LEU  26          2HD1      LEU  26   2.795 -12.911 -10.221
  191   3HD1  LEU  26          3HD1      LEU  26   3.390 -11.288 -10.572
  192   1HD2  LEU  26          1HD2      LEU  26   1.910  -9.357 -10.418
  193   2HD2  LEU  26          2HD2      LEU  26   0.241  -9.537  -9.876
  194   3HD2  LEU  26          3HD2      LEU  26   0.710 -10.083 -11.486
  195    H    GLN  27           H        GLN  27  -2.685 -12.250 -10.925
  196    HA   GLN  27           HA       GLN  27  -3.088  -9.624 -11.809
  197   1HB   GLN  27          2HB       GLN  27  -3.658 -11.810 -12.969
  198   2HB   GLN  27          1HB       GLN  27  -5.073 -11.908 -11.941
  199   1HG   GLN  27          2HG       GLN  27  -4.612  -9.537 -13.702
  200   2HG   GLN  27          1HG       GLN  27  -5.315 -11.020 -14.338
  201   1HE2  GLN  27          1HE2      GLN  27  -6.561  -8.481 -14.242
  202   2HE2  GLN  27          2HE2      GLN  27  -7.959  -8.610 -13.225
  203    H    GLN  28           H        GLN  28  -4.728 -11.521  -9.333
  204    HA   GLN  28           HA       GLN  28  -6.751  -9.566  -8.812
  205   1HB   GLN  28          2HB       GLN  28  -7.064 -11.981  -8.354
  206   2HB   GLN  28          1HB       GLN  28  -5.823 -11.893  -7.115
  207   1HG   GLN  28          2HG       GLN  28  -8.031 -11.870  -6.129
  208   2HG   GLN  28          1HG       GLN  28  -7.196 -10.346  -5.830
  209   1HE2  GLN  28          1HE2      GLN  28  -9.147  -9.273  -5.463
  210   2HE2  GLN  28          2HE2      GLN  28 -10.214  -8.853  -6.760
  211    H    ILE  29           H        ILE  29  -3.623 -10.433  -7.394
  212    HA   ILE  29           HA       ILE  29  -3.655  -8.749  -5.159
  213    HB   ILE  29           HB       ILE  29  -1.293  -9.510  -6.892
  214   1HG1  ILE  29          2HG1      ILE  29  -2.319 -10.772  -4.341
  215   2HG1  ILE  29          1HG1      ILE  29  -2.546 -11.436  -5.955
  216   1HG2  ILE  29          1HG2      ILE  29   0.077  -9.036  -4.912
  217   2HG2  ILE  29          2HG2      ILE  29  -1.359  -8.446  -4.070
  218   3HG2  ILE  29          3HG2      ILE  29  -0.760  -7.597  -5.497
  219   1HD1  ILE  29          1HD1      ILE  29  -0.748 -12.576  -4.839
  220   2HD1  ILE  29          2HD1      ILE  29   0.070 -11.046  -4.524
  221   3HD1  ILE  29          3HD1      ILE  29  -0.101 -11.630  -6.181
  222    H    ALA  30           H        ALA  30  -2.471  -8.134  -8.457
  223    HA   ALA  30           HA       ALA  30  -1.688  -5.471  -8.068
  224   1HB   ALA  30          1HB       ALA  30  -2.710  -6.744 -10.606
  225   2HB   ALA  30          2HB       ALA  30  -1.050  -6.823 -10.016
  226   3HB   ALA  30          3HB       ALA  30  -1.745  -5.273 -10.490
  227    H    ASN  31           H        ASN  31  -4.809  -6.854  -8.992
  228    HA   ASN  31           HA       ASN  31  -6.108  -4.358  -9.411
  229   1HB   ASN  31          2HB       ASN  31  -6.937  -7.198  -9.197
  230   2HB   ASN  31          1HB       ASN  31  -8.173  -5.986  -8.909
  231   1HD2  ASN  31          1HD2      ASN  31  -6.023  -7.392 -11.214
  232   2HD2  ASN  31          2HD2      ASN  31  -6.747  -6.677 -12.613
  233    H    ASP  32           H        ASP  32  -5.699  -6.428  -6.600
  234    HA   ASP  32           HA       ASP  32  -7.634  -5.109  -4.975
  235   1HB   ASP  32          2HB       ASP  32  -6.781  -7.434  -4.575
  236   2HB   ASP  32          1HB       ASP  32  -5.250  -6.733  -4.062
  237    H    LEU  33           H        LEU  33  -4.108  -4.915  -5.223
  238    HA   LEU  33           HA       LEU  33  -3.905  -2.853  -3.246
  239   1HB   LEU  33          2HB       LEU  33  -1.999  -4.183  -5.128
  240   2HB   LEU  33          1HB       LEU  33  -1.515  -2.714  -4.312
  241    HG   LEU  33           HG       LEU  33  -1.918  -3.832  -2.128
  242   1HD1  LEU  33          1HD1      LEU  33  -3.553  -5.491  -2.819
  243   2HD1  LEU  33          2HD1      LEU  33  -2.159  -6.267  -2.066
  244   3HD1  LEU  33          3HD1      LEU  33  -2.342  -6.290  -3.821
  245   1HD2  LEU  33          1HD2      LEU  33  -0.001  -5.250  -3.972
  246   2HD2  LEU  33          2HD2      LEU  33   0.062  -5.258  -2.208
  247   3HD2  LEU  33          3HD2      LEU  33   0.314  -3.754  -3.094
  248    H    GLY  34           H        GLY  34  -4.216  -2.975  -6.709
  249   1HA   GLY  34          2HA       GLY  34  -4.858  -1.216  -8.106
  250   2HA   GLY  34          1HA       GLY  34  -4.570  -0.092  -6.781
  251    H    ILE  35           H        ILE  35  -2.557  -2.479  -8.474
  252    HA   ILE  35           HA       ILE  35  -0.727  -0.343  -9.283
  253    HB   ILE  35           HB       ILE  35   1.200  -1.860  -8.676
  254   1HG1  ILE  35          2HG1      ILE  35  -0.905  -3.176  -6.954
  255   2HG1  ILE  35          1HG1      ILE  35  -0.123  -3.909  -8.351
  256   1HG2  ILE  35          1HG2      ILE  35  -0.444  -0.728  -6.421
  257   2HG2  ILE  35          2HG2      ILE  35   0.702   0.161  -7.425
  258   3HG2  ILE  35          3HG2      ILE  35   1.276  -1.113  -6.348
  259   1HD1  ILE  35          1HD1      ILE  35   2.029  -3.778  -7.207
  260   2HD1  ILE  35          2HD1      ILE  35   0.850  -4.719  -6.294
  261   3HD1  ILE  35          3HD1      ILE  35   1.232  -3.069  -5.803
  262    H    ASN  36           H        ASN  36   1.064  -1.394 -10.708
  263    HA   ASN  36           HA       ASN  36  -0.254  -2.887 -12.795
  264   1HB   ASN  36          2HB       ASN  36   1.115  -1.002 -13.428
  265   2HB   ASN  36          1HB       ASN  36   2.481  -1.631 -12.525
  266   1HD2  ASN  36          1HD2      ASN  36   3.794  -1.554 -14.289
  267   2HD2  ASN  36          2HD2      ASN  36   3.651  -2.655 -15.608
  268    H    ARG  37           H        ARG  37   0.313  -4.930 -13.480
  269    HA   ARG  37           HA       ARG  37   1.157  -6.802 -11.583
  270   1HB   ARG  37          2HB       ARG  37  -0.207  -7.508 -13.408
  271   2HB   ARG  37          1HB       ARG  37   0.947  -6.931 -14.590
  272   1HG   ARG  37          2HG       ARG  37   2.526  -8.667 -13.888
  273   2HG   ARG  37          1HG       ARG  37   1.342  -9.258 -12.721
  274   1HD   ARG  37          2HD       ARG  37  -0.218  -9.717 -14.557
  275   2HD   ARG  37          1HD       ARG  37   0.980  -9.140 -15.714
  276    HE   ARG  37           HE       ARG  37   2.206 -11.143 -14.248
  277   1HH1  ARG  37          1HH1      ARG  37  -0.532 -10.829 -16.404
  278   2HH1  ARG  37          2HH1      ARG  37  -0.431 -12.470 -16.984
  279   1HH2  ARG  37          1HH2      ARG  37   2.361 -13.277 -14.989
  280   2HH2  ARG  37          2HH2      ARG  37   1.227 -13.873 -16.172
  281    H    VAL  38           H        VAL  38   2.917  -5.099 -14.102
  282    HA   VAL  38           HA       VAL  38   5.343  -6.560 -13.805
  283    HB   VAL  38           HB       VAL  38   4.940  -3.786 -14.942
  284   1HG1  VAL  38          1HG1      VAL  38   7.263  -4.191 -14.352
  285   2HG1  VAL  38          2HG1      VAL  38   7.066  -4.191 -16.104
  286   3HG1  VAL  38          3HG1      VAL  38   7.240  -5.717 -15.237
  287   1HG2  VAL  38          1HG2      VAL  38   3.612  -5.423 -16.137
  288   2HG2  VAL  38          2HG2      VAL  38   5.012  -6.483 -16.293
  289   3HG2  VAL  38          3HG2      VAL  38   4.986  -4.928 -17.126
  290    H    THR  39           H        THR  39   4.184  -3.444 -12.556
  291    HA   THR  39           HA       THR  39   6.525  -2.649 -11.256
  292    HB   THR  39           HB       THR  39   3.702  -2.017 -10.372
  293    HG1  THR  39           1HG      THR  39   5.327  -1.028 -12.490
  294   1HG2  THR  39          1HG2      THR  39   4.669   0.067  -9.567
  295   2HG2  THR  39          2HG2      THR  39   6.261  -0.416 -10.150
  296   3HG2  THR  39          3HG2      THR  39   5.500  -1.300  -8.826
  297    H    LEU  40           H        LEU  40   3.855  -4.684 -10.150
  298    HA   LEU  40           HA       LEU  40   4.615  -4.960  -7.465
  299   1HB   LEU  40          2HB       LEU  40   2.456  -5.711  -8.295
  300   2HB   LEU  40          1HB       LEU  40   3.236  -6.899  -9.321
  301    HG   LEU  40           HG       LEU  40   4.039  -8.082  -7.296
  302   1HD1  LEU  40          1HD1      LEU  40   4.062  -6.205  -5.750
  303   2HD1  LEU  40          2HD1      LEU  40   3.081  -7.531  -5.129
  304   3HD1  LEU  40          3HD1      LEU  40   2.300  -6.112  -5.825
  305   1HD2  LEU  40          1HD2      LEU  40   1.057  -7.658  -7.464
  306   2HD2  LEU  40          2HD2      LEU  40   1.859  -9.001  -6.650
  307   3HD2  LEU  40          3HD2      LEU  40   2.008  -8.817  -8.396
  308    H    LYS  41           H        LYS  41   5.414  -6.940 -10.300
  309    HA   LYS  41           HA       LYS  41   6.997  -8.840  -8.963
  310   1HB   LYS  41          2HB       LYS  41   5.999  -8.912 -11.328
  311   2HB   LYS  41          1HB       LYS  41   7.407  -7.986 -11.824
  312   1HG   LYS  41          2HG       LYS  41   8.879  -9.756 -11.106
  313   2HG   LYS  41          1HG       LYS  41   7.507 -10.681 -10.486
  314   1HD   LYS  41          2HD       LYS  41   6.570 -10.700 -12.796
  315   2HD   LYS  41          1HD       LYS  41   8.062  -9.944 -13.358
  316   1HE   LYS  41          2HE       LYS  41   7.860 -12.610 -11.964
  317   2HE   LYS  41          1HE       LYS  41   8.059 -12.379 -13.699
  318   1HZ   LYS  41          1HZ       LYS  41  10.183 -12.821 -12.819
  319   2HZ   LYS  41          2HZ       LYS  41   9.985 -11.728 -11.545
  320   3HZ   LYS  41          3HZ       LYS  41  10.162 -11.154 -13.134
  321    H    ASN  42           H        ASN  42   7.789  -5.802 -10.560
  322    HA   ASN  42           HA       ASN  42  10.559  -5.853 -10.435
  323   1HB   ASN  42          2HB       ASN  42   8.566  -3.613 -10.312
  324   2HB   ASN  42          1HB       ASN  42  10.285  -3.277 -10.146
  325   1HD2  ASN  42          1HD2      ASN  42  10.241  -2.061 -12.043
  326   2HD2  ASN  42          2HD2      ASN  42  10.181  -2.811 -13.607
  327    H    TRP  43           H        TRP  43   8.283  -4.691  -7.956
  328    HA   TRP  43           HA       TRP  43  10.256  -3.935  -6.093
  329   1HB   TRP  43          2HB       TRP  43   7.365  -4.717  -5.718
  330   2HB   TRP  43          1HB       TRP  43   8.388  -4.167  -4.394
  331    HD1  TRP  43           HD       TRP  43   9.811  -1.917  -6.458
  332    HE1  TRP  43           1HE      TRP  43   8.518   0.283  -6.798
  333    HE3  TRP  43           3HE      TRP  43   5.189  -3.471  -4.937
  334    HZ2  TRP  43           2HZ      TRP  43   5.867   1.226  -6.464
  335    HZ3  TRP  43           3HZ      TRP  43   3.329  -1.862  -4.975
  336    HH2  TRP  43           HH       TRP  43   3.662   0.437  -5.719
  337    H    ILE  44           H        ILE  44   8.546  -6.972  -6.612
  338    HA   ILE  44           HA       ILE  44   9.463  -8.352  -4.352
  339    HB   ILE  44           HB       ILE  44   8.797  -9.473  -7.077
  340   1HG1  ILE  44          2HG1      ILE  44   7.015  -9.215  -4.645
  341   2HG1  ILE  44          1HG1      ILE  44   7.008  -8.072  -5.982
  342   1HG2  ILE  44          1HG2      ILE  44  10.026 -11.063  -5.693
  343   2HG2  ILE  44          2HG2      ILE  44   8.346 -11.561  -5.881
  344   3HG2  ILE  44          3HG2      ILE  44   8.881 -10.818  -4.375
  345   1HD1  ILE  44          1HD1      ILE  44   6.326  -9.826  -7.506
  346   2HD1  ILE  44          2HD1      ILE  44   5.200  -9.686  -6.153
  347   3HD1  ILE  44          3HD1      ILE  44   6.376 -11.000  -6.191
  348    H    ILE  45           H        ILE  45  10.837  -8.036  -7.603
  349    HA   ILE  45           HA       ILE  45  12.968  -9.847  -7.252
  350    HB   ILE  45           HB       ILE  45  12.813  -7.458  -9.100
  351   1HG1  ILE  45          2HG1      ILE  45  12.238 -10.386  -9.610
  352   2HG1  ILE  45          1HG1      ILE  45  11.014  -9.133  -9.403
  353   1HG2  ILE  45          1HG2      ILE  45  15.114  -8.174  -8.799
  354   2HG2  ILE  45          2HG2      ILE  45  14.543  -8.605 -10.413
  355   3HG2  ILE  45          3HG2      ILE  45  14.658  -9.841  -9.159
  356   1HD1  ILE  45          1HD1      ILE  45  13.069  -9.240 -11.603
  357   2HD1  ILE  45          2HD1      ILE  45  11.811  -8.017 -11.409
  358   3HD1  ILE  45          3HD1      ILE  45  11.369  -9.689 -11.748
  359    H    LYS  46           H        LYS  46  12.764  -6.344  -6.746
  360    HA   LYS  46           HA       LYS  46  15.591  -6.182  -6.165
  361   1HB   LYS  46          2HB       LYS  46  14.320  -4.384  -7.373
  362   2HB   LYS  46          1HB       LYS  46  13.513  -4.017  -5.853
  363   1HG   LYS  46          2HG       LYS  46  15.717  -3.555  -4.838
  364   2HG   LYS  46          1HG       LYS  46  16.462  -3.821  -6.414
  365   1HD   LYS  46          2HD       LYS  46  15.072  -1.978  -7.327
  366   2HD   LYS  46          1HD       LYS  46  14.464  -1.679  -5.696
  367   1HE   LYS  46          2HE       LYS  46  16.238  -0.132  -6.120
  368   2HE   LYS  46          1HE       LYS  46  16.820  -1.325  -4.960
  369   1HZ   LYS  46          1HZ       LYS  46  18.543  -1.112  -6.484
  370   2HZ   LYS  46          2HZ       LYS  46  17.504  -1.047  -7.818
  371   3HZ   LYS  46          3HZ       LYS  46  17.747  -2.514  -7.011
  372    H    TYR  47           H        TYR  47  12.588  -5.578  -4.310
  373    HA   TYR  47           HA       TYR  47  14.137  -5.049  -1.936
  374   1HB   TYR  47          2HB       TYR  47  11.144  -5.183  -2.338
  375   2HB   TYR  47          1HB       TYR  47  11.949  -4.635  -0.869
  376    HD1  TYR  47           1HD      TYR  47  10.883  -3.733  -4.197
  377    HD2  TYR  47           2HD      TYR  47  13.366  -2.562  -0.947
  378    HE1  TYR  47           1HE      TYR  47  11.041  -1.472  -5.140
  379    HE2  TYR  47           2HE      TYR  47  13.526  -0.292  -1.881
  380    HH   TYR  47           HH       TYR  47  13.320   0.778  -4.157
  381    H    GLY  48           H        GLY  48  12.396  -7.741  -3.283
  382   1HA   GLY  48          2HA       GLY  48  12.367  -9.338  -0.933
  383   2HA   GLY  48          1HA       GLY  48  12.282  -9.930  -2.587
  384    H    SER  49           H        SER  49  14.790  -8.482  -3.234
  385    HA   SER  49           HA       SER  49  16.664 -10.513  -2.410
  386   1HB   SER  49          2HB       SER  49  16.562  -9.511  -4.734
  387   2HB   SER  49          1HB       SER  49  17.217  -8.027  -4.044
  388    HG   SER  49           HG       SER  49  18.905  -9.638  -3.194
  389    H    ASN  50           H        ASN  50  15.728  -7.351  -1.477
  390    HA   ASN  50           HA       ASN  50  16.228  -6.118   0.366
  391   1HB   ASN  50          2HB       ASN  50  16.660  -8.086   1.675
  392   2HB   ASN  50          1HB       ASN  50  18.227  -8.319   0.912
  393   1HD2  ASN  50          1HD2      ASN  50  19.409  -8.272   2.735
  394   2HD2  ASN  50          2HD2      ASN  50  19.598  -6.866   3.733
  395    H    HIS  51           H        HIS  51  19.465  -7.350  -0.427
  396    HA   HIS  51           HA       HIS  51  20.164  -4.827  -1.692
  397   1HB   HIS  51          2HB       HIS  51  21.369  -5.776   0.901
  398   2HB   HIS  51          1HB       HIS  51  22.309  -4.795  -0.219
  399    HD1  HIS  51           1HD      HIS  51  19.443  -4.605   2.185
  400    HD2  HIS  51           2HD      HIS  51  21.491  -2.112  -0.439
  401    HE1  HIS  51           1HE      HIS  51  18.728  -2.271   2.771
  402    HE2  HIS  51           2HE      HIS  51  19.830  -0.798   1.049
  403    H    ASN  52           H        ASN  52  22.450  -4.981  -2.600
  404    HA   ASN  52           HA       ASN  52  23.655  -5.982  -4.251
  405   1HB   ASN  52          2HB       ASN  52  24.706  -6.921  -2.197
  406   2HB   ASN  52          1HB       ASN  52  23.629  -8.304  -2.312
  407   1HD2  ASN  52          1HD2      ASN  52  26.242  -6.584  -3.894
  408   2HD2  ASN  52          2HD2      ASN  52  26.859  -7.943  -4.780
  409    H    VAL  53           H        VAL  53  21.254  -5.882  -5.053
  410    HA   VAL  53           HA       VAL  53  19.677  -8.186  -5.262
  411    HB   VAL  53           HB       VAL  53  19.717  -5.857  -7.191
  412   1HG1  VAL  53          1HG1      VAL  53  17.504  -7.754  -6.405
  413   2HG1  VAL  53          2HG1      VAL  53  18.372  -7.751  -7.939
  414   3HG1  VAL  53          3HG1      VAL  53  17.346  -6.385  -7.503
  415   1HG2  VAL  53          1HG2      VAL  53  18.065  -4.801  -5.731
  416   2HG2  VAL  53          2HG2      VAL  53  19.592  -5.054  -4.883
  417   3HG2  VAL  53          3HG2      VAL  53  18.225  -6.126  -4.579
  418    H    GLN  54           H        GLN  54  21.406  -6.595  -7.934
  419    HA   GLN  54           HA       GLN  54  21.932  -9.262  -9.061
  420   1HB   GLN  54          2HB       GLN  54  21.347  -6.628 -10.296
  421   2HB   GLN  54          1HB       GLN  54  22.537  -7.631 -11.111
  422   1HG   GLN  54          2HG       GLN  54  20.431  -8.053 -12.111
  423   2HG   GLN  54          1HG       GLN  54  20.858  -9.468 -11.152
  424   1HE2  GLN  54          1HE2      GLN  54  19.627 -10.000  -9.371
  425   2HE2  GLN  54          2HE2      GLN  54  18.115  -9.241  -9.018
  426    H    GLY  55           H        GLY  55  23.556  -8.828  -7.098
  427   1HA   GLY  55          2HA       GLY  55  25.859  -7.264  -7.661
  428   2HA   GLY  55          1HA       GLY  55  25.748  -8.545  -6.460
  429    H    THR  56           H        THR  56  24.924 -10.522  -8.364
  430    HA   THR  56           HA       THR  56  25.839 -12.246  -9.476
  431    HB   THR  56           HB       THR  56  27.010 -11.665 -11.607
  432    HG1  THR  56           1HG      THR  56  27.268  -9.288 -10.375
  433   1HG2  THR  56          1HG2      THR  56  25.035 -10.661 -12.652
  434   2HG2  THR  56          2HG2      THR  56  24.416 -10.233 -11.058
  435   3HG2  THR  56          3HG2      THR  56  24.588 -11.929 -11.512
  436    H    THR  57           H        THR  57  27.146 -13.218  -8.025
  437    HA   THR  57           HA       THR  57  30.018 -12.622  -8.283
  438    HB   THR  57           HB       THR  57  30.150 -13.762  -5.963
  439    HG1  THR  57           1HG      THR  57  27.619 -14.078  -6.295
  440   1HG2  THR  57          1HG2      THR  57  28.900 -11.029  -6.229
  441   2HG2  THR  57          2HG2      THR  57  30.622 -11.394  -6.336
  442   3HG2  THR  57          3HG2      THR  57  29.761 -11.637  -4.815
  443    HA   PRO  58           HA       PRO  58  29.301 -16.821  -9.940
  444   1HB   PRO  58          2HB       PRO  58  31.508 -16.305 -11.738
  445   2HB   PRO  58          1HB       PRO  58  29.799 -16.511 -12.123
  446   1HG   PRO  58          2HG       PRO  58  31.144 -14.142 -12.378
  447   2HG   PRO  58          1HG       PRO  58  29.397 -14.260 -12.105
  448   1HD   PRO  58          2HD       PRO  58  31.591 -13.673 -10.154
  449   2HD   PRO  58          1HD       PRO  58  29.967 -12.960 -10.274
  450    H    SER  59           H        SER  59  30.085 -18.241  -8.485
  451    HA   SER  59           HA       SER  59  32.876 -18.194  -7.736
  452   1HB   SER  59          2HB       SER  59  32.044 -20.332  -6.443
  453   2HB   SER  59          1HB       SER  59  31.568 -18.723  -5.897
  454    HG   SER  59           HG       SER  59  30.018 -20.760  -6.828
  455    H    ALA  60           H        ALA  60  30.660 -20.483  -9.317
  456    HA   ALA  60           HA       ALA  60  32.914 -22.139 -10.115
  457   1HB   ALA  60          1HB       ALA  60  31.248 -23.724 -10.886
  458   2HB   ALA  60          2HB       ALA  60  29.966 -22.552 -10.582
  459   3HB   ALA  60          3HB       ALA  60  30.892 -23.217  -9.235
  460    H    ALA  61           H        ALA  61  30.722 -19.831 -11.477
  461    HA   ALA  61           HA       ALA  61  30.891 -20.789 -14.155
  462   1HB   ALA  61          1HB       ALA  61  29.593 -18.853 -14.768
  463   2HB   ALA  61          2HB       ALA  61  29.902 -18.114 -13.197
  464   3HB   ALA  61          3HB       ALA  61  28.928 -19.581 -13.309
  465    H    VAL  62           H        VAL  62  33.100 -19.106 -12.365
  466    HA   VAL  62           HA       VAL  62  34.184 -17.560 -14.557
  467    HB   VAL  62           HB       VAL  62  35.344 -18.103 -11.820
  468   1HG1  VAL  62          1HG1      VAL  62  36.922 -16.291 -12.341
  469   2HG1  VAL  62          2HG1      VAL  62  36.270 -16.203 -13.978
  470   3HG1  VAL  62          3HG1      VAL  62  37.110 -17.659 -13.441
  471   1HG2  VAL  62          1HG2      VAL  62  34.730 -15.768 -11.364
  472   2HG2  VAL  62          2HG2      VAL  62  33.317 -16.754 -11.739
  473   3HG2  VAL  62          3HG2      VAL  62  33.978 -15.662 -12.956
  474    H    SER  63           H        SER  63  35.251 -20.288 -12.594
  475    HA   SER  63           HA       SER  63  37.511 -20.819 -14.267
  476   1HB   SER  63          2HB       SER  63  36.357 -22.562 -12.084
  477   2HB   SER  63          1HB       SER  63  38.005 -22.579 -12.709
  478    HG   SER  63           HG       SER  63  38.170 -21.352 -10.935
  479    H    GLU  64           H        GLU  64  34.305 -22.216 -13.847
  480    HA   GLU  64           HA       GLU  64  34.841 -24.609 -15.294
  481   1HB   GLU  64          2HB       GLU  64  32.912 -23.973 -13.612
  482   2HB   GLU  64          1HB       GLU  64  32.084 -23.475 -15.082
  483   1HG   GLU  64          2HG       GLU  64  31.396 -25.680 -14.663
  484   2HG   GLU  64          1HG       GLU  64  32.558 -25.781 -15.986
  485    H    ALA  65           H        ALA  65  33.713 -21.446 -16.158
  486    HA   ALA  65           HA       ALA  65  32.556 -21.994 -18.647
  487   1HB   ALA  65          1HB       ALA  65  32.227 -19.886 -17.467
  488   2HB   ALA  65          2HB       ALA  65  32.798 -19.618 -19.114
  489   3HB   ALA  65          3HB       ALA  65  33.912 -19.456 -17.755
  490    H    GLU  66           H        GLU  66  35.865 -21.804 -17.699
  491    HA   GLU  66           HA       GLU  66  37.115 -21.075 -20.085
  492   1HB   GLU  66          2HB       GLU  66  38.241 -21.294 -17.890
  493   2HB   GLU  66          1HB       GLU  66  38.070 -23.036 -17.992
  494   1HG   GLU  66          2HG       GLU  66  40.321 -22.363 -18.562
  495   2HG   GLU  66          1HG       GLU  66  39.511 -23.070 -19.960
  496    H    GLN  67           H        GLN  67  36.394 -24.332 -18.850
  497    HA   GLN  67           HA       GLN  67  37.183 -25.547 -21.336
  498   1HB   GLN  67          2HB       GLN  67  36.495 -27.663 -20.234
  499   2HB   GLN  67          1HB       GLN  67  37.670 -26.738 -19.311
  500   1HG   GLN  67          2HG       GLN  67  35.735 -25.836 -17.976
  501   2HG   GLN  67          1HG       GLN  67  34.731 -27.042 -18.783
  502   1HE2  GLN  67          1HE2      GLN  67  37.301 -26.510 -16.508
  503   2HE2  GLN  67          2HE2      GLN  67  37.298 -28.095 -15.827
  504    H    ILE  68           H        ILE  68  34.171 -24.654 -19.771
  505    HA   ILE  68           HA       ILE  68  32.439 -26.197 -21.375
  506    HB   ILE  68           HB       ILE  68  31.928 -23.615 -19.897
  507   1HG1  ILE  68          2HG1      ILE  68  31.250 -26.491 -19.250
  508   2HG1  ILE  68          1HG1      ILE  68  32.510 -25.529 -18.480
  509   1HG2  ILE  68          1HG2      ILE  68  30.311 -23.805 -21.691
  510   2HG2  ILE  68          2HG2      ILE  68  29.534 -24.125 -20.140
  511   3HG2  ILE  68          3HG2      ILE  68  29.941 -25.464 -21.213
  512   1HD1  ILE  68          1HD1      ILE  68  29.547 -25.012 -18.353
  513   2HD1  ILE  68          2HD1      ILE  68  30.795 -24.012 -17.610
  514   3HD1  ILE  68          3HD1      ILE  68  30.557 -25.673 -17.066
  515    H    ARG  69           H        ARG  69  33.599 -22.851 -21.740
  516    HA   ARG  69           HA       ARG  69  32.026 -22.253 -23.994
  517   1HB   ARG  69          2HB       ARG  69  34.448 -21.053 -22.750
  518   2HB   ARG  69          1HB       ARG  69  34.020 -20.551 -24.381
  519   1HG   ARG  69          2HG       ARG  69  31.924 -20.544 -22.265
  520   2HG   ARG  69          1HG       ARG  69  33.124 -19.251 -22.299
  521   1HD   ARG  69          2HD       ARG  69  30.927 -18.869 -23.555
  522   2HD   ARG  69          1HD       ARG  69  32.428 -18.497 -24.397
  523    HE   ARG  69           HE       ARG  69  32.151 -20.582 -25.625
  524   1HH1  ARG  69          1HH1      ARG  69  29.343 -19.420 -23.871
  525   2HH1  ARG  69          2HH1      ARG  69  28.203 -20.211 -24.923
  526   1HH2  ARG  69          1HH2      ARG  69  30.676 -21.615 -27.007
  527   2HH2  ARG  69          2HH2      ARG  69  28.963 -21.491 -26.708
  528    H    GLN  70           H        GLN  70  35.196 -23.745 -23.712
  529    HA   GLN  70           HA       GLN  70  35.743 -23.716 -26.480
  530   1HB   GLN  70          2HB       GLN  70  36.852 -25.084 -24.061
  531   2HB   GLN  70          1HB       GLN  70  37.425 -25.456 -25.656
  532   1HG   GLN  70          2HG       GLN  70  37.516 -22.800 -24.288
  533   2HG   GLN  70          1HG       GLN  70  38.886 -23.842 -24.667
  534   1HE2  GLN  70          1HE2      GLN  70  39.658 -23.924 -26.766
  535   2HE2  GLN  70          2HE2      GLN  70  39.202 -22.767 -27.968
  536    H    LEU  71           H        LEU  71  34.266 -25.931 -24.225
  537    HA   LEU  71           HA       LEU  71  34.195 -28.209 -25.889
  538   1HB   LEU  71          2HB       LEU  71  33.882 -28.051 -23.364
  539   2HB   LEU  71          1HB       LEU  71  32.242 -27.538 -23.694
  540    HG   LEU  71           HG       LEU  71  33.280 -30.165 -24.734
  541   1HD1  LEU  71          1HD1      LEU  71  33.681 -30.145 -22.332
  542   2HD1  LEU  71          2HD1      LEU  71  32.340 -31.218 -22.735
  543   3HD1  LEU  71          3HD1      LEU  71  32.019 -29.625 -22.048
  544   1HD2  LEU  71          1HD2      LEU  71  30.896 -30.760 -24.620
  545   2HD2  LEU  71          2HD2      LEU  71  31.185 -29.377 -25.676
  546   3HD2  LEU  71          3HD2      LEU  71  30.527 -29.129 -24.058
  547    H    LYS  72           H        LYS  72  31.804 -25.644 -25.248
  548    HA   LYS  72           HA       LYS  72  29.977 -26.767 -27.217
  549   1HB   LYS  72          2HB       LYS  72  29.799 -24.242 -25.560
  550   2HB   LYS  72          1HB       LYS  72  28.518 -24.865 -26.591
  551   1HG   LYS  72          2HG       LYS  72  29.677 -26.234 -24.173
  552   2HG   LYS  72          1HG       LYS  72  28.117 -25.415 -24.260
  553   1HD   LYS  72          2HD       LYS  72  27.346 -27.031 -25.915
  554   2HD   LYS  72          1HD       LYS  72  28.918 -27.830 -25.887
  555   1HE   LYS  72          2HE       LYS  72  28.583 -28.365 -23.513
  556   2HE   LYS  72          1HE       LYS  72  27.000 -27.594 -23.571
  557   1HZ   LYS  72          1HZ       LYS  72  26.304 -29.218 -25.217
  558   2HZ   LYS  72          2HZ       LYS  72  26.829 -29.995 -23.798
  559   3HZ   LYS  72          3HZ       LYS  72  27.828 -29.963 -25.166
  560    H    LYS  73           H        LYS  73  32.667 -24.932 -27.307
  561    HA   LYS  73           HA       LYS  73  33.695 -23.555 -28.753
  562   1HB   LYS  73          2HB       LYS  73  32.979 -25.437 -30.306
  563   2HB   LYS  73          1HB       LYS  73  31.663 -24.387 -30.816
  564   1HG   LYS  73          2HG       LYS  73  33.348 -22.687 -31.479
  565   2HG   LYS  73          1HG       LYS  73  34.613 -23.855 -31.091
  566   1HD   LYS  73          2HD       LYS  73  33.565 -25.416 -32.731
  567   2HD   LYS  73          1HD       LYS  73  32.473 -24.111 -33.195
  568   1HE   LYS  73          2HE       LYS  73  35.476 -24.140 -33.439
  569   2HE   LYS  73          1HE       LYS  73  34.308 -24.201 -34.754
  570   1HZ   LYS  73          1HZ       LYS  73  34.901 -21.918 -32.956
  571   2HZ   LYS  73          2HZ       LYS  73  33.538 -21.965 -33.951
  572   3HZ   LYS  73          3HZ       LYS  73  35.082 -21.996 -34.642
  573    H    GLU  74           H        GLU  74  30.695 -23.047 -30.513
  574    HA   GLU  74           HA       GLU  74  30.038 -20.566 -29.291
  575   1HB   GLU  74          2HB       GLU  74  30.834 -19.053 -31.012
  576   2HB   GLU  74          1HB       GLU  74  32.194 -19.941 -30.335
  577   1HG   GLU  74          2HG       GLU  74  32.209 -21.431 -32.242
  578   2HG   GLU  74          1HG       GLU  74  30.799 -20.616 -32.915
  579    H    ASN  75           H        ASN  75  28.596 -19.251 -30.741
  580    HA   ASN  75           HA       ASN  75  27.312 -20.809 -32.887
  581   1HB   ASN  75          2HB       ASN  75  26.059 -20.669 -30.635
  582   2HB   ASN  75          1HB       ASN  75  25.770 -18.993 -31.054
  583   1HD2  ASN  75          1HD2      ASN  75  25.872 -21.660 -33.348
  584   2HD2  ASN  75          2HD2      ASN  75  24.203 -21.581 -33.794
  585    H    ALA  76           H        ALA  76  28.999 -18.209 -32.032
  586    HA   ALA  76           HA       ALA  76  27.706 -15.953 -32.966
  587   1HB   ALA  76          1HB       ALA  76  30.668 -16.462 -32.919
  588   2HB   ALA  76          2HB       ALA  76  29.695 -15.885 -31.563
  589   3HB   ALA  76          3HB       ALA  76  29.883 -14.885 -33.004
  590    H    LEU  77           H        LEU  77  29.976 -18.036 -34.699
  591    HA   LEU  77           HA       LEU  77  30.177 -16.594 -37.037
  592   1HB   LEU  77          2HB       LEU  77  30.821 -18.741 -38.093
  593   2HB   LEU  77          1HB       LEU  77  31.685 -18.369 -36.623
  594    HG   LEU  77           HG       LEU  77  29.890 -19.930 -35.516
  595   1HD1  LEU  77          1HD1      LEU  77  29.888 -20.918 -38.361
  596   2HD1  LEU  77          2HD1      LEU  77  28.517 -20.203 -37.511
  597   3HD1  LEU  77          3HD1      LEU  77  29.183 -21.745 -36.971
  598   1HD2  LEU  77          1HD2      LEU  77  31.378 -21.840 -35.886
  599   2HD2  LEU  77          2HD2      LEU  77  32.275 -20.362 -35.542
  600   3HD2  LEU  77          3HD2      LEU  77  32.169 -20.963 -37.196
  601    H    GLN  78           H        GLN  78  27.533 -18.560 -35.963
  602    HA   GLN  78           HA       GLN  78  26.277 -18.803 -38.528
  603   1HB   GLN  78          2HB       GLN  78  25.324 -19.248 -35.704
  604   2HB   GLN  78          1HB       GLN  78  24.250 -19.406 -37.084
  605   1HG   GLN  78          2HG       GLN  78  26.800 -20.965 -36.772
  606   2HG   GLN  78          1HG       GLN  78  25.222 -21.539 -36.234
  607   1HE2  GLN  78          1HE2      GLN  78  27.241 -20.856 -38.965
  608   2HE2  GLN  78          2HE2      GLN  78  26.238 -21.615 -40.150
  609    H    ARG  79           H        ARG  79  25.769 -16.741 -35.678
  610    HA   ARG  79           HA       ARG  79  23.544 -15.391 -36.869
  611   1HB   ARG  79          2HB       ARG  79  25.033 -15.164 -34.307
  612   2HB   ARG  79          1HB       ARG  79  24.092 -13.775 -34.829
  613   1HG   ARG  79          2HG       ARG  79  22.809 -15.178 -33.328
  614   2HG   ARG  79          1HG       ARG  79  22.088 -15.163 -34.937
  615   1HD   ARG  79          2HD       ARG  79  23.229 -17.319 -35.404
  616   2HD   ARG  79          1HD       ARG  79  23.798 -17.338 -33.737
  617    HE   ARG  79           HE       ARG  79  21.115 -17.055 -33.468
  618   1HH1  ARG  79          1HH1      ARG  79  23.130 -19.308 -35.223
  619   2HH1  ARG  79          2HH1      ARG  79  22.027 -20.636 -35.065
  620   1HH2  ARG  79          1HH2      ARG  79  19.634 -18.790 -33.284
  621   2HH2  ARG  79          2HH2      ARG  79  20.012 -20.328 -33.996
  622    H    ALA  80           H        ALA  80  26.891 -15.030 -37.124
  623    HA   ALA  80           HA       ALA  80  27.150 -12.262 -37.487
  624   1HB   ALA  80          1HB       ALA  80  29.063 -13.763 -37.200
  625   2HB   ALA  80          2HB       ALA  80  29.233 -12.777 -38.652
  626   3HB   ALA  80          3HB       ALA  80  28.748 -14.467 -38.786
  627    H    ARG  81           H        ARG  81  25.825 -14.711 -39.517
  628    HA   ARG  81           HA       ARG  81  25.921 -13.089 -41.909
  629   1HB   ARG  81          2HB       ARG  81  24.818 -15.809 -41.278
  630   2HB   ARG  81          1HB       ARG  81  24.473 -15.012 -42.807
  631   1HG   ARG  81          2HG       ARG  81  27.302 -15.271 -41.910
  632   2HG   ARG  81          1HG       ARG  81  26.475 -16.677 -42.581
  633   1HD   ARG  81          2HD       ARG  81  27.722 -15.449 -44.297
  634   2HD   ARG  81          1HD       ARG  81  25.992 -15.451 -44.622
  635    HE   ARG  81           HE       ARG  81  26.704 -13.107 -43.209
  636   1HH1  ARG  81          1HH1      ARG  81  26.986 -14.600 -46.360
  637   2HH1  ARG  81          2HH1      ARG  81  27.101 -13.087 -47.216
  638   1HH2  ARG  81          1HH2      ARG  81  26.792 -11.093 -44.341
  639   2HH2  ARG  81          2HH2      ARG  81  26.965 -11.100 -46.068
  640    H    THR  82           H        THR  82  23.772 -13.691 -39.315
  641    HA   THR  82           HA       THR  82  21.423 -12.735 -40.706
  642    HB   THR  82           HB       THR  82  21.697 -13.239 -37.739
  643    HG1  THR  82           1HG      THR  82  21.190 -15.041 -39.895
  644   1HG2  THR  82          1HG2      THR  82  19.319 -13.375 -39.604
  645   2HG2  THR  82          2HG2      THR  82  19.657 -12.066 -38.469
  646   3HG2  THR  82          3HG2      THR  82  19.295 -13.686 -37.870
  647    H    ARG  83           H        ARG  83  23.994 -11.453 -38.884
  648    HA   ARG  83           HA       ARG  83  22.743  -9.210 -37.723
  649   1HB   ARG  83          2HB       ARG  83  25.598  -9.793 -38.442
  650   2HB   ARG  83          1HB       ARG  83  25.116  -8.285 -37.686
  651   1HG   ARG  83          2HG       ARG  83  24.478  -9.329 -35.711
  652   2HG   ARG  83          1HG       ARG  83  24.369 -10.913 -36.476
  653   1HD   ARG  83          2HD       ARG  83  26.328 -10.703 -35.004
  654   2HD   ARG  83          1HD       ARG  83  26.767 -11.030 -36.677
  655    HE   ARG  83           HE       ARG  83  27.407  -8.692 -36.884
  656   1HH1  ARG  83          1HH1      ARG  83  26.830  -9.834 -33.618
  657   2HH1  ARG  83          2HH1      ARG  83  27.958  -8.719 -32.898
  658   1HH2  ARG  83          1HH2      ARG  83  28.857  -7.218 -35.939
  659   2HH2  ARG  83          2HH2      ARG  83  29.116  -7.233 -34.219
  660    H    HIS  84           H        HIS  84  21.900  -7.580 -38.615
  661    HA   HIS  84           HA       HIS  84  22.947  -6.335 -41.028
  662   1HB   HIS  84          2HB       HIS  84  20.163  -7.521 -40.813
  663   2HB   HIS  84          1HB       HIS  84  20.579  -6.291 -41.997
  664    HD1  HIS  84           1HD      HIS  84  20.108  -9.748 -41.859
  665    HD2  HIS  84           2HD      HIS  84  23.077  -7.343 -43.505
  666    HE1  HIS  84           1HE      HIS  84  21.233 -11.158 -43.605
  667    HE2  HIS  84           2HE      HIS  84  22.852  -9.603 -44.752
  668    HA   PRO  85           HA       PRO  85  21.415  -2.468 -39.283
  669   1HB   PRO  85          2HB       PRO  85  19.228  -2.349 -41.313
  670   2HB   PRO  85          1HB       PRO  85  20.390  -1.106 -40.835
  671   1HG   PRO  85          2HG       PRO  85  20.690  -2.444 -43.110
  672   2HG   PRO  85          1HG       PRO  85  22.091  -2.020 -42.109
  673   1HD   PRO  85          2HD       PRO  85  20.757  -4.659 -42.478
  674   2HD   PRO  85          1HD       PRO  85  22.461  -4.277 -42.181
  675    H    ALA  86           H        ALA  86  19.374  -1.371 -38.470
  676    HA   ALA  86           HA       ALA  86  17.856  -3.433 -37.052
  677   1HB   ALA  86          1HB       ALA  86  19.239  -1.968 -35.674
  678   2HB   ALA  86          2HB       ALA  86  17.526  -1.774 -35.307
  679   3HB   ALA  86          3HB       ALA  86  18.363  -0.561 -36.279
  680    H    GLU  87           H        GLU  87  15.694  -2.434 -36.152
  681    HA   GLU  87           HA       GLU  87  14.066  -1.951 -38.485
  682   1HB   GLU  87          2HB       GLU  87  12.182  -2.265 -37.039
  683   2HB   GLU  87          1HB       GLU  87  13.384  -3.474 -36.626
  684   1HG   GLU  87          2HG       GLU  87  13.017  -0.911 -35.098
  685   2HG   GLU  87          1HG       GLU  87  12.195  -2.414 -34.697
  686    H    SER  88           H        SER  88  15.469  -0.097 -35.966
  687    HA   SER  88           HA       SER  88  13.659   1.972 -35.619
  688   1HB   SER  88          2HB       SER  88  15.692   3.290 -34.877
  689   2HB   SER  88          1HB       SER  88  15.456   1.737 -34.075
  690    HG   SER  88           HG       SER  88  17.544   2.594 -35.538
  691    H    CYS  89           H        CYS  89  16.057   1.551 -38.162
  692    HA   CYS  89           HA       CYS  89  15.753   4.262 -39.096
  693   1HB   CYS  89          2HB       CYS  89  17.228   3.418 -40.997
  694   2HB   CYS  89          1HB       CYS  89  17.925   3.372 -39.381
  695    HG   CYS  89           HG       CYS  89  17.233   0.858 -41.473
  696    H    LEU  90           H        LEU  90  14.254   1.238 -39.665
  697    HA   LEU  90           HA       LEU  90  13.301   1.910 -42.320
  698   1HB   LEU  90          2HB       LEU  90  12.423  -0.390 -40.581
  699   2HB   LEU  90          1HB       LEU  90  12.282  -0.252 -42.324
  700    HG   LEU  90           HG       LEU  90  14.868  -0.518 -40.798
  701   1HD1  LEU  90          1HD1      LEU  90  13.564  -2.571 -40.735
  702   2HD1  LEU  90          2HD1      LEU  90  14.966  -2.756 -41.790
  703   3HD1  LEU  90          3HD1      LEU  90  13.364  -2.513 -42.486
  704   1HD2  LEU  90          1HD2      LEU  90  15.152   0.762 -42.850
  705   2HD2  LEU  90          2HD2      LEU  90  14.319  -0.495 -43.764
  706   3HD2  LEU  90          3HD2      LEU  90  15.877  -0.839 -43.015
  707    H    GLU  91           H        GLU  91  11.997   1.538 -39.064
  708    HA   GLU  91           HA       GLU  91   9.281   1.878 -39.684
  709   1HB   GLU  91          2HB       GLU  91  10.725   2.603 -37.134
  710   2HB   GLU  91          1HB       GLU  91   8.985   2.451 -37.306
  711   1HG   GLU  91          2HG       GLU  91   9.320   0.068 -37.918
  712   2HG   GLU  91          1HG       GLU  91  11.033   0.268 -37.542
  713    H    HIS  92           H        HIS  92  11.766   4.255 -38.882
  714    HA   HIS  92           HA       HIS  92   9.797   6.349 -38.605
  715   1HB   HIS  92          2HB       HIS  92  12.805   6.381 -38.370
  716   2HB   HIS  92          1HB       HIS  92  11.786   7.797 -38.131
  717    HD1  HIS  92           1HD      HIS  92  13.225   4.991 -36.357
  718    HD2  HIS  92           2HD      HIS  92   9.861   7.391 -35.918
  719    HE1  HIS  92           1HE      HIS  92  12.467   4.662 -33.981
  720    HE2  HIS  92           2HE      HIS  92  10.290   5.920 -33.833
  721    H    HIS  93           H        HIS  93   9.319   7.909 -39.946
  722    HA   HIS  93           HA       HIS  93   9.225   9.264 -41.737
  723   1HB   HIS  93          2HB       HIS  93  11.769   9.411 -41.445
  724   2HB   HIS  93          1HB       HIS  93  11.869   8.237 -42.756
  725    HD1  HIS  93           1HD      HIS  93  12.094   9.281 -45.013
  726    HD2  HIS  93           2HD      HIS  93  10.091  11.759 -42.328
  727    HE1  HIS  93           1HE      HIS  93  11.606  11.404 -46.271
  728    HE2  HIS  93           2HE      HIS  93  10.209  12.791 -44.697
  729    H    HIS  94           H        HIS  94   8.962   6.095 -41.698
  730    HA   HIS  94           HA       HIS  94   8.619   5.606 -44.528
  731   1HB   HIS  94          2HB       HIS  94   9.280   3.818 -42.872
  732   2HB   HIS  94          1HB       HIS  94   7.664   3.928 -42.189
  733    HD1  HIS  94           1HD      HIS  94   9.583   2.477 -45.026
  734    HD2  HIS  94           2HD      HIS  94   5.609   2.860 -43.846
  735    HE1  HIS  94           1HE      HIS  94   8.287   0.868 -46.457
  736    HE2  HIS  94           2HE      HIS  94   5.880   1.129 -45.751
  737    H    HIS  95           H        HIS  95   7.299   7.674 -44.489
  738    HA   HIS  95           HA       HIS  95   4.565   7.253 -43.523
  739   1HB   HIS  95          2HB       HIS  95   5.751   9.285 -42.751
  740   2HB   HIS  95          1HB       HIS  95   5.908   9.814 -44.421
  741    HD1  HIS  95           1HD      HIS  95   3.254   9.162 -41.799
  742    HD2  HIS  95           2HD      HIS  95   3.737  11.179 -45.409
  743    HE1  HIS  95           1HE      HIS  95   1.164  10.535 -42.102
  744    HE2  HIS  95           2HE      HIS  95   1.466  11.736 -44.301
  745    H    HIS  96           H        HIS  96   3.348   6.318 -44.995
  746    HA   HIS  96           HA       HIS  96   3.634   7.052 -47.808
  747   1HB   HIS  96          2HB       HIS  96   3.359   4.632 -47.051
  748   2HB   HIS  96          1HB       HIS  96   1.700   5.045 -46.635
  749    HD1  HIS  96           1HD      HIS  96   0.296   6.099 -48.831
  750    HD2  HIS  96           2HD      HIS  96   3.646   3.737 -49.574
  751    HE1  HIS  96           1HE      HIS  96   0.064   5.318 -51.210
  752    HE2  HIS  96           2HE      HIS  96   2.129   3.940 -51.662
  753    H    HIS  97           H        HIS  97   2.320   8.488 -48.748
  754    HA   HIS  97           HA       HIS  97  -0.096   9.269 -47.262
  755   1HB   HIS  97          2HB       HIS  97   0.007  11.354 -48.759
  756   2HB   HIS  97          1HB       HIS  97   1.202  11.221 -47.479
  757    HD1  HIS  97           1HD      HIS  97   0.915  10.752 -51.238
  758    HD2  HIS  97           2HD      HIS  97   3.791  11.371 -48.299
  759    HE1  HIS  97           1HE      HIS  97   3.060  11.200 -52.473
  760    HE2  HIS  97           2HE      HIS  97   4.814  11.432 -50.673
  Start of MODEL   13
    1   1H    MET   1          1HT       MET   1   4.406  18.751  -9.628
    2   2H    MET   1          2HT       MET   1   5.739  18.575 -10.663
    3   3H    MET   1          3HT       MET   1   5.885  19.482  -9.236
    4    HA   MET   1           HA       MET   1   5.452  17.498  -7.925
    5   1HB   MET   1          2HB       MET   1   4.177  16.272  -9.654
    6   2HB   MET   1          1HB       MET   1   5.644  16.103 -10.612
    7   1HG   MET   1          2HG       MET   1   6.645  14.757  -8.833
    8   2HG   MET   1          1HG       MET   1   5.174  14.921  -7.877
    9   1HE   MET   1          1HE       MET   1   5.311  12.754 -11.943
   10   2HE   MET   1          2HE       MET   1   6.739  13.472 -11.199
   11   3HE   MET   1          3HE       MET   1   5.420  14.504 -11.755
   12    HA   PRO   2           HA       PRO   2   9.927  18.041  -8.224
   13   1HB   PRO   2          2HB       PRO   2   9.867  17.676  -5.332
   14   2HB   PRO   2          1HB       PRO   2  10.368  19.090  -6.262
   15   1HG   PRO   2          2HG       PRO   2   8.112  19.043  -4.754
   16   2HG   PRO   2          1HG       PRO   2   8.271  20.024  -6.222
   17   1HD   PRO   2          2HD       PRO   2   6.904  17.386  -5.842
   18   2HD   PRO   2          1HD       PRO   2   6.382  18.798  -6.787
   19    H    THR   3           H        THR   3   8.187  15.720  -6.272
   20    HA   THR   3           HA       THR   3   9.814  13.559  -7.263
   21    HB   THR   3           HB       THR   3  11.165  14.305  -5.352
   22    HG1  THR   3           1HG      THR   3  10.376  12.118  -4.074
   23   1HG2  THR   3          1HG2      THR   3  10.266  14.110  -3.053
   24   2HG2  THR   3          2HG2      THR   3   8.662  13.830  -3.736
   25   3HG2  THR   3          3HG2      THR   3   9.478  15.373  -3.994
   26    H    LYS   4           H        LYS   4   9.011  11.453  -6.229
   27    HA   LYS   4           HA       LYS   4   6.170  11.582  -5.527
   28   1HB   LYS   4          2HB       LYS   4   6.685  11.120  -8.058
   29   2HB   LYS   4          1HB       LYS   4   7.142   9.522  -7.489
   30   1HG   LYS   4          2HG       LYS   4   4.469  10.739  -6.880
   31   2HG   LYS   4          1HG       LYS   4   4.777   9.821  -8.351
   32   1HD   LYS   4          2HD       LYS   4   5.362   7.864  -7.037
   33   2HD   LYS   4          1HD       LYS   4   5.160   8.785  -5.543
   34   1HE   LYS   4          2HE       LYS   4   3.201   7.391  -6.005
   35   2HE   LYS   4          1HE       LYS   4   2.797   9.108  -6.045
   36   1HZ   LYS   4          1HZ       LYS   4   3.033   8.972  -8.517
   37   2HZ   LYS   4          2HZ       LYS   4   1.741   8.083  -7.887
   38   3HZ   LYS   4          3HZ       LYS   4   3.160   7.287  -8.368
   39    H    THR   5           H        THR   5   6.513  10.929  -3.461
   40    HA   THR   5           HA       THR   5   8.393   8.814  -2.859
   41    HB   THR   5           HB       THR   5   6.565   9.961  -0.802
   42    HG1  THR   5           1HG      THR   5   7.505  11.908  -0.866
   43   1HG2  THR   5          1HG2      THR   5   8.606   9.861   0.566
   44   2HG2  THR   5          2HG2      THR   5   9.509   9.288  -0.837
   45   3HG2  THR   5          3HG2      THR   5   8.223   8.295  -0.151
   46    H    TYR   6           H        TYR   6   7.855   6.941  -1.693
   47    HA   TYR   6           HA       TYR   6   5.135   6.114  -1.306
   48   1HB   TYR   6          2HB       TYR   6   6.059   5.630  -3.822
   49   2HB   TYR   6          1HB       TYR   6   6.595   4.168  -3.000
   50    HD1  TYR   6           1HD      TYR   6   3.683   6.147  -4.035
   51    HD2  TYR   6           2HD      TYR   6   4.992   2.535  -2.205
   52    HE1  TYR   6           1HE      TYR   6   1.418   5.224  -4.260
   53    HE2  TYR   6           2HE      TYR   6   2.726   1.598  -2.428
   54    HH   TYR   6           HH       TYR   6   0.403   2.419  -2.661
   55    H    SER   7           H        SER   7   5.166   5.005   0.526
   56    HA   SER   7           HA       SER   7   7.518   4.667   1.981
   57   1HB   SER   7          2HB       SER   7   4.896   3.253   2.478
   58   2HB   SER   7          1HB       SER   7   6.128   3.672   3.669
   59    HG   SER   7           HG       SER   7   5.707   5.903   3.140
   60    H    GLU   8           H        GLU   8   8.884   3.042   2.355
   61    HA   GLU   8           HA       GLU   8   9.087   0.881   0.559
   62   1HB   GLU   8          2HB       GLU   8  10.445   1.511   3.164
   63   2HB   GLU   8          1HB       GLU   8  10.762   0.004   2.322
   64   1HG   GLU   8          2HG       GLU   8  12.470   1.617   1.803
   65   2HG   GLU   8          1HG       GLU   8  11.515   1.273   0.363
   66    H    GLU   9           H        GLU   9   7.459   1.244   3.587
   67    HA   GLU   9           HA       GLU   9   7.262  -1.445   4.351
   68   1HB   GLU   9          2HB       GLU   9   6.643   0.549   5.750
   69   2HB   GLU   9          1HB       GLU   9   5.170   0.683   4.799
   70   1HG   GLU   9          2HG       GLU   9   4.518  -1.569   5.501
   71   2HG   GLU   9          1HG       GLU   9   5.977  -1.675   6.483
   72    H    PHE  10           H        PHE  10   5.303   0.512   2.168
   73    HA   PHE  10           HA       PHE  10   3.265  -1.395   1.705
   74   1HB   PHE  10          2HB       PHE  10   3.208   1.084   1.114
   75   2HB   PHE  10          1HB       PHE  10   4.228   0.690  -0.264
   76    HD1  PHE  10           1HD      PHE  10   3.350  -0.695  -2.101
   77    HD2  PHE  10           2HD      PHE  10   0.882   0.566   1.130
   78    HE1  PHE  10           1HE      PHE  10   1.344  -1.236  -3.421
   79    HE2  PHE  10           2HE      PHE  10  -1.125   0.015  -0.180
   80    HZ   PHE  10           HZ       PHE  10  -0.896  -0.886  -2.461
   81    H    LYS  11           H        LYS  11   6.315  -0.662   0.115
   82    HA   LYS  11           HA       LYS  11   6.132  -2.511  -1.994
   83   1HB   LYS  11          2HB       LYS  11   8.657  -1.588  -0.610
   84   2HB   LYS  11          1HB       LYS  11   8.507  -2.172  -2.262
   85   1HG   LYS  11          2HG       LYS  11   7.342  -0.212  -2.938
   86   2HG   LYS  11          1HG       LYS  11   7.158   0.327  -1.267
   87   1HD   LYS  11          2HD       LYS  11   9.621   0.514  -1.103
   88   2HD   LYS  11          1HD       LYS  11   9.739   0.080  -2.806
   89   1HE   LYS  11          2HE       LYS  11   8.593   2.055  -3.469
   90   2HE   LYS  11          1HE       LYS  11   8.167   2.440  -1.802
   91   1HZ   LYS  11          1HZ       LYS  11  10.984   2.272  -2.702
   92   2HZ   LYS  11          2HZ       LYS  11  10.378   2.998  -1.293
   93   3HZ   LYS  11          3HZ       LYS  11  10.093   3.705  -2.803
   94    H    ARG  12           H        ARG  12   7.591  -2.731   1.225
   95    HA   ARG  12           HA       ARG  12   8.587  -5.333   1.105
   96   1HB   ARG  12          2HB       ARG  12   9.124  -3.774   2.915
   97   2HB   ARG  12          1HB       ARG  12   7.457  -3.823   3.469
   98   1HG   ARG  12          2HG       ARG  12   7.766  -6.272   3.896
   99   2HG   ARG  12          1HG       ARG  12   9.482  -6.045   3.551
  100   1HD   ARG  12          2HD       ARG  12   9.607  -4.376   5.351
  101   2HD   ARG  12          1HD       ARG  12   7.901  -4.643   5.706
  102    HE   ARG  12           HE       ARG  12   9.888  -6.817   5.928
  103   1HH1  ARG  12          1HH1      ARG  12   7.221  -4.941   7.235
  104   2HH1  ARG  12          2HH1      ARG  12   7.185  -5.810   8.737
  105   1HH2  ARG  12          1HH2      ARG  12   9.805  -7.974   7.933
  106   2HH2  ARG  12          2HH2      ARG  12   8.630  -7.515   9.132
  107    H    ASP  13           H        ASP  13   5.414  -4.162   2.180
  108    HA   ASP  13           HA       ASP  13   4.364  -6.694   2.870
  109   1HB   ASP  13          2HB       ASP  13   3.399  -4.584   3.678
  110   2HB   ASP  13          1HB       ASP  13   2.906  -4.178   2.036
  111    H    ALA  14           H        ALA  14   4.410  -4.853  -0.128
  112    HA   ALA  14           HA       ALA  14   2.622  -6.441  -1.610
  113   1HB   ALA  14          1HB       ALA  14   3.324  -4.234  -2.352
  114   2HB   ALA  14          2HB       ALA  14   3.683  -5.441  -3.587
  115   3HB   ALA  14          3HB       ALA  14   4.977  -4.811  -2.567
  116    H    VAL  15           H        VAL  15   6.105  -6.742  -1.022
  117    HA   VAL  15           HA       VAL  15   6.477  -8.962  -2.764
  118    HB   VAL  15           HB       VAL  15   8.136  -8.300  -0.320
  119   1HG1  VAL  15          1HG1      VAL  15   8.588 -10.500  -1.229
  120   2HG1  VAL  15          2HG1      VAL  15   9.938  -9.415  -1.562
  121   3HG1  VAL  15          3HG1      VAL  15   8.791  -9.818  -2.841
  122   1HG2  VAL  15          1HG2      VAL  15   8.016  -6.319  -1.664
  123   2HG2  VAL  15          2HG2      VAL  15   8.345  -7.239  -3.130
  124   3HG2  VAL  15          3HG2      VAL  15   9.597  -7.065  -1.901
  125    H    ALA  16           H        ALA  16   5.519  -8.605   0.590
  126    HA   ALA  16           HA       ALA  16   5.578 -11.389   1.223
  127   1HB   ALA  16          1HB       ALA  16   4.089  -9.127   2.544
  128   2HB   ALA  16          2HB       ALA  16   5.695  -9.715   2.972
  129   3HB   ALA  16          3HB       ALA  16   4.288 -10.750   3.211
  130    H    LEU  17           H        LEU  17   3.241  -9.219  -0.194
  131    HA   LEU  17           HA       LEU  17   0.957 -10.845  -0.023
  132   1HB   LEU  17          2HB       LEU  17   1.763  -8.762  -2.048
  133   2HB   LEU  17          1HB       LEU  17   0.192  -9.538  -2.043
  134    HG   LEU  17           HG       LEU  17   1.316  -7.832   0.181
  135   1HD1  LEU  17          1HD1      LEU  17  -0.413  -6.238  -0.492
  136   2HD1  LEU  17          2HD1      LEU  17  -0.854  -7.288  -1.837
  137   3HD1  LEU  17          3HD1      LEU  17   0.739  -6.534  -1.795
  138   1HD2  LEU  17          1HD2      LEU  17  -0.913  -8.011   1.158
  139   2HD2  LEU  17          2HD2      LEU  17  -0.155  -9.597   1.011
  140   3HD2  LEU  17          3HD2      LEU  17  -1.398  -9.105  -0.139
  141    H    TYR  18           H        TYR  18   3.716 -10.911  -2.136
  142    HA   TYR  18           HA       TYR  18   2.710 -12.613  -4.138
  143   1HB   TYR  18          2HB       TYR  18   4.840 -11.346  -4.295
  144   2HB   TYR  18          1HB       TYR  18   5.542 -12.419  -3.092
  145    HD1  TYR  18           1HD      TYR  18   6.357 -14.591  -3.702
  146    HD2  TYR  18           2HD      TYR  18   4.260 -12.219  -6.551
  147    HE1  TYR  18           1HE      TYR  18   7.074 -16.117  -5.496
  148    HE2  TYR  18           2HE      TYR  18   4.966 -13.742  -8.348
  149    HH   TYR  18           HH       TYR  18   6.163 -16.774  -7.825
  150    H    GLU  19           H        GLU  19   3.947 -13.217  -0.914
  151    HA   GLU  19           HA       GLU  19   3.991 -16.079  -1.233
  152   1HB   GLU  19          2HB       GLU  19   4.159 -14.376   1.259
  153   2HB   GLU  19          1HB       GLU  19   4.376 -16.121   1.220
  154   1HG   GLU  19          2HG       GLU  19   6.252 -15.671  -0.450
  155   2HG   GLU  19          1HG       GLU  19   6.135 -13.988   0.066
  156    H    ASN  20           H        ASN  20   1.610 -13.736  -0.581
  157    HA   ASN  20           HA       ASN  20  -0.178 -15.599   0.790
  158   1HB   ASN  20          2HB       ASN  20  -0.296 -12.660   0.173
  159   2HB   ASN  20          1HB       ASN  20  -1.750 -13.533   0.635
  160   1HD2  ASN  20          1HD2      ASN  20   1.343 -12.350   1.683
  161   2HD2  ASN  20          2HD2      ASN  20   1.058 -12.555   3.381
  162    H    SER  21           H        SER  21   0.702 -15.631  -2.158
  163    HA   SER  21           HA       SER  21  -1.574 -15.003  -3.726
  164   1HB   SER  21          2HB       SER  21  -0.318 -16.437  -5.448
  165   2HB   SER  21          1HB       SER  21   0.462 -14.969  -4.863
  166    HG   SER  21           HG       SER  21   1.946 -16.109  -3.893
  167    H    ASP  22           H        ASP  22  -0.839 -17.636  -1.741
  168    HA   ASP  22           HA       ASP  22  -2.080 -19.798  -2.926
  169   1HB   ASP  22          2HB       ASP  22  -2.050 -18.995  -0.015
  170   2HB   ASP  22          1HB       ASP  22  -2.652 -20.544  -0.590
  171    H    GLY  23           H        GLY  23  -3.521 -16.981  -1.489
  172   1HA   GLY  23          2HA       GLY  23  -6.198 -18.165  -1.784
  173   2HA   GLY  23          1HA       GLY  23  -5.806 -16.771  -0.791
  174    H    ALA  24           H        ALA  24  -4.097 -16.067  -3.405
  175    HA   ALA  24           HA       ALA  24  -6.192 -15.135  -5.148
  176   1HB   ALA  24          1HB       ALA  24  -6.399 -13.488  -3.371
  177   2HB   ALA  24          2HB       ALA  24  -5.725 -12.740  -4.820
  178   3HB   ALA  24          3HB       ALA  24  -4.672 -13.143  -3.465
  179    H    SER  25           H        SER  25  -5.415 -15.028  -7.132
  180    HA   SER  25           HA       SER  25  -2.742 -15.644  -7.745
  181   1HB   SER  25          2HB       SER  25  -4.626 -16.114  -9.263
  182   2HB   SER  25          1HB       SER  25  -4.861 -14.384  -9.507
  183    HG   SER  25           HG       SER  25  -2.966 -16.098 -10.567
  184    H    LEU  26           H        LEU  26  -1.217 -14.335  -8.967
  185    HA   LEU  26           HA       LEU  26  -0.517 -11.950  -7.703
  186   1HB   LEU  26          2HB       LEU  26   0.902 -13.550  -9.109
  187   2HB   LEU  26          1HB       LEU  26   0.288 -12.705 -10.513
  188    HG   LEU  26           HG       LEU  26   1.722 -11.225  -8.320
  189   1HD1  LEU  26          1HD1      LEU  26   3.205 -13.023  -9.021
  190   2HD1  LEU  26          2HD1      LEU  26   3.782 -11.470  -9.624
  191   3HD1  LEU  26          3HD1      LEU  26   2.958 -12.584 -10.714
  192   1HD2  LEU  26          1HD2      LEU  26   0.492  -9.888  -9.954
  193   2HD2  LEU  26          2HD2      LEU  26   1.368 -10.681 -11.264
  194   3HD2  LEU  26          3HD2      LEU  26   2.234  -9.661 -10.116
  195    H    GLN  27           H        GLN  27  -2.406 -12.539 -10.617
  196    HA   GLN  27           HA       GLN  27  -2.581  -9.876 -11.529
  197   1HB   GLN  27          2HB       GLN  27  -3.257 -12.002 -12.770
  198   2HB   GLN  27          1HB       GLN  27  -4.747 -11.958 -11.839
  199   1HG   GLN  27          2HG       GLN  27  -5.129 -10.986 -13.998
  200   2HG   GLN  27          1HG       GLN  27  -5.217  -9.719 -12.772
  201   1HE2  GLN  27          1HE2      GLN  27  -4.773  -8.116 -14.304
  202   2HE2  GLN  27          2HE2      GLN  27  -3.179  -7.894 -14.950
  203    H    GLN  28           H        GLN  28  -4.398 -11.709  -9.158
  204    HA   GLN  28           HA       GLN  28  -6.422  -9.737  -8.763
  205   1HB   GLN  28          2HB       GLN  28  -6.744 -12.144  -8.227
  206   2HB   GLN  28          1HB       GLN  28  -5.565 -11.987  -6.932
  207   1HG   GLN  28          2HG       GLN  28  -7.823 -11.933  -6.060
  208   2HG   GLN  28          1HG       GLN  28  -7.011 -10.390  -5.795
  209   1HE2  GLN  28          1HE2      GLN  28  -7.730  -8.570  -6.847
  210   2HE2  GLN  28          2HE2      GLN  28  -9.232  -8.517  -7.711
  211    H    ILE  29           H        ILE  29  -3.368 -10.563  -7.194
  212    HA   ILE  29           HA       ILE  29  -3.444  -8.826  -5.017
  213    HB   ILE  29           HB       ILE  29  -1.031  -9.547  -6.689
  214   1HG1  ILE  29          2HG1      ILE  29  -2.285 -11.510  -5.793
  215   2HG1  ILE  29          1HG1      ILE  29  -0.658 -11.365  -5.136
  216   1HG2  ILE  29          1HG2      ILE  29   0.283  -9.018  -4.709
  217   2HG2  ILE  29          2HG2      ILE  29  -1.183  -8.565  -3.841
  218   3HG2  ILE  29          3HG2      ILE  29  -0.652  -7.616  -5.229
  219   1HD1  ILE  29          1HD1      ILE  29  -1.563 -10.420  -3.089
  220   2HD1  ILE  29          2HD1      ILE  29  -2.266 -12.000  -3.434
  221   3HD1  ILE  29          3HD1      ILE  29  -3.194 -10.534  -3.750
  222    H    ALA  30           H        ALA  30  -2.162  -8.263  -8.287
  223    HA   ALA  30           HA       ALA  30  -1.446  -5.572  -7.915
  224   1HB   ALA  30          1HB       ALA  30  -1.346  -5.437 -10.345
  225   2HB   ALA  30          2HB       ALA  30  -2.234  -6.954 -10.477
  226   3HB   ALA  30          3HB       ALA  30  -0.621  -6.938  -9.767
  227    H    ASN  31           H        ASN  31  -4.461  -7.038  -9.071
  228    HA   ASN  31           HA       ASN  31  -5.735  -4.601  -9.724
  229   1HB   ASN  31          2HB       ASN  31  -6.570  -7.424  -9.370
  230   2HB   ASN  31          1HB       ASN  31  -7.824  -6.202  -9.257
  231   1HD2  ASN  31          1HD2      ASN  31  -5.559  -7.802 -11.331
  232   2HD2  ASN  31          2HD2      ASN  31  -6.170  -7.160 -12.823
  233    H    ASP  32           H        ASP  32  -5.572  -6.525  -6.782
  234    HA   ASP  32           HA       ASP  32  -7.564  -5.159  -5.335
  235   1HB   ASP  32          2HB       ASP  32  -6.664  -7.344  -4.647
  236   2HB   ASP  32          1HB       ASP  32  -5.110  -6.594  -4.299
  237    H    LEU  33           H        LEU  33  -4.100  -4.637  -5.682
  238    HA   LEU  33           HA       LEU  33  -4.029  -2.412  -3.901
  239   1HB   LEU  33          2HB       LEU  33  -2.074  -3.340  -5.999
  240   2HB   LEU  33          1HB       LEU  33  -1.754  -2.085  -4.826
  241    HG   LEU  33           HG       LEU  33  -2.263  -4.991  -4.215
  242   1HD1  LEU  33          1HD1      LEU  33   0.066  -4.996  -3.482
  243   2HD1  LEU  33          2HD1      LEU  33   0.233  -3.318  -3.997
  244   3HD1  LEU  33          3HD1      LEU  33  -0.072  -4.580  -5.189
  245   1HD2  LEU  33          1HD2      LEU  33  -1.751  -4.417  -1.906
  246   2HD2  LEU  33          2HD2      LEU  33  -3.167  -3.532  -2.474
  247   3HD2  LEU  33          3HD2      LEU  33  -1.608  -2.715  -2.350
  248    H    GLY  34           H        GLY  34  -4.340  -2.851  -7.362
  249   1HA   GLY  34          2HA       GLY  34  -5.487  -1.300  -8.757
  250   2HA   GLY  34          1HA       GLY  34  -5.108  -0.025  -7.606
  251    H    ILE  35           H        ILE  35  -2.688  -2.290  -8.603
  252    HA   ILE  35           HA       ILE  35  -1.398  -0.174 -10.192
  253    HB   ILE  35           HB       ILE  35   0.778  -1.024  -9.398
  254   1HG1  ILE  35          2HG1      ILE  35  -0.862  -2.696  -7.476
  255   2HG1  ILE  35          1HG1      ILE  35   0.030  -3.323  -8.858
  256   1HG2  ILE  35          1HG2      ILE  35  -0.214   0.887  -8.299
  257   2HG2  ILE  35          2HG2      ILE  35   0.657  -0.105  -7.132
  258   3HG2  ILE  35          3HG2      ILE  35  -1.103  -0.175  -7.205
  259   1HD1  ILE  35          1HD1      ILE  35   1.223  -1.952  -6.455
  260   2HD1  ILE  35          2HD1      ILE  35   2.120  -2.568  -7.842
  261   3HD1  ILE  35          3HD1      ILE  35   1.250  -3.684  -6.793
  262    H    ASN  36           H        ASN  36   0.480  -1.199 -11.522
  263    HA   ASN  36           HA       ASN  36  -0.597  -3.319 -13.123
  264   1HB   ASN  36          2HB       ASN  36   0.631  -1.452 -14.118
  265   2HB   ASN  36          1HB       ASN  36   2.053  -1.873 -13.183
  266   1HD2  ASN  36          1HD2      ASN  36   3.252  -2.058 -15.024
  267   2HD2  ASN  36          2HD2      ASN  36   3.111  -3.410 -16.083
  268    H    ARG  37           H        ARG  37   0.243  -5.411 -13.316
  269    HA   ARG  37           HA       ARG  37   1.293  -6.558 -10.969
  270   1HB   ARG  37          2HB       ARG  37   1.480  -8.602 -12.393
  271   2HB   ARG  37          1HB       ARG  37  -0.109  -7.878 -12.336
  272   1HG   ARG  37          2HG       ARG  37   0.178  -6.945 -14.527
  273   2HG   ARG  37          1HG       ARG  37   1.858  -7.491 -14.577
  274   1HD   ARG  37          2HD       ARG  37   1.208  -9.769 -14.623
  275   2HD   ARG  37          1HD       ARG  37  -0.463  -9.373 -14.229
  276    HE   ARG  37           HE       ARG  37  -0.430  -8.207 -16.499
  277   1HH1  ARG  37          1HH1      ARG  37   1.457 -11.052 -15.729
  278   2HH1  ARG  37          2HH1      ARG  37   1.434 -11.674 -17.345
  279   1HH2  ARG  37          1HH2      ARG  37  -0.500  -9.051 -18.648
  280   2HH2  ARG  37          2HH2      ARG  37   0.346 -10.536 -19.000
  281    H    VAL  38           H        VAL  38   2.740  -5.444 -13.935
  282    HA   VAL  38           HA       VAL  38   5.314  -6.557 -13.514
  283    HB   VAL  38           HB       VAL  38   4.582  -4.058 -15.061
  284   1HG1  VAL  38          1HG1      VAL  38   6.687  -4.449 -16.269
  285   2HG1  VAL  38          2HG1      VAL  38   7.051  -5.794 -15.186
  286   3HG1  VAL  38          3HG1      VAL  38   6.966  -4.152 -14.552
  287   1HG2  VAL  38          1HG2      VAL  38   4.591  -5.512 -17.032
  288   2HG2  VAL  38          2HG2      VAL  38   3.381  -6.040 -15.861
  289   3HG2  VAL  38          3HG2      VAL  38   4.907  -6.911 -16.006
  290    H    THR  39           H        THR  39   3.872  -3.416 -12.657
  291    HA   THR  39           HA       THR  39   6.152  -2.309 -11.440
  292    HB   THR  39           HB       THR  39   3.316  -1.820 -10.529
  293    HG1  THR  39           1HG      THR  39   4.006  -0.031 -12.353
  294   1HG2  THR  39          1HG2      THR  39   4.117   0.437 -10.090
  295   2HG2  THR  39          2HG2      THR  39   5.713   0.012 -10.709
  296   3HG2  THR  39          3HG2      THR  39   5.111  -0.736  -9.229
  297    H    LEU  40           H        LEU  40   3.604  -4.397 -10.180
  298    HA   LEU  40           HA       LEU  40   4.427  -4.487  -7.497
  299   1HB   LEU  40          2HB       LEU  40   2.278  -5.342  -8.292
  300   2HB   LEU  40          1HB       LEU  40   3.097  -6.594  -9.205
  301    HG   LEU  40           HG       LEU  40   3.945  -7.521  -7.039
  302   1HD1  LEU  40          1HD1      LEU  40   2.002  -5.540  -5.861
  303   2HD1  LEU  40          2HD1      LEU  40   3.755  -5.524  -5.673
  304   3HD1  LEU  40          3HD1      LEU  40   2.805  -6.839  -4.979
  305   1HD2  LEU  40          1HD2      LEU  40   0.949  -7.349  -7.351
  306   2HD2  LEU  40          2HD2      LEU  40   1.828  -8.577  -6.440
  307   3HD2  LEU  40          3HD2      LEU  40   2.015  -8.476  -8.191
  308    H    LYS  41           H        LYS  41   5.273  -6.487 -10.284
  309    HA   LYS  41           HA       LYS  41   6.954  -8.330  -9.048
  310   1HB   LYS  41          2HB       LYS  41   6.131  -8.498 -11.368
  311   2HB   LYS  41          1HB       LYS  41   7.179  -7.172 -11.829
  312   1HG   LYS  41          2HG       LYS  41   9.130  -8.510 -11.181
  313   2HG   LYS  41          1HG       LYS  41   8.057  -9.856 -10.798
  314   1HD   LYS  41          2HD       LYS  41   7.350 -10.019 -13.091
  315   2HD   LYS  41          1HD       LYS  41   8.242  -8.557 -13.515
  316   1HE   LYS  41          2HE       LYS  41  10.341  -9.668 -12.983
  317   2HE   LYS  41          1HE       LYS  41   9.467 -11.120 -12.504
  318   1HZ   LYS  41          1HZ       LYS  41  10.484 -10.993 -14.839
  319   2HZ   LYS  41          2HZ       LYS  41   9.149 -10.013 -15.222
  320   3HZ   LYS  41          3HZ       LYS  41   8.908 -11.603 -14.675
  321    H    ASN  42           H        ASN  42   7.655  -5.181 -10.450
  322    HA   ASN  42           HA       ASN  42  10.411  -5.144 -10.335
  323   1HB   ASN  42          2HB       ASN  42   8.365  -2.970 -10.033
  324   2HB   ASN  42          1HB       ASN  42  10.075  -2.600  -9.886
  325   1HD2  ASN  42          1HD2      ASN  42   9.981  -1.283 -11.721
  326   2HD2  ASN  42          2HD2      ASN  42   9.873  -1.943 -13.316
  327    H    TRP  43           H        TRP  43   8.148  -4.255  -7.732
  328    HA   TRP  43           HA       TRP  43  10.193  -3.643  -5.853
  329   1HB   TRP  43          2HB       TRP  43   7.311  -4.446  -5.412
  330   2HB   TRP  43          1HB       TRP  43   8.388  -3.881  -4.140
  331    HD1  TRP  43           HD       TRP  43   9.649  -1.540  -6.190
  332    HE1  TRP  43           1HE      TRP  43   8.249   0.605  -6.454
  333    HE3  TRP  43           3HE      TRP  43   5.137  -3.321  -4.589
  334    HZ2  TRP  43           2HZ      TRP  43   5.578   1.431  -6.036
  335    HZ3  TRP  43           3HZ      TRP  43   3.210  -1.793  -4.545
  336    HH2  TRP  43           HH       TRP  43   3.426   0.538  -5.252
  337    H    ILE  44           H        ILE  44   8.352  -6.568  -6.557
  338    HA   ILE  44           HA       ILE  44   9.283  -8.141  -4.427
  339    HB   ILE  44           HB       ILE  44   8.413  -9.030  -7.178
  340   1HG1  ILE  44          2HG1      ILE  44   6.825  -8.845  -4.604
  341   2HG1  ILE  44          1HG1      ILE  44   6.745  -7.670  -5.911
  342   1HG2  ILE  44          1HG2      ILE  44   9.648 -10.783  -6.036
  343   2HG2  ILE  44          2HG2      ILE  44   7.935 -11.194  -6.125
  344   3HG2  ILE  44          3HG2      ILE  44   8.624 -10.602  -4.612
  345   1HD1  ILE  44          1HD1      ILE  44   5.906  -9.402  -7.414
  346   2HD1  ILE  44          2HD1      ILE  44   4.873  -9.191  -6.000
  347   3HD1  ILE  44          3HD1      ILE  44   5.970 -10.567  -6.091
  348    H    ILE  45           H        ILE  45  10.611  -7.526  -7.627
  349    HA   ILE  45           HA       ILE  45  12.663  -9.447  -7.584
  350    HB   ILE  45           HB       ILE  45  12.612  -6.771  -8.992
  351   1HG1  ILE  45          2HG1      ILE  45  11.995  -9.547 -10.028
  352   2HG1  ILE  45          1HG1      ILE  45  10.781  -8.346  -9.609
  353   1HG2  ILE  45          1HG2      ILE  45  14.336  -7.749 -10.464
  354   2HG2  ILE  45          2HG2      ILE  45  14.407  -9.159  -9.407
  355   3HG2  ILE  45          3HG2      ILE  45  14.889  -7.577  -8.798
  356   1HD1  ILE  45          1HD1      ILE  45  11.659  -6.864 -11.347
  357   2HD1  ILE  45          2HD1      ILE  45  11.128  -8.416 -11.995
  358   3HD1  ILE  45          3HD1      ILE  45  12.847  -8.095 -11.777
  359    H    LYS  46           H        LYS  46  12.736  -5.987  -6.713
  360    HA   LYS  46           HA       LYS  46  15.521  -6.090  -6.048
  361   1HB   LYS  46          2HB       LYS  46  14.382  -4.060  -6.940
  362   2HB   LYS  46          1HB       LYS  46  13.530  -3.912  -5.409
  363   1HG   LYS  46          2HG       LYS  46  15.675  -3.681  -4.247
  364   2HG   LYS  46          1HG       LYS  46  16.514  -3.785  -5.793
  365   1HD   LYS  46          2HD       LYS  46  15.283  -1.769  -6.542
  366   2HD   LYS  46          1HD       LYS  46  14.573  -1.643  -4.932
  367   1HE   LYS  46          2HE       LYS  46  17.525  -1.576  -5.550
  368   2HE   LYS  46          1HE       LYS  46  16.523  -0.164  -5.223
  369   1HZ   LYS  46          1HZ       LYS  46  17.884  -1.108  -3.320
  370   2HZ   LYS  46          2HZ       LYS  46  16.758  -2.380  -3.270
  371   3HZ   LYS  46          3HZ       LYS  46  16.252  -0.786  -3.009
  372    H    TYR  47           H        TYR  47  12.544  -5.764  -4.118
  373    HA   TYR  47           HA       TYR  47  14.071  -5.641  -1.676
  374   1HB   TYR  47          2HB       TYR  47  11.092  -5.749  -2.188
  375   2HB   TYR  47          1HB       TYR  47  11.810  -5.594  -0.587
  376    HD1  TYR  47           1HD      TYR  47  12.560  -3.482   0.211
  377    HD2  TYR  47           2HD      TYR  47  11.456  -3.917  -3.873
  378    HE1  TYR  47           1HE      TYR  47  12.677  -1.041  -0.076
  379    HE2  TYR  47           2HE      TYR  47  11.574  -1.480  -4.172
  380    HH   TYR  47           HH       TYR  47  12.986   0.606  -1.853
  381    H    GLY  48           H        GLY  48  12.665  -8.089  -3.608
  382   1HA   GLY  48          2HA       GLY  48  13.042 -10.044  -1.444
  383   2HA   GLY  48          1HA       GLY  48  12.073 -10.306  -2.884
  384    H    SER  49           H        SER  49  15.242  -8.827  -3.112
  385    HA   SER  49           HA       SER  49  16.240 -10.945  -4.751
  386   1HB   SER  49          2HB       SER  49  17.796  -8.717  -3.409
  387   2HB   SER  49          1HB       SER  49  18.347  -9.713  -4.753
  388    HG   SER  49           HG       SER  49  16.027  -8.655  -5.465
  389    H    ASN  50           H        ASN  50  16.994  -9.795  -1.511
  390    HA   ASN  50           HA       ASN  50  17.649 -12.505  -0.668
  391   1HB   ASN  50          2HB       ASN  50  19.825 -11.525  -1.319
  392   2HB   ASN  50          1HB       ASN  50  19.523 -10.149  -0.265
  393   1HD2  ASN  50          1HD2      ASN  50  21.262 -10.469   1.047
  394   2HD2  ASN  50          2HD2      ASN  50  21.414 -11.817   2.115
  395    H    HIS  51           H        HIS  51  17.564  -9.096   0.284
  396    HA   HIS  51           HA       HIS  51  15.399  -9.503   2.092
  397   1HB   HIS  51          2HB       HIS  51  17.497 -10.330   3.364
  398   2HB   HIS  51          1HB       HIS  51  17.947  -8.631   3.448
  399    HD1  HIS  51           1HD      HIS  51  15.605 -11.141   4.856
  400    HD2  HIS  51           2HD      HIS  51  16.314  -7.051   5.144
  401    HE1  HIS  51           1HE      HIS  51  14.298 -10.366   6.860
  402    HE2  HIS  51           2HE      HIS  51  14.946  -7.944   7.150
  403    H    ASN  52           H        ASN  52  17.895  -7.585   0.690
  404    HA   ASN  52           HA       ASN  52  18.072  -5.453   0.023
  405   1HB   ASN  52          2HB       ASN  52  15.882  -5.830  -0.998
  406   2HB   ASN  52          1HB       ASN  52  15.100  -5.373   0.508
  407   1HD2  ASN  52          1HD2      ASN  52  15.136  -3.197   1.155
  408   2HD2  ASN  52          2HD2      ASN  52  15.474  -1.924   0.036
  409    H    VAL  53           H        VAL  53  19.349  -4.644   1.586
  410    HA   VAL  53           HA       VAL  53  18.259  -3.628   4.064
  411    HB   VAL  53           HB       VAL  53  21.042  -3.298   2.918
  412   1HG1  VAL  53          1HG1      VAL  53  21.684  -2.770   5.229
  413   2HG1  VAL  53          2HG1      VAL  53  19.995  -2.890   5.723
  414   3HG1  VAL  53          3HG1      VAL  53  20.500  -1.618   4.611
  415   1HG2  VAL  53          1HG2      VAL  53  21.672  -5.113   4.453
  416   2HG2  VAL  53          2HG2      VAL  53  20.503  -5.652   3.246
  417   3HG2  VAL  53          3HG2      VAL  53  19.978  -5.317   4.897
  418    H    GLN  54           H        GLN  54  19.483  -2.394   1.004
  419    HA   GLN  54           HA       GLN  54  19.100   0.366   1.794
  420   1HB   GLN  54          2HB       GLN  54  19.855  -0.823  -0.883
  421   2HB   GLN  54          1HB       GLN  54  19.877   0.888  -0.482
  422   1HG   GLN  54          2HG       GLN  54  21.569  -1.234   0.818
  423   2HG   GLN  54          1HG       GLN  54  22.108  -0.108  -0.426
  424   1HE2  GLN  54          1HE2      GLN  54  23.093  -0.489   2.285
  425   2HE2  GLN  54          2HE2      GLN  54  22.958   1.050   3.068
  426    H    GLY  55           H        GLY  55  16.943   0.721   2.115
  427   1HA   GLY  55          2HA       GLY  55  14.853  -0.196   0.472
  428   2HA   GLY  55          1HA       GLY  55  14.757   1.180   1.557
  429    H    THR  56           H        THR  56  17.022   2.452   0.166
  430    HA   THR  56           HA       THR  56  17.527   3.808  -1.587
  431    HB   THR  56           HB       THR  56  15.258   2.716  -3.174
  432    HG1  THR  56           1HG      THR  56  17.237   1.277  -2.157
  433   1HG2  THR  56          1HG2      THR  56  17.974   3.763  -3.947
  434   2HG2  THR  56          2HG2      THR  56  16.451   4.640  -4.089
  435   3HG2  THR  56          3HG2      THR  56  16.732   3.200  -5.067
  436    H    THR  57           H        THR  57  17.101   5.804  -1.117
  437    HA   THR  57           HA       THR  57  14.487   6.957  -1.553
  438    HB   THR  57           HB       THR  57  15.735   7.199   1.197
  439    HG1  THR  57           1HG      THR  57  13.796   5.414   0.162
  440   1HG2  THR  57          1HG2      THR  57  13.027   8.000   0.120
  441   2HG2  THR  57          2HG2      THR  57  14.346   9.095   0.527
  442   3HG2  THR  57          3HG2      THR  57  13.555   8.163   1.797
  443    HA   PRO  58           HA       PRO  58  17.681   9.999  -2.659
  444   1HB   PRO  58          2HB       PRO  58  15.586  11.223  -4.271
  445   2HB   PRO  58          1HB       PRO  58  17.092  10.466  -4.796
  446   1HG   PRO  58          2HG       PRO  58  14.650   9.375  -5.272
  447   2HG   PRO  58          1HG       PRO  58  16.121   8.407  -5.065
  448   1HD   PRO  58          2HD       PRO  58  13.938   8.980  -3.091
  449   2HD   PRO  58          1HD       PRO  58  14.794   7.457  -3.410
  450    H    SER  59           H        SER  59  17.749  11.035  -0.656
  451    HA   SER  59           HA       SER  59  15.497  12.703   0.133
  452   1HB   SER  59          2HB       SER  59  18.116  12.212   1.572
  453   2HB   SER  59          1HB       SER  59  16.651  12.923   2.255
  454    HG   SER  59           HG       SER  59  16.838  10.291   1.194
  455    H    ALA  60           H        ALA  60  18.988  13.092  -0.449
  456    HA   ALA  60           HA       ALA  60  18.839  15.950  -0.223
  457   1HB   ALA  60          1HB       ALA  60  20.833  14.697   0.461
  458   2HB   ALA  60          2HB       ALA  60  21.208  15.932  -0.740
  459   3HB   ALA  60          3HB       ALA  60  21.112  14.237  -1.217
  460    H    ALA  61           H        ALA  61  18.381  13.691  -2.734
  461    HA   ALA  61           HA       ALA  61  19.292  15.310  -4.901
  462   1HB   ALA  61          1HB       ALA  61  18.354  13.599  -6.337
  463   2HB   ALA  61          2HB       ALA  61  17.500  12.892  -4.965
  464   3HB   ALA  61          3HB       ALA  61  19.264  12.862  -5.017
  465    H    VAL  62           H        VAL  62  16.664  15.616  -2.966
  466    HA   VAL  62           HA       VAL  62  14.660  16.264  -4.892
  467    HB   VAL  62           HB       VAL  62  14.801  16.978  -1.958
  468   1HG1  VAL  62          1HG1      VAL  62  13.276  18.455  -3.146
  469   2HG1  VAL  62          2HG1      VAL  62  12.376  17.326  -2.133
  470   3HG1  VAL  62          3HG1      VAL  62  12.470  17.067  -3.875
  471   1HG2  VAL  62          1HG2      VAL  62  14.805  14.579  -2.315
  472   2HG2  VAL  62          2HG2      VAL  62  13.409  14.714  -3.384
  473   3HG2  VAL  62          3HG2      VAL  62  13.246  15.095  -1.671
  474    H    SER  63           H        SER  63  16.871  18.144  -2.891
  475    HA   SER  63           HA       SER  63  15.921  20.669  -3.839
  476   1HB   SER  63          2HB       SER  63  18.470  19.987  -2.347
  477   2HB   SER  63          1HB       SER  63  17.800  21.606  -2.563
  478    HG   SER  63           HG       SER  63  15.822  20.554  -1.544
  479    H    GLU  64           H        GLU  64  18.491  18.463  -4.722
  480    HA   GLU  64           HA       GLU  64  19.854  20.269  -6.439
  481   1HB   GLU  64          2HB       GLU  64  20.965  18.296  -5.501
  482   2HB   GLU  64          1HB       GLU  64  19.873  17.246  -6.395
  483   1HG   GLU  64          2HG       GLU  64  20.789  17.997  -8.491
  484   2HG   GLU  64          1HG       GLU  64  21.798  19.181  -7.665
  485    H    ALA  65           H        ALA  65  17.157  18.136  -6.796
  486    HA   ALA  65           HA       ALA  65  17.066  17.815  -9.561
  487   1HB   ALA  65          1HB       ALA  65  14.690  17.309  -9.260
  488   2HB   ALA  65          2HB       ALA  65  14.758  17.975  -7.627
  489   3HB   ALA  65          3HB       ALA  65  15.686  16.531  -8.029
  490    H    GLU  66           H        GLU  66  16.190  20.546  -7.585
  491    HA   GLU  66           HA       GLU  66  14.527  21.959  -9.337
  492   1HB   GLU  66          2HB       GLU  66  14.965  22.590  -6.971
  493   2HB   GLU  66          1HB       GLU  66  16.590  23.081  -7.425
  494   1HG   GLU  66          2HG       GLU  66  15.286  25.046  -7.272
  495   2HG   GLU  66          1HG       GLU  66  15.560  24.739  -8.986
  496    H    GLN  67           H        GLN  67  18.041  22.000  -8.974
  497    HA   GLN  67           HA       GLN  67  18.420  23.860 -11.130
  498   1HB   GLN  67          2HB       GLN  67  20.422  22.185  -9.601
  499   2HB   GLN  67          1HB       GLN  67  20.817  23.511 -10.691
  500   1HG   GLN  67          2HG       GLN  67  19.771  25.098  -9.243
  501   2HG   GLN  67          1HG       GLN  67  19.130  23.815  -8.221
  502   1HE2  GLN  67          1HE2      GLN  67  20.100  24.605  -6.392
  503   2HE2  GLN  67          2HE2      GLN  67  21.805  24.523  -6.119
  504    H    ILE  68           H        ILE  68  18.549  20.405 -10.676
  505    HA   ILE  68           HA       ILE  68  19.867  19.755 -13.090
  506    HB   ILE  68           HB       ILE  68  17.966  18.118 -11.405
  507   1HG1  ILE  68          2HG1      ILE  68  20.005  18.763 -10.235
  508   2HG1  ILE  68          1HG1      ILE  68  20.034  17.041 -10.597
  509   1HG2  ILE  68          1HG2      ILE  68  19.772  17.232 -13.652
  510   2HG2  ILE  68          2HG2      ILE  68  18.009  17.244 -13.670
  511   3HG2  ILE  68          3HG2      ILE  68  18.871  16.158 -12.581
  512   1HD1  ILE  68          1HD1      ILE  68  22.201  18.070 -10.962
  513   2HD1  ILE  68          2HD1      ILE  68  21.487  19.187 -12.127
  514   3HD1  ILE  68          3HD1      ILE  68  21.528  17.457 -12.472
  515    H    ARG  69           H        ARG  69  16.464  20.201 -12.249
  516    HA   ARG  69           HA       ARG  69  15.264  19.131 -14.512
  517   1HB   ARG  69          2HB       ARG  69  13.989  19.725 -12.558
  518   2HB   ARG  69          1HB       ARG  69  14.393  21.422 -12.756
  519   1HG   ARG  69          2HG       ARG  69  12.956  21.680 -14.567
  520   2HG   ARG  69          1HG       ARG  69  12.881  19.942 -14.869
  521   1HD   ARG  69          2HD       ARG  69  11.793  21.274 -12.395
  522   2HD   ARG  69          1HD       ARG  69  10.824  20.904 -13.823
  523    HE   ARG  69           HE       ARG  69  11.873  18.506 -13.283
  524   1HH1  ARG  69          1HH1      ARG  69  10.413  20.851 -11.116
  525   2HH1  ARG  69          2HH1      ARG  69   9.735  19.643 -10.073
  526   1HH2  ARG  69          1HH2      ARG  69  11.026  16.938 -11.927
  527   2HH2  ARG  69          2HH2      ARG  69  10.087  17.389 -10.535
  528    H    GLN  70           H        GLN  70  16.869  22.207 -14.142
  529    HA   GLN  70           HA       GLN  70  15.866  23.542 -16.387
  530   1HB   GLN  70          2HB       GLN  70  17.257  24.512 -14.553
  531   2HB   GLN  70          1HB       GLN  70  18.644  23.689 -15.232
  532   1HG   GLN  70          2HG       GLN  70  18.353  24.933 -17.311
  533   2HG   GLN  70          1HG       GLN  70  17.001  25.801 -16.587
  534   1HE2  GLN  70          1HE2      GLN  70  20.456  25.377 -16.612
  535   2HE2  GLN  70          2HE2      GLN  70  20.841  26.784 -15.675
  536    H    LEU  71           H        LEU  71  18.754  21.560 -15.970
  537    HA   LEU  71           HA       LEU  71  19.397  21.635 -18.786
  538   1HB   LEU  71          2HB       LEU  71  21.061  21.621 -16.869
  539   2HB   LEU  71          1HB       LEU  71  20.659  19.933 -16.635
  540    HG   LEU  71           HG       LEU  71  21.662  20.879 -19.305
  541   1HD1  LEU  71          1HD1      LEU  71  23.259  21.719 -17.659
  542   2HD1  LEU  71          2HD1      LEU  71  23.941  20.375 -18.575
  543   3HD1  LEU  71          3HD1      LEU  71  23.362  20.116 -16.929
  544   1HD2  LEU  71          1HD2      LEU  71  22.487  18.594 -19.454
  545   2HD2  LEU  71          2HD2      LEU  71  20.759  18.602 -19.104
  546   3HD2  LEU  71          3HD2      LEU  71  21.916  18.263 -17.817
  547    H    LYS  72           H        LYS  72  17.932  19.402 -16.526
  548    HA   LYS  72           HA       LYS  72  18.122  17.088 -18.174
  549   1HB   LYS  72          2HB       LYS  72  17.868  17.168 -15.649
  550   2HB   LYS  72          1HB       LYS  72  16.178  17.565 -15.911
  551   1HG   LYS  72          2HG       LYS  72  17.257  15.122 -17.207
  552   2HG   LYS  72          1HG       LYS  72  16.988  15.099 -15.463
  553   1HD   LYS  72          2HD       LYS  72  14.659  15.793 -15.833
  554   2HD   LYS  72          1HD       LYS  72  14.938  15.767 -17.575
  555   1HE   LYS  72          2HE       LYS  72  15.425  13.389 -17.480
  556   2HE   LYS  72          1HE       LYS  72  15.220  13.399 -15.730
  557   1HZ   LYS  72          1HZ       LYS  72  13.252  12.575 -16.880
  558   2HZ   LYS  72          2HZ       LYS  72  13.099  14.045 -17.709
  559   3HZ   LYS  72          3HZ       LYS  72  12.907  13.998 -16.023
  560    H    LYS  73           H        LYS  73  15.940  19.755 -18.004
  561    HA   LYS  73           HA       LYS  73  14.297  20.446 -19.403
  562   1HB   LYS  73          2HB       LYS  73  15.030  17.968 -20.961
  563   2HB   LYS  73          1HB       LYS  73  13.834  19.137 -21.499
  564   1HG   LYS  73          2HG       LYS  73  15.517  20.862 -21.627
  565   2HG   LYS  73          1HG       LYS  73  16.732  19.766 -20.963
  566   1HD   LYS  73          2HD       LYS  73  16.906  19.972 -23.413
  567   2HD   LYS  73          1HD       LYS  73  16.528  18.326 -22.907
  568   1HE   LYS  73          2HE       LYS  73  14.154  18.742 -23.398
  569   2HE   LYS  73          1HE       LYS  73  14.567  20.363 -23.953
  570   1HZ   LYS  73          1HZ       LYS  73  14.332  18.806 -25.790
  571   2HZ   LYS  73          2HZ       LYS  73  15.560  17.828 -25.145
  572   3HZ   LYS  73          3HZ       LYS  73  15.922  19.391 -25.691
  573    H    GLU  74           H        GLU  74  12.700  20.253 -17.835
  574    HA   GLU  74           HA       GLU  74  10.792  18.110 -18.433
  575   1HB   GLU  74          2HB       GLU  74  11.444  19.018 -15.618
  576   2HB   GLU  74          1HB       GLU  74  10.224  17.835 -16.067
  577   1HG   GLU  74          2HG       GLU  74  12.093  16.465 -17.055
  578   2HG   GLU  74          1HG       GLU  74  13.207  17.579 -16.264
  579    H    ASN  75           H        ASN  75   9.051  19.064 -19.175
  580    HA   ASN  75           HA       ASN  75   7.665  21.176 -17.924
  581   1HB   ASN  75          2HB       ASN  75   9.612  22.484 -18.759
  582   2HB   ASN  75          1HB       ASN  75   9.221  21.979 -20.396
  583   1HD2  ASN  75          1HD2      ASN  75   8.330  24.006 -17.734
  584   2HD2  ASN  75          2HD2      ASN  75   7.177  24.969 -18.590
  585    H    ALA  76           H        ALA  76   8.424  19.395 -20.801
  586    HA   ALA  76           HA       ALA  76   6.274  19.946 -22.434
  587   1HB   ALA  76          1HB       ALA  76   6.734  17.820 -23.519
  588   2HB   ALA  76          2HB       ALA  76   7.714  17.318 -22.142
  589   3HB   ALA  76          3HB       ALA  76   8.228  18.678 -23.143
  590    H    LEU  77           H        LEU  77   6.286  18.102 -19.520
  591    HA   LEU  77           HA       LEU  77   4.117  16.409 -19.924
  592   1HB   LEU  77          2HB       LEU  77   5.041  17.792 -17.406
  593   2HB   LEU  77          1HB       LEU  77   3.890  16.476 -17.454
  594    HG   LEU  77           HG       LEU  77   6.768  16.296 -18.343
  595   1HD1  LEU  77          1HD1      LEU  77   7.076  14.917 -16.346
  596   2HD1  LEU  77          2HD1      LEU  77   5.410  15.243 -15.864
  597   3HD1  LEU  77          3HD1      LEU  77   6.582  16.559 -15.932
  598   1HD2  LEU  77          1HD2      LEU  77   5.310  14.771 -19.575
  599   2HD2  LEU  77          2HD2      LEU  77   4.659  14.155 -18.057
  600   3HD2  LEU  77          3HD2      LEU  77   6.355  13.889 -18.462
  601    H    GLN  78           H        GLN  78   4.179  19.672 -18.484
  602    HA   GLN  78           HA       GLN  78   1.294  19.777 -18.436
  603   1HB   GLN  78          2HB       GLN  78   1.631  22.064 -17.525
  604   2HB   GLN  78          1HB       GLN  78   2.473  20.825 -16.610
  605   1HG   GLN  78          2HG       GLN  78   4.560  21.422 -17.744
  606   2HG   GLN  78          1HG       GLN  78   3.704  22.692 -18.619
  607   1HE2  GLN  78          1HE2      GLN  78   2.995  24.514 -17.500
  608   2HE2  GLN  78          2HE2      GLN  78   3.635  24.943 -15.950
  609    H    ARG  79           H        ARG  79   3.885  20.934 -20.471
  610    HA   ARG  79           HA       ARG  79   2.394  22.885 -21.892
  611   1HB   ARG  79          2HB       ARG  79   4.879  22.771 -21.848
  612   2HB   ARG  79          1HB       ARG  79   4.803  21.319 -22.831
  613   1HG   ARG  79          2HG       ARG  79   5.328  23.209 -24.223
  614   2HG   ARG  79          1HG       ARG  79   3.718  22.611 -24.623
  615   1HD   ARG  79          2HD       ARG  79   2.780  24.387 -23.130
  616   2HD   ARG  79          1HD       ARG  79   4.409  25.039 -22.974
  617    HE   ARG  79           HE       ARG  79   3.792  24.804 -25.704
  618   1HH1  ARG  79          1HH1      ARG  79   2.901  26.700 -22.895
  619   2HH1  ARG  79          2HH1      ARG  79   2.375  28.074 -23.829
  620   1HH2  ARG  79          1HH2      ARG  79   3.087  26.592 -26.939
  621   2HH2  ARG  79          2HH2      ARG  79   2.512  28.024 -26.133
  622    H    ALA  80           H        ALA  80   2.514  19.488 -22.003
  623    HA   ALA  80           HA       ALA  80   1.815  18.947 -24.659
  624   1HB   ALA  80          1HB       ALA  80   2.591  17.238 -23.082
  625   2HB   ALA  80          2HB       ALA  80   1.082  16.774 -23.867
  626   3HB   ALA  80          3HB       ALA  80   1.065  17.365 -22.205
  627    H    ARG  81           H        ARG  81  -0.050  20.268 -22.101
  628    HA   ARG  81           HA       ARG  81  -2.629  19.516 -23.065
  629   1HB   ARG  81          2HB       ARG  81  -1.556  21.321 -20.984
  630   2HB   ARG  81          1HB       ARG  81  -3.156  21.705 -21.599
  631   1HG   ARG  81          2HG       ARG  81  -3.781  19.305 -21.093
  632   2HG   ARG  81          1HG       ARG  81  -2.248  19.193 -20.226
  633   1HD   ARG  81          2HD       ARG  81  -2.891  20.815 -18.655
  634   2HD   ARG  81          1HD       ARG  81  -4.240  21.361 -19.650
  635    HE   ARG  81           HE       ARG  81  -4.144  18.843 -18.112
  636   1HH1  ARG  81          1HH1      ARG  81  -5.926  21.259 -19.923
  637   2HH1  ARG  81          2HH1      ARG  81  -7.483  20.741 -19.342
  638   1HH2  ARG  81          1HH2      ARG  81  -6.203  18.128 -17.364
  639   2HH2  ARG  81          2HH2      ARG  81  -7.637  18.936 -17.919
  640    H    THR  82           H        THR  82  -0.364  21.695 -24.217
  641    HA   THR  82           HA       THR  82  -2.269  23.621 -25.257
  642    HB   THR  82           HB       THR  82   0.616  23.513 -26.090
  643    HG1  THR  82           1HG      THR  82   0.906  23.407 -23.932
  644   1HG2  THR  82          1HG2      THR  82  -1.311  25.767 -25.506
  645   2HG2  THR  82          2HG2      THR  82  -0.820  25.208 -27.104
  646   3HG2  THR  82          3HG2      THR  82   0.361  25.965 -26.036
  647    H    ARG  83           H        ARG  83  -1.652  20.580 -26.108
  648    HA   ARG  83           HA       ARG  83  -1.367  20.975 -28.972
  649   1HB   ARG  83          2HB       ARG  83  -1.546  18.495 -27.266
  650   2HB   ARG  83          1HB       ARG  83  -1.510  18.453 -29.021
  651   1HG   ARG  83          2HG       ARG  83   0.673  19.684 -28.909
  652   2HG   ARG  83          1HG       ARG  83   0.644  19.423 -27.164
  653   1HD   ARG  83          2HD       ARG  83   0.537  17.250 -29.254
  654   2HD   ARG  83          1HD       ARG  83   1.981  17.729 -28.363
  655    HE   ARG  83           HE       ARG  83   0.320  17.127 -26.368
  656   1HH1  ARG  83          1HH1      ARG  83   0.938  15.415 -29.361
  657   2HH1  ARG  83          2HH1      ARG  83   0.711  13.837 -28.658
  658   1HH2  ARG  83          1HH2      ARG  83   0.039  15.036 -25.438
  659   2HH2  ARG  83          2HH2      ARG  83   0.244  13.626 -26.428
  660    H    HIS  84           H        HIS  84  -2.875  20.217 -30.484
  661    HA   HIS  84           HA       HIS  84  -5.626  19.980 -29.448
  662   1HB   HIS  84          2HB       HIS  84  -4.624  21.108 -32.079
  663   2HB   HIS  84          1HB       HIS  84  -6.323  20.823 -31.719
  664    HD1  HIS  84           1HD      HIS  84  -7.541  22.577 -30.359
  665    HD2  HIS  84           2HD      HIS  84  -3.431  23.221 -30.543
  666    HE1  HIS  84           1HE      HIS  84  -7.164  24.865 -29.386
  667    HE2  HIS  84           2HE      HIS  84  -4.665  25.203 -29.421
  668    HA   PRO  85           HA       PRO  85  -6.074  15.914 -30.996
  669   1HB   PRO  85          2HB       PRO  85  -8.362  16.757 -32.690
  670   2HB   PRO  85          1HB       PRO  85  -8.281  15.512 -31.440
  671   1HG   PRO  85          2HG       PRO  85  -9.506  17.838 -30.990
  672   2HG   PRO  85          1HG       PRO  85  -8.565  17.030 -29.722
  673   1HD   PRO  85          2HD       PRO  85  -7.852  19.397 -31.398
  674   2HD   PRO  85          1HD       PRO  85  -7.477  19.054 -29.700
  675    H    ALA  86           H        ALA  86  -6.394  14.575 -32.985
  676    HA   ALA  86           HA       ALA  86  -4.628  15.670 -35.053
  677   1HB   ALA  86          1HB       ALA  86  -5.344  12.794 -34.498
  678   2HB   ALA  86          2HB       ALA  86  -3.905  13.618 -33.897
  679   3HB   ALA  86          3HB       ALA  86  -4.121  13.370 -35.630
  680    H    GLU  87           H        GLU  87  -7.518  16.113 -34.809
  681    HA   GLU  87           HA       GLU  87  -8.991  14.691 -36.720
  682   1HB   GLU  87          2HB       GLU  87 -10.442  16.795 -36.701
  683   2HB   GLU  87          1HB       GLU  87 -10.211  15.975 -35.163
  684   1HG   GLU  87          2HG       GLU  87  -8.477  17.600 -34.570
  685   2HG   GLU  87          1HG       GLU  87  -8.746  18.430 -36.102
  686    H    SER  88           H        SER  88  -7.143  17.709 -36.992
  687    HA   SER  88           HA       SER  88  -7.748  18.088 -39.744
  688   1HB   SER  88          2HB       SER  88  -5.427  19.243 -38.191
  689   2HB   SER  88          1HB       SER  88  -6.197  19.918 -39.629
  690    HG   SER  88           HG       SER  88  -8.180  19.933 -38.211
  691    H    CYS  89           H        CYS  89  -5.449  16.176 -38.033
  692    HA   CYS  89           HA       CYS  89  -3.482  16.066 -40.097
  693   1HB   CYS  89          2HB       CYS  89  -2.991  15.707 -37.669
  694   2HB   CYS  89          1HB       CYS  89  -3.854  14.177 -37.771
  695    HG   CYS  89           HG       CYS  89  -0.849  14.213 -37.851
  696    H    LEU  90           H        LEU  90  -6.236  14.099 -39.164
  697    HA   LEU  90           HA       LEU  90  -5.591  11.961 -40.954
  698   1HB   LEU  90          2HB       LEU  90  -7.872  11.130 -40.454
  699   2HB   LEU  90          1HB       LEU  90  -6.889  11.416 -39.035
  700    HG   LEU  90           HG       LEU  90  -8.153  13.709 -38.955
  701   1HD1  LEU  90          1HD1      LEU  90 -10.118  12.017 -40.494
  702   2HD1  LEU  90          2HD1      LEU  90  -9.280  13.436 -41.119
  703   3HD1  LEU  90          3HD1      LEU  90 -10.426  13.605 -39.790
  704   1HD2  LEU  90          1HD2      LEU  90  -9.861  12.680 -37.542
  705   2HD2  LEU  90          2HD2      LEU  90  -8.276  11.962 -37.258
  706   3HD2  LEU  90          3HD2      LEU  90  -9.474  11.098 -38.222
  707    H    GLU  91           H        GLU  91  -7.118  14.991 -41.258
  708    HA   GLU  91           HA       GLU  91  -8.657  14.508 -43.584
  709   1HB   GLU  91          2HB       GLU  91  -7.431  17.023 -42.454
  710   2HB   GLU  91          1HB       GLU  91  -8.475  17.009 -43.868
  711   1HG   GLU  91          2HG       GLU  91  -9.296  15.982 -41.162
  712   2HG   GLU  91          1HG       GLU  91  -9.609  17.617 -41.742
  713    H    HIS  92           H        HIS  92  -5.280  15.136 -43.015
  714    HA   HIS  92           HA       HIS  92  -4.756  15.840 -45.771
  715   1HB   HIS  92          2HB       HIS  92  -3.038  15.593 -43.318
  716   2HB   HIS  92          1HB       HIS  92  -2.316  15.756 -44.918
  717    HD1  HIS  92           1HD      HIS  92  -3.945  17.703 -42.229
  718    HD2  HIS  92           2HD      HIS  92  -2.904  18.233 -46.222
  719    HE1  HIS  92           1HE      HIS  92  -4.111  20.176 -42.652
  720    HE2  HIS  92           2HE      HIS  92  -3.672  20.442 -45.120
  721    H    HIS  93           H        HIS  93  -5.597  13.891 -46.660
  722    HA   HIS  93           HA       HIS  93  -3.458  11.978 -47.103
  723   1HB   HIS  93          2HB       HIS  93  -6.191  11.204 -46.069
  724   2HB   HIS  93          1HB       HIS  93  -5.188  10.081 -46.978
  725    HD1  HIS  93           1HD      HIS  93  -5.877  11.169 -43.615
  726    HD2  HIS  93           2HD      HIS  93  -2.572   9.659 -45.637
  727    HE1  HIS  93           1HE      HIS  93  -4.320  10.323 -41.830
  728    HE2  HIS  93           2HE      HIS  93  -2.404   9.257 -43.085
  729    H    HIS  94           H        HIS  94  -3.645  10.930 -49.139
  730    HA   HIS  94           HA       HIS  94  -4.157  10.777 -51.343
  731   1HB   HIS  94          2HB       HIS  94  -6.825  11.297 -50.137
  732   2HB   HIS  94          1HB       HIS  94  -6.674  11.554 -51.871
  733    HD1  HIS  94           1HD      HIS  94  -8.362   9.227 -50.472
  734    HD2  HIS  94           2HD      HIS  94  -4.593   8.870 -52.207
  735    HE1  HIS  94           1HE      HIS  94  -8.140   6.813 -51.138
  736    HE2  HIS  94           2HE      HIS  94  -5.934   6.663 -52.353
  737    H    HIS  95           H        HIS  95  -5.607  12.338 -53.078
  738    HA   HIS  95           HA       HIS  95  -4.514  15.037 -52.633
  739   1HB   HIS  95          2HB       HIS  95  -3.981  15.193 -55.036
  740   2HB   HIS  95          1HB       HIS  95  -3.084  13.897 -54.256
  741    HD1  HIS  95           1HD      HIS  95  -5.622  14.563 -56.880
  742    HD2  HIS  95           2HD      HIS  95  -3.822  11.284 -55.071
  743    HE1  HIS  95           1HE      HIS  95  -6.175  12.599 -58.345
  744    HE2  HIS  95           2HE      HIS  95  -4.980  10.642 -57.299
  745    H    HIS  96           H        HIS  96  -5.764  16.758 -53.341
  746    HA   HIS  96           HA       HIS  96  -8.574  16.050 -53.737
  747   1HB   HIS  96          2HB       HIS  96  -7.897  17.656 -51.928
  748   2HB   HIS  96          1HB       HIS  96  -7.389  18.776 -53.186
  749    HD1  HIS  96           1HD      HIS  96  -9.221  20.104 -54.396
  750    HD2  HIS  96           2HD      HIS  96 -10.703  17.293 -51.712
  751    HE1  HIS  96           1HE      HIS  96 -11.675  20.599 -54.182
  752    HE2  HIS  96           2HE      HIS  96 -12.576  18.818 -52.639
  753    H    HIS  97           H        HIS  97  -9.633  16.352 -55.572
  754    HA   HIS  97           HA       HIS  97  -8.279  17.750 -57.770
  755   1HB   HIS  97          2HB       HIS  97  -9.042  15.448 -58.227
  756   2HB   HIS  97          1HB       HIS  97 -10.687  15.908 -57.807
  757    HD1  HIS  97           1HD      HIS  97 -12.096  16.978 -59.609
  758    HD2  HIS  97           2HD      HIS  97  -8.101  16.571 -60.696
  759    HE1  HIS  97           1HE      HIS  97 -11.999  17.524 -62.065
  760    HE2  HIS  97           2HE      HIS  97  -9.595  17.145 -62.729
  Start of MODEL   14
    1   1H    MET   1          1HT       MET   1  -7.598  12.469  -6.652
    2   2H    MET   1          2HT       MET   1  -7.658  14.012  -7.346
    3   3H    MET   1          3HT       MET   1  -8.142  13.791  -5.739
    4    HA   MET   1           HA       MET   1  -5.980  14.797  -5.797
    5   1HB   MET   1          2HB       MET   1  -5.841  11.881  -4.986
    6   2HB   MET   1          1HB       MET   1  -4.735  13.140  -4.458
    7   1HG   MET   1          2HG       MET   1  -6.219  12.808  -2.679
    8   2HG   MET   1          1HG       MET   1  -6.735  14.304  -3.454
    9   1HE   MET   1          1HE       MET   1  -7.498  10.522  -2.842
   10   2HE   MET   1          2HE       MET   1  -7.331  10.563  -4.598
   11   3HE   MET   1          3HE       MET   1  -8.907  10.256  -3.870
   12    HA   PRO   2           HA       PRO   2  -3.526  13.580  -9.320
   13   1HB   PRO   2          2HB       PRO   2  -1.484  15.297  -8.973
   14   2HB   PRO   2          1HB       PRO   2  -3.073  15.836  -9.523
   15   1HG   PRO   2          2HG       PRO   2  -1.853  16.001  -6.800
   16   2HG   PRO   2          1HG       PRO   2  -2.846  17.190  -7.662
   17   1HD   PRO   2          2HD       PRO   2  -3.799  15.493  -5.718
   18   2HD   PRO   2          1HD       PRO   2  -4.799  16.221  -6.992
   19    H    THR   3           H        THR   3  -2.735  13.227  -6.057
   20    HA   THR   3           HA       THR   3  -0.146  12.000  -6.565
   21    HB   THR   3           HB       THR   3  -1.278  12.071  -3.855
   22    HG1  THR   3           1HG      THR   3  -0.298  14.421  -5.168
   23   1HG2  THR   3          1HG2      THR   3   1.429  12.774  -4.981
   24   2HG2  THR   3          2HG2      THR   3   0.975  11.217  -4.289
   25   3HG2  THR   3          3HG2      THR   3   1.023  12.653  -3.267
   26    H    LYS   4           H        LYS   4   0.138   9.919  -6.609
   27    HA   LYS   4           HA       LYS   4  -1.629   8.086  -5.193
   28   1HB   LYS   4          2HB       LYS   4  -2.412   8.389  -7.631
   29   2HB   LYS   4          1HB       LYS   4  -0.922   7.588  -8.094
   30   1HG   LYS   4          2HG       LYS   4  -2.962   6.334  -6.269
   31   2HG   LYS   4          1HG       LYS   4  -2.987   6.152  -8.022
   32   1HD   LYS   4          2HD       LYS   4  -0.530   5.369  -7.715
   33   2HD   LYS   4          1HD       LYS   4  -1.006   5.107  -6.037
   34   1HE   LYS   4          2HE       LYS   4  -2.357   3.921  -8.459
   35   2HE   LYS   4          1HE       LYS   4  -1.234   3.073  -7.400
   36   1HZ   LYS   4          1HZ       LYS   4  -3.504   2.531  -6.849
   37   2HZ   LYS   4          2HZ       LYS   4  -3.897   4.161  -6.622
   38   3HZ   LYS   4          3HZ       LYS   4  -2.808   3.394  -5.569
   39    H    THR   5           H        THR   5   0.100   7.740  -3.813
   40    HA   THR   5           HA       THR   5   2.667   7.011  -5.051
   41    HB   THR   5           HB       THR   5   2.429   7.830  -2.183
   42    HG1  THR   5           1HG      THR   5   2.467   9.589  -4.443
   43   1HG2  THR   5          1HG2      THR   5   4.538   8.282  -4.301
   44   2HG2  THR   5          2HG2      THR   5   4.584   7.041  -3.051
   45   3HG2  THR   5          3HG2      THR   5   4.663   8.745  -2.602
   46    H    TYR   6           H        TYR   6   3.981   5.456  -3.961
   47    HA   TYR   6           HA       TYR   6   2.642   3.668  -2.092
   48   1HB   TYR   6          2HB       TYR   6   3.850   1.774  -3.468
   49   2HB   TYR   6          1HB       TYR   6   2.266   2.358  -3.959
   50    HD1  TYR   6           1HD      TYR   6   1.946   3.358  -6.083
   51    HD2  TYR   6           2HD      TYR   6   5.891   2.589  -4.697
   52    HE1  TYR   6           1HE      TYR   6   2.827   3.853  -8.324
   53    HE2  TYR   6           2HE      TYR   6   6.782   3.085  -6.931
   54    HH   TYR   6           HH       TYR   6   4.916   4.556  -9.369
   55    H    SER   7           H        SER   7   3.895   3.648  -0.347
   56    HA   SER   7           HA       SER   7   6.616   4.492  -0.427
   57   1HB   SER   7          2HB       SER   7   6.602   3.781   2.002
   58   2HB   SER   7          1HB       SER   7   5.368   4.961   1.557
   59    HG   SER   7           HG       SER   7   3.941   3.598   2.217
   60    H    GLU   8           H        GLU   8   8.482   3.260   0.204
   61    HA   GLU   8           HA       GLU   8   8.725   0.802  -1.122
   62   1HB   GLU   8          2HB       GLU   8  10.921   0.646   0.141
   63   2HB   GLU   8          1HB       GLU   8  10.686   2.072  -0.859
   64   1HG   GLU   8          2HG       GLU   8  10.041   3.337   1.155
   65   2HG   GLU   8          1HG       GLU   8  10.392   1.908   2.131
   66    H    GLU   9           H        GLU   9   7.963   1.545   2.211
   67    HA   GLU   9           HA       GLU   9   8.243  -1.091   3.225
   68   1HB   GLU   9          2HB       GLU   9   8.084   1.028   4.591
   69   2HB   GLU   9          1HB       GLU   9   6.368   1.061   4.221
   70   1HG   GLU   9          2HG       GLU   9   6.732   0.133   6.415
   71   2HG   GLU   9          1HG       GLU   9   6.087  -1.099   5.333
   72    H    PHE  10           H        PHE  10   5.645   0.676   1.654
   73    HA   PHE  10           HA       PHE  10   3.626  -1.287   1.971
   74   1HB   PHE  10          2HB       PHE  10   3.145   1.055   1.358
   75   2HB   PHE  10          1HB       PHE  10   3.942   0.809  -0.190
   76    HD1  PHE  10           1HD      PHE  10   2.728   0.076  -2.027
   77    HD2  PHE  10           2HD      PHE  10   1.104  -0.403   1.878
   78    HE1  PHE  10           1HE      PHE  10   0.590  -0.640  -3.006
   79    HE2  PHE  10           2HE      PHE  10  -1.034  -1.128   0.901
   80    HZ   PHE  10           HZ       PHE  10  -1.292  -1.245  -1.544
   81    H    LYS  11           H        LYS  11   6.028  -0.664  -0.548
   82    HA   LYS  11           HA       LYS  11   5.312  -2.695  -2.343
   83   1HB   LYS  11          2HB       LYS  11   8.119  -1.762  -1.717
   84   2HB   LYS  11          1HB       LYS  11   7.561  -2.505  -3.208
   85   1HG   LYS  11          2HG       LYS  11   6.268  -0.570  -3.768
   86   2HG   LYS  11          1HG       LYS  11   6.592   0.155  -2.190
   87   1HD   LYS  11          2HD       LYS  11   9.031   0.114  -2.779
   88   2HD   LYS  11          1HD       LYS  11   8.560  -0.378  -4.407
   89   1HE   LYS  11          2HE       LYS  11   7.302   1.663  -4.698
   90   2HE   LYS  11          1HE       LYS  11   7.638   2.141  -3.032
   91   1HZ   LYS  11          1HZ       LYS  11   9.125   3.313  -4.439
   92   2HZ   LYS  11          2HZ       LYS  11   9.577   1.909  -5.265
   93   3HZ   LYS  11          3HZ       LYS  11  10.043   2.126  -3.650
   94    H    ARG  12           H        ARG  12   7.363  -2.685   0.509
   95    HA   ARG  12           HA       ARG  12   8.336  -5.324   0.338
   96   1HB   ARG  12          2HB       ARG  12   9.330  -3.568   1.740
   97   2HB   ARG  12          1HB       ARG  12   7.893  -3.552   2.747
   98   1HG   ARG  12          2HG       ARG  12   8.361  -5.826   3.478
   99   2HG   ARG  12          1HG       ARG  12   9.788  -5.872   2.435
  100   1HD   ARG  12          2HD       ARG  12  10.792  -4.054   3.662
  101   2HD   ARG  12          1HD       ARG  12   9.345  -3.877   4.648
  102    HE   ARG  12           HE       ARG  12  10.803  -6.424   4.737
  103   1HH1  ARG  12          1HH1      ARG  12   9.779  -3.442   6.273
  104   2HH1  ARG  12          2HH1      ARG  12  10.346  -3.912   7.853
  105   1HH2  ARG  12          1HH2      ARG  12  11.533  -7.047   6.831
  106   2HH2  ARG  12          2HH2      ARG  12  11.349  -5.946   8.164
  107    H    ASP  13           H        ASP  13   5.442  -3.927   1.787
  108    HA   ASP  13           HA       ASP  13   4.528  -6.331   3.009
  109   1HB   ASP  13          2HB       ASP  13   3.731  -4.125   3.727
  110   2HB   ASP  13          1HB       ASP  13   2.974  -3.882   2.156
  111    H    ALA  14           H        ALA  14   4.101  -4.846  -0.136
  112    HA   ALA  14           HA       ALA  14   2.113  -6.558  -1.142
  113   1HB   ALA  14          1HB       ALA  14   4.317  -5.191  -2.681
  114   2HB   ALA  14          2HB       ALA  14   2.788  -4.447  -2.215
  115   3HB   ALA  14          3HB       ALA  14   2.800  -5.806  -3.339
  116    H    VAL  15           H        VAL  15   5.585  -6.923  -0.839
  117    HA   VAL  15           HA       VAL  15   5.862  -9.290  -2.361
  118    HB   VAL  15           HB       VAL  15   7.481  -8.434   0.057
  119   1HG1  VAL  15          1HG1      VAL  15   9.239  -9.854  -0.878
  120   2HG1  VAL  15          2HG1      VAL  15   8.154 -10.349  -2.177
  121   3HG1  VAL  15          3HG1      VAL  15   7.790 -10.791  -0.509
  122   1HG2  VAL  15          1HG2      VAL  15   7.931  -7.905  -2.883
  123   2HG2  VAL  15          2HG2      VAL  15   9.057  -7.506  -1.585
  124   3HG2  VAL  15          3HG2      VAL  15   7.484  -6.711  -1.663
  125    H    ALA  16           H        ALA  16   4.974  -8.649   0.982
  126    HA   ALA  16           HA       ALA  16   4.906 -11.349   1.852
  127   1HB   ALA  16          1HB       ALA  16   3.412  -8.971   2.958
  128   2HB   ALA  16          2HB       ALA  16   5.046  -9.458   3.407
  129   3HB   ALA  16          3HB       ALA  16   3.680 -10.509   3.779
  130    H    LEU  17           H        LEU  17   2.610  -9.232   0.274
  131    HA   LEU  17           HA       LEU  17   0.325 -10.864   0.483
  132   1HB   LEU  17          2HB       LEU  17   1.202  -8.763  -1.474
  133   2HB   LEU  17          1HB       LEU  17  -0.294  -9.639  -1.711
  134    HG   LEU  17           HG       LEU  17   0.306  -8.074   0.799
  135   1HD1  LEU  17          1HD1      LEU  17   0.317  -6.565  -1.131
  136   2HD1  LEU  17          2HD1      LEU  17  -1.110  -6.317  -0.129
  137   3HD1  LEU  17          3HD1      LEU  17  -1.241  -7.208  -1.645
  138   1HD2  LEU  17          1HD2      LEU  17  -2.263  -9.132  -0.378
  139   2HD2  LEU  17          2HD2      LEU  17  -2.109  -8.212   1.120
  140   3HD2  LEU  17          3HD2      LEU  17  -1.400  -9.823   0.995
  141    H    TYR  18           H        TYR  18   3.054 -10.863  -1.753
  142    HA   TYR  18           HA       TYR  18   1.937 -12.817  -3.507
  143   1HB   TYR  18          2HB       TYR  18   3.745 -11.231  -4.186
  144   2HB   TYR  18          1HB       TYR  18   4.859 -12.122  -3.154
  145    HD1  TYR  18           1HD      TYR  18   5.973 -14.020  -3.971
  146    HD2  TYR  18           2HD      TYR  18   2.597 -12.511  -6.080
  147    HE1  TYR  18           1HE      TYR  18   6.426 -15.590  -5.811
  148    HE2  TYR  18           2HE      TYR  18   3.039 -14.076  -7.923
  149    HH   TYR  18           HH       TYR  18   5.138 -16.691  -7.644
  150    H    GLU  19           H        GLU  19   3.672 -12.942  -0.506
  151    HA   GLU  19           HA       GLU  19   4.472 -15.659  -0.608
  152   1HB   GLU  19          2HB       GLU  19   3.709 -14.017   1.812
  153   2HB   GLU  19          1HB       GLU  19   4.592 -15.533   1.839
  154   1HG   GLU  19          2HG       GLU  19   6.411 -14.449   0.569
  155   2HG   GLU  19          1HG       GLU  19   5.530 -12.924   0.678
  156    H    ASN  20           H        ASN  20   1.461 -14.127  -0.310
  157    HA   ASN  20           HA       ASN  20   0.154 -16.571   0.664
  158   1HB   ASN  20          2HB       ASN  20  -0.675 -13.668   0.694
  159   2HB   ASN  20          1HB       ASN  20  -1.805 -14.974   1.029
  160   1HD2  ASN  20          1HD2      ASN  20   0.950 -13.195   2.185
  161   2HD2  ASN  20          2HD2      ASN  20   0.928 -13.823   3.801
  162    H    SER  21           H        SER  21   1.128 -15.955  -2.083
  163    HA   SER  21           HA       SER  21  -1.013 -15.216  -3.751
  164   1HB   SER  21          2HB       SER  21   0.389 -16.245  -5.568
  165   2HB   SER  21          1HB       SER  21   1.181 -14.998  -4.609
  166    HG   SER  21           HG       SER  21   2.544 -16.416  -3.854
  167    H    ASP  22           H        ASP  22  -0.352 -18.132  -2.145
  168    HA   ASP  22           HA       ASP  22  -1.598 -20.030  -3.748
  169   1HB   ASP  22          2HB       ASP  22  -0.448 -20.477  -1.565
  170   2HB   ASP  22          1HB       ASP  22  -1.862 -19.823  -0.742
  171    H    GLY  23           H        GLY  23  -2.947 -17.480  -1.794
  172   1HA   GLY  23          2HA       GLY  23  -5.667 -18.339  -2.534
  173   2HA   GLY  23          1HA       GLY  23  -5.275 -17.274  -1.193
  174    H    ALA  24           H        ALA  24  -3.283 -15.971  -3.238
  175    HA   ALA  24           HA       ALA  24  -5.205 -14.505  -4.866
  176   1HB   ALA  24          1HB       ALA  24  -5.214 -13.314  -2.731
  177   2HB   ALA  24          2HB       ALA  24  -4.518 -12.330  -4.017
  178   3HB   ALA  24          3HB       ALA  24  -3.464 -13.110  -2.838
  179    H    SER  25           H        SER  25  -4.340 -14.635  -6.819
  180    HA   SER  25           HA       SER  25  -1.573 -15.123  -7.248
  181   1HB   SER  25          2HB       SER  25  -3.429 -15.968  -8.701
  182   2HB   SER  25          1HB       SER  25  -3.654 -14.325  -9.297
  183    HG   SER  25           HG       SER  25  -1.663 -16.173  -9.859
  184    H    LEU  26           H        LEU  26  -0.377 -13.793  -8.989
  185    HA   LEU  26           HA       LEU  26   0.381 -11.377  -7.836
  186   1HB   LEU  26          2HB       LEU  26   1.807 -12.708  -9.322
  187   2HB   LEU  26          1HB       LEU  26   0.773 -12.312 -10.681
  188    HG   LEU  26           HG       LEU  26   1.386  -9.906 -10.362
  189   1HD1  LEU  26          1HD1      LEU  26   3.374 -11.059  -8.415
  190   2HD1  LEU  26          2HD1      LEU  26   2.044  -9.964  -8.035
  191   3HD1  LEU  26          3HD1      LEU  26   3.391  -9.408  -9.030
  192   1HD2  LEU  26          1HD2      LEU  26   3.633 -10.134 -11.331
  193   2HD2  LEU  26          2HD2      LEU  26   2.475 -11.245 -12.063
  194   3HD2  LEU  26          3HD2      LEU  26   3.640 -11.839 -10.879
  195    H    GLN  27           H        GLN  27  -1.552 -11.897 -10.804
  196    HA   GLN  27           HA       GLN  27  -2.030  -9.172 -11.329
  197   1HB   GLN  27          2HB       GLN  27  -2.436 -10.962 -12.978
  198   2HB   GLN  27          1HB       GLN  27  -3.778 -11.551 -12.007
  199   1HG   GLN  27          2HG       GLN  27  -4.615 -10.250 -13.861
  200   2HG   GLN  27          1HG       GLN  27  -4.943  -9.421 -12.342
  201   1HE2  GLN  27          1HE2      GLN  27  -3.902  -7.514 -11.875
  202   2HE2  GLN  27          2HE2      GLN  27  -3.027  -6.617 -13.067
  203    H    GLN  28           H        GLN  28  -3.578 -11.456  -9.205
  204    HA   GLN  28           HA       GLN  28  -5.990 -10.032  -8.795
  205   1HB   GLN  28          2HB       GLN  28  -5.278 -12.518  -8.224
  206   2HB   GLN  28          1HB       GLN  28  -4.858 -11.806  -6.672
  207   1HG   GLN  28          2HG       GLN  28  -7.085 -12.711  -6.588
  208   2HG   GLN  28          1HG       GLN  28  -7.149 -10.952  -6.465
  209   1HE2  GLN  28          1HE2      GLN  28  -9.275 -10.887  -7.181
  210   2HE2  GLN  28          2HE2      GLN  28  -9.696 -11.160  -8.839
  211    H    ILE  29           H        ILE  29  -2.927 -10.182  -7.012
  212    HA   ILE  29           HA       ILE  29  -3.607  -8.436  -4.921
  213    HB   ILE  29           HB       ILE  29  -0.904  -8.913  -6.195
  214   1HG1  ILE  29          2HG1      ILE  29  -1.917 -10.952  -5.276
  215   2HG1  ILE  29          1HG1      ILE  29  -0.533 -10.448  -4.310
  216   1HG2  ILE  29          1HG2      ILE  29  -1.585  -7.648  -3.540
  217   2HG2  ILE  29          2HG2      ILE  29  -0.906  -6.826  -4.946
  218   3HG2  ILE  29          3HG2      ILE  29   0.037  -8.051  -4.098
  219   1HD1  ILE  29          1HD1      ILE  29  -3.433 -10.006  -3.620
  220   2HD1  ILE  29          2HD1      ILE  29  -2.051  -9.475  -2.660
  221   3HD1  ILE  29          3HD1      ILE  29  -2.349 -11.197  -2.898
  222    H    ALA  30           H        ALA  30  -1.963  -7.780  -8.009
  223    HA   ALA  30           HA       ALA  30  -1.715  -5.007  -7.662
  224   1HB   ALA  30          1HB       ALA  30  -1.970  -6.548 -10.240
  225   2HB   ALA  30          2HB       ALA  30  -0.474  -6.278  -9.347
  226   3HB   ALA  30          3HB       ALA  30  -1.331  -4.913 -10.065
  227    H    ASN  31           H        ASN  31  -4.342  -6.988  -8.802
  228    HA   ASN  31           HA       ASN  31  -5.883  -4.961 -10.029
  229   1HB   ASN  31          2HB       ASN  31  -6.071  -7.566 -10.164
  230   2HB   ASN  31          1HB       ASN  31  -7.108  -7.392  -8.755
  231   1HD2  ASN  31          1HD2      ASN  31  -7.761  -8.380 -11.372
  232   2HD2  ASN  31          2HD2      ASN  31  -9.011  -7.357 -11.995
  233    H    ASP  32           H        ASP  32  -6.001  -6.420  -6.787
  234    HA   ASP  32           HA       ASP  32  -8.255  -4.898  -5.955
  235   1HB   ASP  32          2HB       ASP  32  -7.511  -7.098  -4.950
  236   2HB   ASP  32          1HB       ASP  32  -6.223  -6.209  -4.146
  237    H    LEU  33           H        LEU  33  -4.773  -4.515  -5.575
  238    HA   LEU  33           HA       LEU  33  -5.022  -2.262  -3.804
  239   1HB   LEU  33          2HB       LEU  33  -2.740  -3.673  -5.126
  240   2HB   LEU  33          1HB       LEU  33  -2.482  -2.102  -4.399
  241    HG   LEU  33           HG       LEU  33  -3.231  -2.997  -2.215
  242   1HD1  LEU  33          1HD1      LEU  33  -4.718  -4.762  -2.985
  243   2HD1  LEU  33          2HD1      LEU  33  -3.480  -5.416  -1.912
  244   3HD1  LEU  33          3HD1      LEU  33  -3.345  -5.643  -3.656
  245   1HD2  LEU  33          1HD2      LEU  33  -0.865  -2.981  -2.795
  246   2HD2  LEU  33          2HD2      LEU  33  -1.026  -4.581  -3.519
  247   3HD2  LEU  33          3HD2      LEU  33  -1.263  -4.369  -1.785
  248    H    GLY  34           H        GLY  34  -5.173  -2.677  -7.158
  249   1HA   GLY  34          2HA       GLY  34  -5.467  -1.136  -8.844
  250   2HA   GLY  34          1HA       GLY  34  -5.498   0.117  -7.610
  251    H    ILE  35           H        ILE  35  -2.984  -2.200  -8.549
  252    HA   ILE  35           HA       ILE  35  -1.244   0.056  -9.266
  253    HB   ILE  35           HB       ILE  35   0.677  -1.253  -8.330
  254   1HG1  ILE  35          2HG1      ILE  35  -1.518  -2.847  -6.987
  255   2HG1  ILE  35          1HG1      ILE  35  -0.445  -3.448  -8.248
  256   1HG2  ILE  35          1HG2      ILE  35  -0.221   0.663  -7.152
  257   2HG2  ILE  35          2HG2      ILE  35   0.273  -0.579  -6.002
  258   3HG2  ILE  35          3HG2      ILE  35  -1.435  -0.355  -6.377
  259   1HD1  ILE  35          1HD1      ILE  35   0.268  -4.209  -6.061
  260   2HD1  ILE  35          2HD1      ILE  35   0.385  -2.540  -5.498
  261   3HD1  ILE  35          3HD1      ILE  35   1.468  -3.125  -6.762
  262    H    ASN  36           H        ASN  36   0.762  -0.835 -10.486
  263    HA   ASN  36           HA       ASN  36  -0.253  -2.264 -12.746
  264   1HB   ASN  36          2HB       ASN  36   1.412  -0.352 -12.779
  265   2HB   ASN  36          1HB       ASN  36   2.616  -1.507 -12.227
  266   1HD2  ASN  36          1HD2      ASN  36   0.580  -0.507 -14.829
  267   2HD2  ASN  36          2HD2      ASN  36   1.335  -1.460 -16.054
  268    H    ARG  37           H        ARG  37   0.308  -4.255 -13.496
  269    HA   ARG  37           HA       ARG  37   0.929  -6.246 -11.576
  270   1HB   ARG  37          2HB       ARG  37  -0.487  -6.651 -13.551
  271   2HB   ARG  37          1HB       ARG  37   0.911  -6.423 -14.592
  272   1HG   ARG  37          2HG       ARG  37   1.981  -8.373 -13.509
  273   2HG   ARG  37          1HG       ARG  37   0.495  -8.627 -12.586
  274   1HD   ARG  37          2HD       ARG  37   0.521 -10.071 -14.536
  275   2HD   ARG  37          1HD       ARG  37  -0.753  -8.860 -14.686
  276    HE   ARG  37           HE       ARG  37   1.862  -8.625 -16.056
  277   1HH1  ARG  37          1HH1      ARG  37  -1.652  -8.394 -16.050
  278   2HH1  ARG  37          2HH1      ARG  37  -1.743  -7.818 -17.690
  279   1HH2  ARG  37          1HH2      ARG  37   1.732  -7.846 -18.206
  280   2HH2  ARG  37          2HH2      ARG  37   0.181  -7.488 -18.904
  281    H    VAL  38           H        VAL  38   2.787  -4.615 -14.086
  282    HA   VAL  38           HA       VAL  38   5.052  -6.368 -13.886
  283    HB   VAL  38           HB       VAL  38   4.923  -3.598 -15.100
  284   1HG1  VAL  38          1HG1      VAL  38   6.870  -5.861 -15.566
  285   2HG1  VAL  38          2HG1      VAL  38   7.209  -4.376 -14.678
  286   3HG1  VAL  38          3HG1      VAL  38   6.864  -4.312 -16.407
  287   1HG2  VAL  38          1HG2      VAL  38   4.601  -4.765 -17.236
  288   2HG2  VAL  38          2HG2      VAL  38   3.266  -5.043 -16.117
  289   3HG2  VAL  38          3HG2      VAL  38   4.482  -6.295 -16.370
  290    H    THR  39           H        THR  39   4.250  -3.148 -12.672
  291    HA   THR  39           HA       THR  39   6.708  -2.596 -11.445
  292    HB   THR  39           HB       THR  39   4.026  -1.653 -10.434
  293    HG1  THR  39           1HG      THR  39   5.576  -0.703 -12.639
  294   1HG2  THR  39          1HG2      THR  39   5.988  -1.050  -9.080
  295   2HG2  THR  39          2HG2      THR  39   5.276   0.368  -9.852
  296   3HG2  THR  39          3HG2      THR  39   6.750  -0.347 -10.505
  297    H    LEU  40           H        LEU  40   3.794  -4.204 -10.216
  298    HA   LEU  40           HA       LEU  40   4.659  -4.618  -7.579
  299   1HB   LEU  40          2HB       LEU  40   2.341  -4.907  -8.267
  300   2HB   LEU  40          1HB       LEU  40   2.793  -6.237  -9.313
  301    HG   LEU  40           HG       LEU  40   3.444  -7.563  -7.340
  302   1HD1  LEU  40          1HD1      LEU  40   2.347  -5.237  -5.768
  303   2HD1  LEU  40          2HD1      LEU  40   4.033  -5.748  -5.832
  304   3HD1  LEU  40          3HD1      LEU  40   2.820  -6.801  -5.104
  305   1HD2  LEU  40          1HD2      LEU  40   0.636  -6.470  -7.215
  306   2HD2  LEU  40          2HD2      LEU  40   1.190  -7.992  -6.518
  307   3HD2  LEU  40          3HD2      LEU  40   1.195  -7.771  -8.267
  308    H    LYS  41           H        LYS  41   4.914  -6.639 -10.470
  309    HA   LYS  41           HA       LYS  41   6.202  -8.860  -9.390
  310   1HB   LYS  41          2HB       LYS  41   5.239  -8.712 -11.658
  311   2HB   LYS  41          1HB       LYS  41   6.529  -7.626 -12.131
  312   1HG   LYS  41          2HG       LYS  41   7.470 -10.160 -11.024
  313   2HG   LYS  41          1HG       LYS  41   6.522 -10.323 -12.504
  314   1HD   LYS  41          2HD       LYS  41   7.986  -8.682 -13.602
  315   2HD   LYS  41          1HD       LYS  41   8.945  -8.559 -12.125
  316   1HE   LYS  41          2HE       LYS  41   9.563 -10.894 -12.301
  317   2HE   LYS  41          1HE       LYS  41   8.530 -11.086 -13.718
  318   1HZ   LYS  41          1HZ       LYS  41  10.908 -10.800 -14.261
  319   2HZ   LYS  41          2HZ       LYS  41  10.857  -9.242 -13.586
  320   3HZ   LYS  41          3HZ       LYS  41   9.922  -9.601 -14.951
  321    H    ASN  42           H        ASN  42   7.522  -5.891 -10.751
  322    HA   ASN  42           HA       ASN  42  10.249  -6.473 -10.490
  323   1HB   ASN  42          2HB       ASN  42   8.689  -3.916 -10.626
  324   2HB   ASN  42          1HB       ASN  42  10.418  -3.868 -10.308
  325   1HD2  ASN  42          1HD2      ASN  42  10.725  -2.763 -12.240
  326   2HD2  ASN  42          2HD2      ASN  42  10.679  -3.571 -13.772
  327    H    TRP  43           H        TRP  43   7.994  -5.029  -8.162
  328    HA   TRP  43           HA       TRP  43   9.879  -4.260  -6.235
  329   1HB   TRP  43          2HB       TRP  43   7.015  -5.148  -5.862
  330   2HB   TRP  43          1HB       TRP  43   7.997  -4.423  -4.597
  331    HD1  TRP  43           HD       TRP  43   9.165  -2.315  -7.078
  332    HE1  TRP  43           1HE      TRP  43   7.690  -0.244  -7.483
  333    HE3  TRP  43           3HE      TRP  43   4.856  -3.926  -4.841
  334    HZ2  TRP  43           2HZ      TRP  43   5.058   0.597  -6.921
  335    HZ3  TRP  43           3HZ      TRP  43   2.906  -2.425  -4.818
  336    HH2  TRP  43           HH       TRP  43   3.008  -0.210  -5.836
  337    H    ILE  44           H        ILE  44   8.211  -7.322  -6.739
  338    HA   ILE  44           HA       ILE  44   8.940  -8.587  -4.350
  339    HB   ILE  44           HB       ILE  44   8.471  -9.885  -7.043
  340   1HG1  ILE  44          2HG1      ILE  44   6.501  -9.325  -4.813
  341   2HG1  ILE  44          1HG1      ILE  44   6.628  -8.382  -6.294
  342   1HG2  ILE  44          1HG2      ILE  44   9.513 -11.393  -5.432
  343   2HG2  ILE  44          2HG2      ILE  44   7.838 -11.859  -5.728
  344   3HG2  ILE  44          3HG2      ILE  44   8.265 -11.006  -4.246
  345   1HD1  ILE  44          1HD1      ILE  44   4.796  -9.940  -6.451
  346   2HD1  ILE  44          2HD1      ILE  44   5.874 -11.288  -6.087
  347   3HD1  ILE  44          3HD1      ILE  44   6.062 -10.389  -7.593
  348    H    ILE  45           H        ILE  45  10.592  -8.385  -7.465
  349    HA   ILE  45           HA       ILE  45  12.674 -10.203  -6.702
  350    HB   ILE  45           HB       ILE  45  12.619  -8.249  -8.998
  351   1HG1  ILE  45          2HG1      ILE  45  11.895 -11.186  -8.909
  352   2HG1  ILE  45          1HG1      ILE  45  10.753  -9.858  -9.077
  353   1HG2  ILE  45          1HG2      ILE  45  14.380 -10.645  -8.492
  354   2HG2  ILE  45          2HG2      ILE  45  14.881  -8.955  -8.515
  355   3HG2  ILE  45          3HG2      ILE  45  14.322  -9.727  -9.997
  356   1HD1  ILE  45          1HD1      ILE  45  12.894 -10.593 -11.052
  357   2HD1  ILE  45          2HD1      ILE  45  11.746  -9.266 -11.222
  358   3HD1  ILE  45          3HD1      ILE  45  11.173 -10.934 -11.201
  359    H    LYS  46           H        LYS  46  12.294  -6.709  -6.776
  360    HA   LYS  46           HA       LYS  46  15.079  -6.179  -6.335
  361   1HB   LYS  46          2HB       LYS  46  13.586  -4.650  -7.587
  362   2HB   LYS  46          1HB       LYS  46  12.694  -4.335  -6.108
  363   1HG   LYS  46          2HG       LYS  46  14.648  -3.312  -5.110
  364   2HG   LYS  46          1HG       LYS  46  15.604  -3.690  -6.545
  365   1HD   LYS  46          2HD       LYS  46  14.155  -2.269  -7.900
  366   2HD   LYS  46          1HD       LYS  46  13.164  -1.916  -6.484
  367   1HE   LYS  46          2HE       LYS  46  14.668  -0.076  -6.902
  368   2HE   LYS  46          1HE       LYS  46  15.119  -0.883  -5.403
  369   1HZ   LYS  46          1HZ       LYS  46  17.012  -0.282  -6.859
  370   2HZ   LYS  46          2HZ       LYS  46  16.446  -1.380  -8.016
  371   3HZ   LYS  46          3HZ       LYS  46  16.946  -1.938  -6.492
  372    H    TYR  47           H        TYR  47  12.142  -5.857  -4.311
  373    HA   TYR  47           HA       TYR  47  13.772  -5.118  -2.030
  374   1HB   TYR  47          2HB       TYR  47  10.784  -5.509  -2.296
  375   2HB   TYR  47          1HB       TYR  47  11.595  -4.933  -0.841
  376    HD1  TYR  47           1HD      TYR  47  12.588  -2.697  -0.766
  377    HD2  TYR  47           2HD      TYR  47  10.567  -4.081  -4.249
  378    HE1  TYR  47           1HE      TYR  47  12.511  -0.397  -1.632
  379    HE2  TYR  47           2HE      TYR  47  10.489  -1.783  -5.122
  380    HH   TYR  47           HH       TYR  47  12.332   0.728  -3.866
  381    H    GLY  48           H        GLY  48  11.925  -7.868  -3.160
  382   1HA   GLY  48          2HA       GLY  48  12.754  -9.476  -0.872
  383   2HA   GLY  48          1HA       GLY  48  11.769 -10.016  -2.230
  384    H    SER  49           H        SER  49  14.996  -8.754  -1.575
  385    HA   SER  49           HA       SER  49  16.245  -9.342  -3.921
  386   1HB   SER  49          2HB       SER  49  17.534  -9.509  -1.191
  387   2HB   SER  49          1HB       SER  49  18.328  -9.122  -2.720
  388    HG   SER  49           HG       SER  49  16.758  -7.298  -2.789
  389    H    ASN  50           H        ASN  50  15.844 -11.491  -1.131
  390    HA   ASN  50           HA       ASN  50  15.730 -13.755  -1.002
  391   1HB   ASN  50          2HB       ASN  50  14.499 -13.818  -3.055
  392   2HB   ASN  50          1HB       ASN  50  15.965 -13.597  -4.007
  393   1HD2  ASN  50          1HD2      ASN  50  14.083 -15.801  -2.107
  394   2HD2  ASN  50          2HD2      ASN  50  14.881 -17.247  -2.621
  395    H    HIS  51           H        HIS  51  18.234 -12.735  -3.285
  396    HA   HIS  51           HA       HIS  51  19.928 -14.963  -2.686
  397   1HB   HIS  51          2HB       HIS  51  20.533 -12.387  -4.159
  398   2HB   HIS  51          1HB       HIS  51  21.593 -13.789  -4.093
  399    HD1  HIS  51           1HD      HIS  51  20.931 -15.859  -5.499
  400    HD2  HIS  51           2HD      HIS  51  18.365 -12.608  -5.906
  401    HE1  HIS  51           1HE      HIS  51  19.504 -16.360  -7.514
  402    HE2  HIS  51           2HE      HIS  51  17.823 -14.483  -7.605
  403    H    ASN  52           H        ASN  52  21.522 -15.124  -1.257
  404    HA   ASN  52           HA       ASN  52  22.551 -12.737   0.035
  405   1HB   ASN  52          2HB       ASN  52  20.750 -13.623   1.527
  406   2HB   ASN  52          1HB       ASN  52  21.626 -15.149   1.617
  407   1HD2  ASN  52          1HD2      ASN  52  21.620 -11.786   2.533
  408   2HD2  ASN  52          2HD2      ASN  52  22.844 -11.921   3.753
  409    H    VAL  53           H        VAL  53  24.549 -12.822  -0.457
  410    HA   VAL  53           HA       VAL  53  26.017 -14.869  -1.510
  411    HB   VAL  53           HB       VAL  53  28.049 -13.563  -0.784
  412   1HG1  VAL  53          1HG1      VAL  53  25.802 -12.142  -2.216
  413   2HG1  VAL  53          2HG1      VAL  53  27.030 -13.183  -2.940
  414   3HG1  VAL  53          3HG1      VAL  53  27.490 -11.629  -2.244
  415   1HG2  VAL  53          1HG2      VAL  53  27.670 -11.341   0.166
  416   2HG2  VAL  53          2HG2      VAL  53  27.145 -12.613   1.270
  417   3HG2  VAL  53          3HG2      VAL  53  25.953 -11.708   0.336
  418    H    GLN  54           H        GLN  54  25.398 -14.365   1.862
  419    HA   GLN  54           HA       GLN  54  26.077 -15.364   3.766
  420   1HB   GLN  54          2HB       GLN  54  26.815 -17.556   1.830
  421   2HB   GLN  54          1HB       GLN  54  26.929 -17.714   3.570
  422   1HG   GLN  54          2HG       GLN  54  24.363 -17.014   2.189
  423   2HG   GLN  54          1HG       GLN  54  24.876 -18.679   2.462
  424   1HE2  GLN  54          1HE2      GLN  54  23.680 -15.771   3.917
  425   2HE2  GLN  54          2HE2      GLN  54  23.343 -16.451   5.474
  426    H    GLY  55           H        GLY  55  27.626 -13.746   4.097
  427   1HA   GLY  55          2HA       GLY  55  30.252 -14.641   4.529
  428   2HA   GLY  55          1HA       GLY  55  30.210 -13.715   3.032
  429    H    THR  56           H        THR  56  30.388 -11.595   3.160
  430    HA   THR  56           HA       THR  56  30.907  -9.580   4.036
  431    HB   THR  56           HB       THR  56  29.112  -8.614   5.522
  432    HG1  THR  56           1HG      THR  56  28.512 -11.008   6.097
  433   1HG2  THR  56          1HG2      THR  56  27.446  -8.535   3.738
  434   2HG2  THR  56          2HG2      THR  56  28.226  -9.906   2.949
  435   3HG2  THR  56          3HG2      THR  56  29.082  -8.371   3.094
  436    H    THR  57           H        THR  57  32.802  -9.846   5.132
  437    HA   THR  57           HA       THR  57  32.581 -10.092   8.032
  438    HB   THR  57           HB       THR  57  33.123 -12.317   7.473
  439    HG1  THR  57           1HG      THR  57  35.062 -12.560   8.482
  440   1HG2  THR  57          1HG2      THR  57  33.717 -12.018   5.137
  441   2HG2  THR  57          2HG2      THR  57  34.963 -12.948   5.969
  442   3HG2  THR  57          3HG2      THR  57  35.232 -11.244   5.599
  443    HA   PRO  58           HA       PRO  58  35.174  -6.469   7.416
  444   1HB   PRO  58          2HB       PRO  58  35.164  -5.763  10.056
  445   2HB   PRO  58          1HB       PRO  58  33.861  -5.363   8.933
  446   1HG   PRO  58          2HG       PRO  58  34.026  -7.587  10.924
  447   2HG   PRO  58          1HG       PRO  58  32.655  -6.530  10.536
  448   1HD   PRO  58          2HD       PRO  58  32.838  -9.044   9.573
  449   2HD   PRO  58          1HD       PRO  58  32.106  -7.728   8.636
  450    H    SER  59           H        SER  59  35.579  -9.084   9.665
  451    HA   SER  59           HA       SER  59  38.148  -8.429  10.619
  452   1HB   SER  59          2HB       SER  59  36.937 -11.192  10.391
  453   2HB   SER  59          1HB       SER  59  38.184 -10.661  11.521
  454    HG   SER  59           HG       SER  59  36.005 -10.749  12.400
  455    H    ALA  60           H        ALA  60  37.030 -10.303   7.851
  456    HA   ALA  60           HA       ALA  60  39.686 -11.144   7.127
  457   1HB   ALA  60          1HB       ALA  60  38.653 -12.104   5.149
  458   2HB   ALA  60          2HB       ALA  60  37.144 -11.261   5.510
  459   3HB   ALA  60          3HB       ALA  60  37.735 -12.517   6.597
  460    H    ALA  61           H        ALA  61  37.743  -8.381   6.621
  461    HA   ALA  61           HA       ALA  61  39.000  -7.568   4.165
  462   1HB   ALA  61          1HB       ALA  61  36.674  -6.963   4.667
  463   2HB   ALA  61          2HB       ALA  61  37.680  -5.547   4.354
  464   3HB   ALA  61          3HB       ALA  61  37.240  -5.973   6.009
  465    H    VAL  62           H        VAL  62  39.942  -7.578   7.329
  466    HA   VAL  62           HA       VAL  62  41.435  -5.120   7.345
  467    HB   VAL  62           HB       VAL  62  41.755  -7.537   9.141
  468   1HG1  VAL  62          1HG1      VAL  62  42.673  -4.687   9.498
  469   2HG1  VAL  62          2HG1      VAL  62  43.705  -6.077   9.166
  470   3HG1  VAL  62          3HG1      VAL  62  42.830  -5.978  10.693
  471   1HG2  VAL  62          1HG2      VAL  62  39.499  -6.665   9.299
  472   2HG2  VAL  62          2HG2      VAL  62  40.124  -5.031   9.529
  473   3HG2  VAL  62          3HG2      VAL  62  40.403  -6.262  10.761
  474    H    SER  63           H        SER  63  41.990  -8.457   6.559
  475    HA   SER  63           HA       SER  63  44.798  -8.372   6.285
  476   1HB   SER  63          2HB       SER  63  42.887 -10.156   4.773
  477   2HB   SER  63          1HB       SER  63  44.557 -10.497   5.221
  478    HG   SER  63           HG       SER  63  43.466 -11.497   6.792
  479    H    GLU  64           H        GLU  64  42.142  -7.531   4.225
  480    HA   GLU  64           HA       GLU  64  43.595  -7.406   1.783
  481   1HB   GLU  64          2HB       GLU  64  41.064  -7.646   2.111
  482   2HB   GLU  64          1HB       GLU  64  41.052  -5.911   2.390
  483   1HG   GLU  64          2HG       GLU  64  40.479  -6.242   0.126
  484   2HG   GLU  64          1HG       GLU  64  42.136  -5.643   0.147
  485    H    ALA  65           H        ALA  65  43.383  -5.360   4.489
  486    HA   ALA  65           HA       ALA  65  43.546  -2.813   3.340
  487   1HB   ALA  65          1HB       ALA  65  44.373  -2.058   5.508
  488   2HB   ALA  65          2HB       ALA  65  44.656  -3.732   5.989
  489   3HB   ALA  65          3HB       ALA  65  43.013  -3.165   5.690
  490    H    GLU  66           H        GLU  66  45.987  -5.258   3.815
  491    HA   GLU  66           HA       GLU  66  48.289  -3.651   3.545
  492   1HB   GLU  66          2HB       GLU  66  47.830  -6.295   3.995
  493   2HB   GLU  66          1HB       GLU  66  48.349  -6.343   2.317
  494   1HG   GLU  66          2HG       GLU  66  49.915  -5.103   4.570
  495   2HG   GLU  66          1HG       GLU  66  50.177  -6.719   3.925
  496    H    GLN  67           H        GLN  67  46.184  -5.238   1.210
  497    HA   GLN  67           HA       GLN  67  47.662  -4.386  -1.097
  498   1HB   GLN  67          2HB       GLN  67  44.863  -5.507  -0.800
  499   2HB   GLN  67          1HB       GLN  67  45.612  -5.146  -2.346
  500   1HG   GLN  67          2HG       GLN  67  45.749  -7.504  -1.911
  501   2HG   GLN  67          1HG       GLN  67  47.364  -6.802  -1.861
  502   1HE2  GLN  67          1HE2      GLN  67  44.737  -8.086   0.086
  503   2HE2  GLN  67          2HE2      GLN  67  45.710  -8.436   1.483
  504    H    ILE  68           H        ILE  68  44.752  -3.360   0.598
  505    HA   ILE  68           HA       ILE  68  43.825  -1.399  -1.133
  506    HB   ILE  68           HB       ILE  68  43.667  -1.488   1.885
  507   1HG1  ILE  68          2HG1      ILE  68  41.687  -2.280  -0.259
  508   2HG1  ILE  68          1HG1      ILE  68  42.630  -3.391   0.721
  509   1HG2  ILE  68          1HG2      ILE  68  42.149   0.242  -0.060
  510   2HG2  ILE  68          2HG2      ILE  68  43.306   0.787   1.154
  511   3HG2  ILE  68          3HG2      ILE  68  41.773   0.073   1.656
  512   1HD1  ILE  68          1HD1      ILE  68  41.487  -2.615   2.723
  513   2HD1  ILE  68          2HD1      ILE  68  40.344  -3.215   1.522
  514   3HD1  ILE  68          3HD1      ILE  68  40.551  -1.479   1.752
  515    H    ARG  69           H        ARG  69  46.195  -1.079   1.513
  516    HA   ARG  69           HA       ARG  69  46.417   1.725   1.274
  517   1HB   ARG  69          2HB       ARG  69  48.356   1.588   2.693
  518   2HB   ARG  69          1HB       ARG  69  47.114   0.506   3.297
  519   1HG   ARG  69          2HG       ARG  69  48.296  -1.406   2.427
  520   2HG   ARG  69          1HG       ARG  69  49.494  -0.355   1.665
  521   1HD   ARG  69          2HD       ARG  69  50.175   0.470   3.858
  522   2HD   ARG  69          1HD       ARG  69  48.958  -0.543   4.630
  523    HE   ARG  69           HE       ARG  69  50.451  -2.326   3.234
  524   1HH1  ARG  69          1HH1      ARG  69  51.288   0.207   5.528
  525   2HH1  ARG  69          2HH1      ARG  69  52.679  -0.643   6.139
  526   1HH2  ARG  69          1HH2      ARG  69  52.243  -3.435   4.042
  527   2HH2  ARG  69          2HH2      ARG  69  53.207  -2.742   5.320
  528    H    GLN  70           H        GLN  70  47.949  -0.883  -0.472
  529    HA   GLN  70           HA       GLN  70  50.070   0.628  -1.590
  530   1HB   GLN  70          2HB       GLN  70  49.876  -1.887  -1.550
  531   2HB   GLN  70          1HB       GLN  70  48.670  -1.744  -2.814
  532   1HG   GLN  70          2HG       GLN  70  50.458  -0.430  -4.085
  533   2HG   GLN  70          1HG       GLN  70  51.585  -1.135  -2.932
  534   1HE2  GLN  70          1HE2      GLN  70  51.963  -3.368  -2.973
  535   2HE2  GLN  70          2HE2      GLN  70  51.512  -4.341  -4.333
  536    H    LEU  71           H        LEU  71  46.885  -0.326  -2.765
  537    HA   LEU  71           HA       LEU  71  47.152   0.929  -5.287
  538   1HB   LEU  71          2HB       LEU  71  44.974  -0.418  -3.781
  539   2HB   LEU  71          1HB       LEU  71  44.541   0.564  -5.155
  540    HG   LEU  71           HG       LEU  71  44.705  -1.728  -5.851
  541   1HD1  LEU  71          1HD1      LEU  71  47.095  -0.168  -6.821
  542   2HD1  LEU  71          2HD1      LEU  71  45.451  -0.047  -7.452
  543   3HD1  LEU  71          3HD1      LEU  71  46.359  -1.548  -7.634
  544   1HD2  LEU  71          1HD2      LEU  71  47.528  -1.670  -4.791
  545   2HD2  LEU  71          2HD2      LEU  71  46.788  -2.997  -5.684
  546   3HD2  LEU  71          3HD2      LEU  71  46.174  -2.559  -4.091
  547    H    LYS  72           H        LYS  72  45.749   1.957  -2.222
  548    HA   LYS  72           HA       LYS  72  44.375   4.165  -3.456
  549   1HB   LYS  72          2HB       LYS  72  43.537   2.920  -1.433
  550   2HB   LYS  72          1HB       LYS  72  44.798   3.725  -0.505
  551   1HG   LYS  72          2HG       LYS  72  43.846   5.903  -1.133
  552   2HG   LYS  72          1HG       LYS  72  42.566   5.072  -2.016
  553   1HD   LYS  72          2HD       LYS  72  41.876   3.987   0.100
  554   2HD   LYS  72          1HD       LYS  72  43.096   4.941   0.948
  555   1HE   LYS  72          2HE       LYS  72  40.739   6.007  -0.603
  556   2HE   LYS  72          1HE       LYS  72  40.929   6.005   1.149
  557   1HZ   LYS  72          1HZ       LYS  72  42.690   7.464  -0.753
  558   2HZ   LYS  72          2HZ       LYS  72  42.789   7.507   0.938
  559   3HZ   LYS  72          3HZ       LYS  72  41.441   8.171   0.150
  560    H    LYS  73           H        LYS  73  47.417   3.708  -1.787
  561    HA   LYS  73           HA       LYS  73  47.869   6.540  -1.455
  562   1HB   LYS  73          2HB       LYS  73  48.841   4.985   0.157
  563   2HB   LYS  73          1HB       LYS  73  49.741   4.187  -1.123
  564   1HG   LYS  73          2HG       LYS  73  51.195   5.640   0.138
  565   2HG   LYS  73          1HG       LYS  73  51.016   6.242  -1.508
  566   1HD   LYS  73          2HD       LYS  73  50.855   8.161  -0.191
  567   2HD   LYS  73          1HD       LYS  73  49.177   7.755  -0.547
  568   1HE   LYS  73          2HE       LYS  73  50.606   6.966   1.989
  569   2HE   LYS  73          1HE       LYS  73  49.627   8.420   1.829
  570   1HZ   LYS  73          1HZ       LYS  73  48.702   5.611   1.587
  571   2HZ   LYS  73          2HZ       LYS  73  47.735   6.960   1.240
  572   3HZ   LYS  73          3HZ       LYS  73  48.309   6.709   2.815
  573    H    GLU  74           H        GLU  74  48.015   7.644  -3.263
  574    HA   GLU  74           HA       GLU  74  48.770   8.464  -5.226
  575   1HB   GLU  74          2HB       GLU  74  51.070   6.532  -4.882
  576   2HB   GLU  74          1HB       GLU  74  51.009   7.872  -6.021
  577   1HG   GLU  74          2HG       GLU  74  50.916   9.457  -4.196
  578   2HG   GLU  74          1HG       GLU  74  50.894   8.137  -3.026
  579    H    ASN  75           H        ASN  75  47.630   8.050  -6.967
  580    HA   ASN  75           HA       ASN  75  47.685   5.335  -8.095
  581   1HB   ASN  75          2HB       ASN  75  45.594   5.921  -6.684
  582   2HB   ASN  75          1HB       ASN  75  45.159   6.981  -8.021
  583   1HD2  ASN  75          1HD2      ASN  75  45.530   3.709  -6.953
  584   2HD2  ASN  75          2HD2      ASN  75  44.737   2.968  -8.302
  585    H    ALA  76           H        ALA  76  46.407   5.496 -10.347
  586    HA   ALA  76           HA       ALA  76  48.154   6.855 -12.029
  587   1HB   ALA  76          1HB       ALA  76  46.649   6.197 -13.844
  588   2HB   ALA  76          2HB       ALA  76  45.424   5.756 -12.653
  589   3HB   ALA  76          3HB       ALA  76  46.947   4.870 -12.720
  590    H    LEU  77           H        LEU  77  45.168   7.903 -10.606
  591    HA   LEU  77           HA       LEU  77  44.389   9.929 -12.342
  592   1HB   LEU  77          2HB       LEU  77  44.150   9.751  -9.339
  593   2HB   LEU  77          1HB       LEU  77  43.317  10.929 -10.327
  594    HG   LEU  77           HG       LEU  77  42.939   7.942 -10.504
  595   1HD1  LEU  77          1HD1      LEU  77  40.713   8.423  -9.546
  596   2HD1  LEU  77          2HD1      LEU  77  41.208  10.099  -9.303
  597   3HD1  LEU  77          3HD1      LEU  77  42.030   8.802  -8.436
  598   1HD2  LEU  77          1HD2      LEU  77  42.590   9.086 -12.643
  599   2HD2  LEU  77          2HD2      LEU  77  41.459  10.192 -11.863
  600   3HD2  LEU  77          3HD2      LEU  77  41.074   8.475 -11.979
  601    H    GLN  78           H        GLN  78  47.017   9.817 -10.085
  602    HA   GLN  78           HA       GLN  78  47.408  12.671 -10.000
  603   1HB   GLN  78          2HB       GLN  78  49.142  10.368  -9.093
  604   2HB   GLN  78          1HB       GLN  78  49.518  12.062  -8.811
  605   1HG   GLN  78          2HG       GLN  78  47.033  10.684  -7.810
  606   2HG   GLN  78          1HG       GLN  78  48.506  10.907  -6.866
  607   1HE2  GLN  78          1HE2      GLN  78  45.766  11.911  -6.424
  608   2HE2  GLN  78          2HE2      GLN  78  45.936  13.632  -6.292
  609    H    ARG  79           H        ARG  79  49.054   9.908 -11.520
  610    HA   ARG  79           HA       ARG  79  51.023  11.630 -12.738
  611   1HB   ARG  79          2HB       ARG  79  51.364   9.242 -11.818
  612   2HB   ARG  79          1HB       ARG  79  50.686   8.707 -13.348
  613   1HG   ARG  79          2HG       ARG  79  53.129   8.716 -13.395
  614   2HG   ARG  79          1HG       ARG  79  52.452   9.858 -14.559
  615   1HD   ARG  79          2HD       ARG  79  52.845  11.691 -12.984
  616   2HD   ARG  79          1HD       ARG  79  53.518  10.549 -11.823
  617    HE   ARG  79           HE       ARG  79  55.337  10.173 -13.403
  618   1HH1  ARG  79          1HH1      ARG  79  53.344  13.007 -13.901
  619   2HH1  ARG  79          2HH1      ARG  79  54.581  13.875 -14.761
  620   1HH2  ARG  79          1HH2      ARG  79  56.982  11.333 -14.490
  621   2HH2  ARG  79          2HH2      ARG  79  56.643  12.938 -15.076
  622    H    ALA  80           H        ALA  80  47.968  10.514 -13.559
  623    HA   ALA  80           HA       ALA  80  48.083  10.078 -16.299
  624   1HB   ALA  80          1HB       ALA  80  45.819  11.323 -14.751
  625   2HB   ALA  80          2HB       ALA  80  46.121   9.594 -14.932
  626   3HB   ALA  80          3HB       ALA  80  45.706  10.568 -16.342
  627    H    ARG  81           H        ARG  81  48.540  13.007 -14.619
  628    HA   ARG  81           HA       ARG  81  47.446  14.947 -16.258
  629   1HB   ARG  81          2HB       ARG  81  50.023  15.032 -14.697
  630   2HB   ARG  81          1HB       ARG  81  49.224  16.437 -15.378
  631   1HG   ARG  81          2HG       ARG  81  47.297  16.056 -13.942
  632   2HG   ARG  81          1HG       ARG  81  48.067  14.609 -13.284
  633   1HD   ARG  81          2HD       ARG  81  49.939  16.017 -12.483
  634   2HD   ARG  81          1HD       ARG  81  49.078  17.443 -13.062
  635    HE   ARG  81           HE       ARG  81  47.472  15.887 -11.289
  636   1HH1  ARG  81          1HH1      ARG  81  50.088  18.220 -11.378
  637   2HH1  ARG  81          2HH1      ARG  81  49.758  18.840  -9.789
  638   1HH2  ARG  81          1HH2      ARG  81  47.041  16.709  -9.195
  639   2HH2  ARG  81          2HH2      ARG  81  48.036  17.983  -8.551
  640    H    THR  82           H        THR  82  50.223  12.999 -16.818
  641    HA   THR  82           HA       THR  82  51.485  14.753 -18.683
  642    HB   THR  82           HB       THR  82  52.006  11.807 -18.273
  643    HG1  THR  82           1HG      THR  82  52.587  14.063 -16.743
  644   1HG2  THR  82          1HG2      THR  82  53.045  12.705 -20.290
  645   2HG2  THR  82          2HG2      THR  82  54.271  12.380 -19.063
  646   3HG2  THR  82          3HG2      THR  82  53.739  14.035 -19.354
  647    H    ARG  83           H        ARG  83  49.244  12.084 -18.968
  648    HA   ARG  83           HA       ARG  83  49.349  12.367 -21.887
  649   1HB   ARG  83          2HB       ARG  83  49.112   9.864 -20.227
  650   2HB   ARG  83          1HB       ARG  83  48.746   9.916 -21.942
  651   1HG   ARG  83          2HG       ARG  83  51.023  10.645 -22.417
  652   2HG   ARG  83          1HG       ARG  83  51.393  10.610 -20.695
  653   1HD   ARG  83          2HD       ARG  83  50.939   8.196 -20.664
  654   2HD   ARG  83          1HD       ARG  83  50.599   8.248 -22.395
  655    HE   ARG  83           HE       ARG  83  53.165   9.332 -21.833
  656   1HH1  ARG  83          1HH1      ARG  83  51.452   6.283 -22.080
  657   2HH1  ARG  83          2HH1      ARG  83  52.866   5.383 -22.549
  658   1HH2  ARG  83          1HH2      ARG  83  55.032   8.149 -22.382
  659   2HH2  ARG  83          2HH2      ARG  83  54.919   6.439 -22.685
  660    H    HIS  84           H        HIS  84  47.241  10.824 -22.634
  661    HA   HIS  84           HA       HIS  84  44.934  11.697 -21.071
  662   1HB   HIS  84          2HB       HIS  84  45.479  13.507 -22.737
  663   2HB   HIS  84          1HB       HIS  84  45.157  12.343 -24.016
  664    HD1  HIS  84           1HD      HIS  84  42.852  12.539 -24.931
  665    HD2  HIS  84           2HD      HIS  84  43.043  13.668 -20.932
  666    HE1  HIS  84           1HE      HIS  84  40.526  13.266 -24.316
  667    HE2  HIS  84           2HE      HIS  84  40.628  13.748 -21.845
  668    HA   PRO  85           HA       PRO  85  43.934   7.576 -22.607
  669   1HB   PRO  85          2HB       PRO  85  42.197   6.949 -20.664
  670   2HB   PRO  85          1HB       PRO  85  43.942   6.943 -20.378
  671   1HG   PRO  85          2HG       PRO  85  41.913   9.026 -19.667
  672   2HG   PRO  85          1HG       PRO  85  43.265   8.410 -18.701
  673   1HD   PRO  85          2HD       PRO  85  43.326  10.759 -20.116
  674   2HD   PRO  85          1HD       PRO  85  44.767   9.809 -19.708
  675    H    ALA  86           H        ALA  86  41.724   6.494 -22.953
  676    HA   ALA  86           HA       ALA  86  39.626   8.440 -23.599
  677   1HB   ALA  86          1HB       ALA  86  40.717   6.415 -25.558
  678   2HB   ALA  86          2HB       ALA  86  40.958   8.162 -25.627
  679   3HB   ALA  86          3HB       ALA  86  39.341   7.487 -25.829
  680    H    GLU  87           H        GLU  87  39.799   6.575 -21.469
  681    HA   GLU  87           HA       GLU  87  38.783   4.052 -21.895
  682   1HB   GLU  87          2HB       GLU  87  38.042   4.159 -19.506
  683   2HB   GLU  87          1HB       GLU  87  39.716   4.619 -19.780
  684   1HG   GLU  87          2HG       GLU  87  38.991   7.003 -19.728
  685   2HG   GLU  87          1HG       GLU  87  37.385   6.448 -19.256
  686    H    SER  88           H        SER  88  36.915   7.014 -21.220
  687    HA   SER  88           HA       SER  88  34.416   5.599 -21.418
  688   1HB   SER  88          2HB       SER  88  34.886   8.585 -21.374
  689   2HB   SER  88          1HB       SER  88  33.396   7.734 -20.960
  690    HG   SER  88           HG       SER  88  35.699   8.129 -19.483
  691    H    CYS  89           H        CYS  89  36.523   7.304 -23.554
  692    HA   CYS  89           HA       CYS  89  34.563   8.059 -25.474
  693   1HB   CYS  89          2HB       CYS  89  36.770   9.185 -25.212
  694   2HB   CYS  89          1HB       CYS  89  37.539   7.747 -25.871
  695    HG   CYS  89           HG       CYS  89  35.701  10.113 -27.448
  696    H    LEU  90           H        LEU  90  36.598   5.273 -25.001
  697    HA   LEU  90           HA       LEU  90  36.169   4.186 -27.590
  698   1HB   LEU  90          2HB       LEU  90  37.147   2.121 -26.712
  699   2HB   LEU  90          1HB       LEU  90  38.120   3.530 -26.353
  700    HG   LEU  90           HG       LEU  90  36.863   3.422 -24.039
  701   1HD1  LEU  90          1HD1      LEU  90  36.729   0.564 -24.983
  702   2HD1  LEU  90          2HD1      LEU  90  35.354   1.611 -24.629
  703   3HD1  LEU  90          3HD1      LEU  90  36.446   1.120 -23.333
  704   1HD2  LEU  90          1HD2      LEU  90  38.700   2.027 -23.184
  705   2HD2  LEU  90          2HD2      LEU  90  39.258   3.261 -24.313
  706   3HD2  LEU  90          3HD2      LEU  90  39.111   1.585 -24.843
  707    H    GLU  91           H        GLU  91  34.426   3.985 -24.571
  708    HA   GLU  91           HA       GLU  91  32.675   1.895 -25.538
  709   1HB   GLU  91          2HB       GLU  91  32.541   3.659 -23.092
  710   2HB   GLU  91          1HB       GLU  91  31.340   2.437 -23.475
  711   1HG   GLU  91          2HG       GLU  91  33.255   0.778 -23.473
  712   2HG   GLU  91          1HG       GLU  91  34.211   2.058 -22.723
  713    H    HIS  92           H        HIS  92  32.585   5.395 -25.118
  714    HA   HIS  92           HA       HIS  92  31.051   7.005 -25.607
  715   1HB   HIS  92          2HB       HIS  92  29.763   4.889 -27.364
  716   2HB   HIS  92          1HB       HIS  92  29.321   6.590 -27.343
  717    HD1  HIS  92           1HD      HIS  92  31.061   8.273 -28.389
  718    HD2  HIS  92           2HD      HIS  92  31.961   4.239 -28.901
  719    HE1  HIS  92           1HE      HIS  92  32.795   8.189 -30.204
  720    HE2  HIS  92           2HE      HIS  92  33.230   5.737 -30.594
  721    H    HIS  93           H        HIS  93  28.318   7.091 -25.659
  722    HA   HIS  93           HA       HIS  93  27.662   5.681 -23.158
  723   1HB   HIS  93          2HB       HIS  93  27.533   8.283 -23.420
  724   2HB   HIS  93          1HB       HIS  93  26.004   7.940 -24.226
  725    HD1  HIS  93           1HD      HIS  93  24.377   8.713 -22.462
  726    HD2  HIS  93           2HD      HIS  93  27.274   6.132 -20.957
  727    HE1  HIS  93           1HE      HIS  93  23.666   8.191 -20.104
  728    HE2  HIS  93           2HE      HIS  93  25.538   6.786 -19.153
  729    H    HIS  94           H        HIS  94  26.852   6.057 -26.459
  730    HA   HIS  94           HA       HIS  94  25.657   4.773 -27.880
  731   1HB   HIS  94          2HB       HIS  94  25.298   3.096 -25.419
  732   2HB   HIS  94          1HB       HIS  94  24.424   2.724 -26.901
  733    HD1  HIS  94           1HD      HIS  94  25.700   1.585 -28.765
  734    HD2  HIS  94           2HD      HIS  94  28.136   2.792 -25.613
  735    HE1  HIS  94           1HE      HIS  94  27.944   0.529 -29.194
  736    HE2  HIS  94           2HE      HIS  94  29.350   1.129 -27.188
  737    H    HIS  95           H        HIS  95  23.727   4.931 -28.791
  738    HA   HIS  95           HA       HIS  95  21.335   5.328 -27.217
  739   1HB   HIS  95          2HB       HIS  95  22.227   7.630 -27.433
  740   2HB   HIS  95          1HB       HIS  95  22.266   7.443 -29.184
  741    HD1  HIS  95           1HD      HIS  95  20.079   7.711 -30.457
  742    HD2  HIS  95           2HD      HIS  95  19.616   7.906 -26.327
  743    HE1  HIS  95           1HE      HIS  95  17.733   8.530 -30.074
  744    HE2  HIS  95           2HE      HIS  95  17.403   8.405 -27.579
  745    H    HIS  96           H        HIS  96  19.469   4.781 -28.368
  746    HA   HIS  96           HA       HIS  96  19.669   4.331 -31.238
  747   1HB   HIS  96          2HB       HIS  96  18.994   2.026 -31.185
  748   2HB   HIS  96          1HB       HIS  96  20.398   2.177 -30.138
  749    HD1  HIS  96           1HD      HIS  96  16.698   1.526 -30.063
  750    HD2  HIS  96           2HD      HIS  96  19.920   1.663 -27.423
  751    HE1  HIS  96           1HE      HIS  96  15.866   0.514 -27.919
  752    HE2  HIS  96           2HE      HIS  96  17.784   0.723 -26.296
  753    H    HIS  97           H        HIS  97  17.571   3.979 -32.232
  754    HA   HIS  97           HA       HIS  97  15.296   4.396 -30.410
  755   1HB   HIS  97          2HB       HIS  97  15.645   6.311 -31.983
  756   2HB   HIS  97          1HB       HIS  97  15.450   5.195 -33.330
  757    HD1  HIS  97           1HD      HIS  97  13.155   4.959 -34.203
  758    HD2  HIS  97           2HD      HIS  97  13.195   6.438 -30.316
  759    HE1  HIS  97           1HE      HIS  97  10.767   5.553 -33.679
  760    HE2  HIS  97           2HE      HIS  97  10.806   6.435 -31.317
  Start of MODEL   15
    1   1H    MET   1          1HT       MET   1   2.795  22.786  -7.833
    2   2H    MET   1          2HT       MET   1   1.372  21.891  -7.590
    3   3H    MET   1          3HT       MET   1   2.603  21.277  -8.580
    4    HA   MET   1           HA       MET   1   4.084  21.092  -6.706
    5   1HB   MET   1          2HB       MET   1   1.682  22.067  -5.140
    6   2HB   MET   1          1HB       MET   1   3.150  21.419  -4.424
    7   1HG   MET   1          2HG       MET   1   3.006  23.888  -6.137
    8   2HG   MET   1          1HG       MET   1   3.059  23.870  -4.375
    9   1HE   MET   1          1HE       MET   1   6.600  22.397  -3.659
   10   2HE   MET   1          2HE       MET   1   5.067  21.529  -3.748
   11   3HE   MET   1          3HE       MET   1   5.143  23.102  -2.955
   12    HA   PRO   2           HA       PRO   2   1.428  17.371  -6.971
   13   1HB   PRO   2          2HB       PRO   2   3.007  15.852  -8.499
   14   2HB   PRO   2          1HB       PRO   2   2.040  17.155  -9.200
   15   1HG   PRO   2          2HG       PRO   2   4.961  17.056  -8.634
   16   2HG   PRO   2          1HG       PRO   2   4.095  17.874  -9.944
   17   1HD   PRO   2          2HD       PRO   2   5.043  19.042  -7.557
   18   2HD   PRO   2          1HD       PRO   2   3.948  19.785  -8.739
   19    H    THR   3           H        THR   3   1.751  15.195  -6.142
   20    HA   THR   3           HA       THR   3   4.276  14.776  -4.718
   21    HB   THR   3           HB       THR   3   2.689  15.531  -3.040
   22    HG1  THR   3           1HG      THR   3   4.016  14.087  -2.129
   23   1HG2  THR   3          1HG2      THR   3   0.992  13.162  -3.832
   24   2HG2  THR   3          2HG2      THR   3   0.604  14.852  -4.159
   25   3HG2  THR   3          3HG2      THR   3   0.674  14.269  -2.496
   26    H    LYS   4           H        LYS   4   4.786  12.604  -4.317
   27    HA   LYS   4           HA       LYS   4   3.416  10.412  -5.478
   28   1HB   LYS   4          2HB       LYS   4   4.141  11.790  -7.516
   29   2HB   LYS   4          1HB       LYS   4   5.788  11.372  -7.085
   30   1HG   LYS   4          2HG       LYS   4   3.666   9.326  -7.666
   31   2HG   LYS   4          1HG       LYS   4   4.739   9.993  -8.895
   32   1HD   LYS   4          2HD       LYS   4   6.649   9.238  -7.357
   33   2HD   LYS   4          1HD       LYS   4   5.423   8.273  -6.530
   34   1HE   LYS   4          2HE       LYS   4   6.477   6.876  -8.158
   35   2HE   LYS   4          1HE       LYS   4   4.852   7.249  -8.732
   36   1HZ   LYS   4          1HZ       LYS   4   5.752   8.892 -10.219
   37   2HZ   LYS   4          2HZ       LYS   4   6.550   7.417 -10.477
   38   3HZ   LYS   4          3HZ       LYS   4   7.318   8.656  -9.612
   39    H    THR   5           H        THR   5   4.016   9.167  -3.786
   40    HA   THR   5           HA       THR   5   6.891   8.697  -3.425
   41    HB   THR   5           HB       THR   5   5.197   8.700  -0.983
   42    HG1  THR   5           1HG      THR   5   4.654  10.690  -1.988
   43   1HG2  THR   5          1HG2      THR   5   7.274   9.517   0.038
   44   2HG2  THR   5          2HG2      THR   5   8.024   9.593  -1.558
   45   3HG2  THR   5          3HG2      THR   5   7.546   8.036  -0.880
   46    H    TYR   6           H        TYR   6   7.403   6.667  -2.517
   47    HA   TYR   6           HA       TYR   6   5.238   4.744  -2.162
   48   1HB   TYR   6          2HB       TYR   6   7.565   4.481  -4.048
   49   2HB   TYR   6          1HB       TYR   6   6.808   3.061  -3.347
   50    HD1  TYR   6           1HD      TYR   6   6.715   5.419  -5.997
   51    HD2  TYR   6           2HD      TYR   6   4.258   2.812  -3.704
   52    HE1  TYR   6           1HE      TYR   6   5.022   5.453  -7.779
   53    HE2  TYR   6           2HE      TYR   6   2.566   2.827  -5.484
   54    HH   TYR   6           HH       TYR   6   1.871   4.226  -7.348
   55    H    SER   7           H        SER   7   5.481   4.228  -0.090
   56    HA   SER   7           HA       SER   7   8.051   4.266   1.187
   57   1HB   SER   7          2HB       SER   7   6.719   3.496   3.183
   58   2HB   SER   7          1HB       SER   7   6.165   5.010   2.473
   59    HG   SER   7           HG       SER   7   4.500   3.404   2.989
   60    H    GLU   8           H        GLU   8   8.837   2.386   2.461
   61    HA   GLU   8           HA       GLU   8   9.083   0.120   0.777
   62   1HB   GLU   8          2HB       GLU   8   9.870   0.521   3.664
   63   2HB   GLU   8          1HB       GLU   8  10.265  -0.916   2.732
   64   1HG   GLU   8          2HG       GLU   8  11.407   0.627   1.089
   65   2HG   GLU   8          1HG       GLU   8  11.228   1.894   2.304
   66    H    GLU   9           H        GLU   9   7.131   0.789   3.644
   67    HA   GLU   9           HA       GLU   9   6.231  -1.783   4.184
   68   1HB   GLU   9          2HB       GLU   9   5.378   0.950   4.798
   69   2HB   GLU   9          1HB       GLU   9   4.073  -0.223   4.797
   70   1HG   GLU   9          2HG       GLU   9   5.044   0.069   7.015
   71   2HG   GLU   9          1HG       GLU   9   5.244  -1.579   6.423
   72    H    PHE  10           H        PHE  10   5.019   0.599   1.884
   73    HA   PHE  10           HA       PHE  10   2.648  -0.725   1.160
   74   1HB   PHE  10          2HB       PHE  10   3.246   1.654   0.605
   75   2HB   PHE  10          1HB       PHE  10   4.363   1.041  -0.607
   76    HD1  PHE  10           1HD      PHE  10   3.613   0.476  -2.752
   77    HD2  PHE  10           2HD      PHE  10   0.797   1.151   0.363
   78    HE1  PHE  10           1HE      PHE  10   1.788   0.454  -4.403
   79    HE2  PHE  10           2HE      PHE  10  -1.035   1.125  -1.276
   80    HZ   PHE  10           HZ       PHE  10  -0.542   0.777  -3.665
   81    H    LYS  11           H        LYS  11   5.927  -0.860  -0.179
   82    HA   LYS  11           HA       LYS  11   5.224  -2.754  -2.210
   83   1HB   LYS  11          2HB       LYS  11   7.983  -2.085  -1.201
   84   2HB   LYS  11          1HB       LYS  11   7.555  -2.781  -2.757
   85   1HG   LYS  11          2HG       LYS  11   6.434  -0.704  -3.384
   86   2HG   LYS  11          1HG       LYS  11   6.866  -0.002  -1.824
   87   1HD   LYS  11          2HD       LYS  11   9.256  -0.399  -2.391
   88   2HD   LYS  11          1HD       LYS  11   8.740  -0.917  -3.994
   89   1HE   LYS  11          2HE       LYS  11   7.830   1.261  -4.461
   90   2HE   LYS  11          1HE       LYS  11   8.154   1.793  -2.810
   91   1HZ   LYS  11          1HZ       LYS  11   9.866   2.633  -4.222
   92   2HZ   LYS  11          2HZ       LYS  11  10.155   1.106  -4.896
   93   3HZ   LYS  11          3HZ       LYS  11  10.545   1.401  -3.273
   94    H    ARG  12           H        ARG  12   6.776  -2.915   0.965
   95    HA   ARG  12           HA       ARG  12   7.602  -5.584   0.931
   96   1HB   ARG  12          2HB       ARG  12   6.746  -3.782   3.185
   97   2HB   ARG  12          1HB       ARG  12   7.291  -5.426   3.474
   98   1HG   ARG  12          2HG       ARG  12   9.464  -4.911   2.574
   99   2HG   ARG  12          1HG       ARG  12   8.926  -3.297   2.105
  100   1HD   ARG  12          2HD       ARG  12   8.613  -2.670   4.401
  101   2HD   ARG  12          1HD       ARG  12   8.949  -4.313   4.944
  102    HE   ARG  12           HE       ARG  12  11.221  -3.696   3.673
  103   1HH1  ARG  12          1HH1      ARG  12   9.332  -1.794   5.951
  104   2HH1  ARG  12          2HH1      ARG  12  10.739  -1.066   6.675
  105   1HH2  ARG  12          1HH2      ARG  12  13.046  -2.746   4.632
  106   2HH2  ARG  12          2HH2      ARG  12  12.841  -1.579   5.904
  107    H    ASP  13           H        ASP  13   4.509  -4.161   1.900
  108    HA   ASP  13           HA       ASP  13   3.295  -6.540   2.806
  109   1HB   ASP  13          2HB       ASP  13   2.395  -4.309   3.321
  110   2HB   ASP  13          1HB       ASP  13   2.015  -4.064   1.621
  111    H    ALA  14           H        ALA  14   3.393  -4.978  -0.362
  112    HA   ALA  14           HA       ALA  14   1.660  -6.727  -1.701
  113   1HB   ALA  14          1HB       ALA  14   4.023  -5.251  -2.848
  114   2HB   ALA  14          2HB       ALA  14   2.406  -4.578  -2.630
  115   3HB   ALA  14          3HB       ALA  14   2.666  -5.914  -3.752
  116    H    VAL  15           H        VAL  15   5.183  -6.872  -1.234
  117    HA   VAL  15           HA       VAL  15   5.547  -9.256  -2.739
  118    HB   VAL  15           HB       VAL  15   7.323  -8.155  -0.544
  119   1HG1  VAL  15          1HG1      VAL  15   7.912 -10.099  -2.774
  120   2HG1  VAL  15          2HG1      VAL  15   7.811 -10.485  -1.056
  121   3HG1  VAL  15          3HG1      VAL  15   9.098  -9.436  -1.651
  122   1HG2  VAL  15          1HG2      VAL  15   8.615  -7.157  -2.382
  123   2HG2  VAL  15          2HG2      VAL  15   6.981  -6.501  -2.288
  124   3HG2  VAL  15          3HG2      VAL  15   7.383  -7.693  -3.524
  125    H    ALA  16           H        ALA  16   5.009  -8.594   0.698
  126    HA   ALA  16           HA       ALA  16   5.339 -11.264   1.590
  127   1HB   ALA  16          1HB       ALA  16   5.444  -9.335   3.104
  128   2HB   ALA  16          2HB       ALA  16   4.255 -10.522   3.640
  129   3HB   ALA  16          3HB       ALA  16   3.723  -9.041   2.844
  130    H    LEU  17           H        LEU  17   2.602  -9.457   0.355
  131    HA   LEU  17           HA       LEU  17   0.623 -11.400   0.963
  132   1HB   LEU  17          2HB       LEU  17   0.280  -8.952   0.386
  133   2HB   LEU  17          1HB       LEU  17   0.554  -9.390  -1.286
  134    HG   LEU  17           HG       LEU  17  -1.410 -10.836  -1.264
  135   1HD1  LEU  17          1HD1      LEU  17  -1.306 -11.526   1.087
  136   2HD1  LEU  17          2HD1      LEU  17  -2.903 -10.915   0.654
  137   3HD1  LEU  17          3HD1      LEU  17  -1.794  -9.902   1.580
  138   1HD2  LEU  17          1HD2      LEU  17  -3.116  -9.115  -1.075
  139   2HD2  LEU  17          2HD2      LEU  17  -1.668  -8.467  -1.847
  140   3HD2  LEU  17          3HD2      LEU  17  -2.009  -8.095  -0.157
  141    H    TYR  18           H        TYR  18   2.829 -10.889  -1.701
  142    HA   TYR  18           HA       TYR  18   1.728 -12.785  -3.487
  143   1HB   TYR  18          2HB       TYR  18   3.339 -11.131  -4.264
  144   2HB   TYR  18          1HB       TYR  18   4.580 -11.805  -3.216
  145    HD1  TYR  18           1HD      TYR  18   2.303 -12.826  -5.989
  146    HD2  TYR  18           2HD      TYR  18   6.079 -13.340  -4.097
  147    HE1  TYR  18           1HE      TYR  18   2.987 -14.357  -7.784
  148    HE2  TYR  18           2HE      TYR  18   6.772 -14.875  -5.891
  149    HH   TYR  18           HH       TYR  18   5.678 -16.367  -7.557
  150    H    GLU  19           H        GLU  19   3.835 -13.065  -0.721
  151    HA   GLU  19           HA       GLU  19   4.685 -15.730  -1.164
  152   1HB   GLU  19          2HB       GLU  19   4.306 -14.281   1.462
  153   2HB   GLU  19          1HB       GLU  19   5.219 -15.764   1.233
  154   1HG   GLU  19          2HG       GLU  19   6.759 -14.562  -0.252
  155   2HG   GLU  19          1HG       GLU  19   5.867 -13.073   0.058
  156    H    ASN  20           H        ASN  20   1.707 -14.372  -0.222
  157    HA   ASN  20           HA       ASN  20   0.654 -16.984   0.630
  158   1HB   ASN  20          2HB       ASN  20  -0.360 -14.171   1.118
  159   2HB   ASN  20          1HB       ASN  20  -1.225 -15.631   1.578
  160   1HD2  ASN  20          1HD2      ASN  20   1.468 -13.555   2.269
  161   2HD2  ASN  20          2HD2      ASN  20   1.885 -14.262   3.790
  162    H    SER  21           H        SER  21   1.167 -16.218  -2.100
  163    HA   SER  21           HA       SER  21  -1.049 -15.138  -3.422
  164   1HB   SER  21          2HB       SER  21  -0.001 -16.296  -5.446
  165   2HB   SER  21          1HB       SER  21   0.972 -15.112  -4.578
  166    HG   SER  21           HG       SER  21   2.307 -16.620  -3.969
  167    H    ASP  22           H        ASP  22  -0.665 -18.237  -2.086
  168    HA   ASP  22           HA       ASP  22  -2.346 -19.775  -3.689
  169   1HB   ASP  22          2HB       ASP  22  -1.956 -19.837  -0.697
  170   2HB   ASP  22          1HB       ASP  22  -2.873 -21.050  -1.587
  171    H    GLY  23           H        GLY  23  -3.089 -17.277  -1.387
  172   1HA   GLY  23          2HA       GLY  23  -5.960 -17.809  -1.616
  173   2HA   GLY  23          1HA       GLY  23  -5.202 -16.680  -0.503
  174    H    ALA  24           H        ALA  24  -3.585 -15.918  -3.105
  175    HA   ALA  24           HA       ALA  24  -5.539 -14.448  -4.616
  176   1HB   ALA  24          1HB       ALA  24  -5.389 -13.034  -2.619
  177   2HB   ALA  24          2HB       ALA  24  -4.741 -12.223  -4.045
  178   3HB   ALA  24          3HB       ALA  24  -3.642 -12.905  -2.847
  179    H    SER  25           H        SER  25  -4.789 -14.763  -6.588
  180    HA   SER  25           HA       SER  25  -2.146 -15.474  -7.205
  181   1HB   SER  25          2HB       SER  25  -4.322 -14.422  -9.015
  182   2HB   SER  25          1HB       SER  25  -2.852 -15.236  -9.551
  183    HG   SER  25           HG       SER  25  -4.932 -16.322  -7.941
  184    H    LEU  26           H        LEU  26  -0.784 -14.350  -8.839
  185    HA   LEU  26           HA       LEU  26   0.320 -12.040  -7.849
  186   1HB   LEU  26          2HB       LEU  26   1.414 -13.544  -9.434
  187   2HB   LEU  26          1HB       LEU  26   0.338 -13.008 -10.707
  188    HG   LEU  26           HG       LEU  26   1.303 -10.721 -10.503
  189   1HD1  LEU  26          1HD1      LEU  26   3.259 -12.082  -8.656
  190   2HD1  LEU  26          2HD1      LEU  26   2.078 -10.855  -8.197
  191   3HD1  LEU  26          3HD1      LEU  26   3.403 -10.440  -9.284
  192   1HD2  LEU  26          1HD2      LEU  26   2.101 -12.243 -12.218
  193   2HD2  LEU  26          2HD2      LEU  26   3.248 -12.951 -11.080
  194   3HD2  LEU  26          3HD2      LEU  26   3.436 -11.275 -11.592
  195    H    GLN  27           H        GLN  27  -1.956 -12.259 -10.590
  196    HA   GLN  27           HA       GLN  27  -1.987  -9.478 -11.103
  197   1HB   GLN  27          2HB       GLN  27  -2.744 -11.202 -12.717
  198   2HB   GLN  27          1HB       GLN  27  -4.159 -11.489 -11.713
  199   1HG   GLN  27          2HG       GLN  27  -4.672 -10.052 -13.627
  200   2HG   GLN  27          1HG       GLN  27  -4.926  -9.221 -12.095
  201   1HE2  GLN  27          1HE2      GLN  27  -3.604  -7.517 -11.526
  202   2HE2  GLN  27          2HE2      GLN  27  -2.522  -6.757 -12.643
  203    H    GLN  28           H        GLN  28  -3.831 -11.507  -8.927
  204    HA   GLN  28           HA       GLN  28  -5.826  -9.605  -8.260
  205   1HB   GLN  28          2HB       GLN  28  -6.101 -12.001  -7.809
  206   2HB   GLN  28          1HB       GLN  28  -4.758 -11.956  -6.678
  207   1HG   GLN  28          2HG       GLN  28  -6.852 -11.983  -5.486
  208   2HG   GLN  28          1HG       GLN  28  -6.032 -10.444  -5.236
  209   1HE2  GLN  28          1HE2      GLN  28  -7.946  -9.438  -4.660
  210   2HE2  GLN  28          2HE2      GLN  28  -9.158  -9.027  -5.831
  211    H    ILE  29           H        ILE  29  -2.637 -10.377  -6.951
  212    HA   ILE  29           HA       ILE  29  -2.672  -8.693  -4.703
  213    HB   ILE  29           HB       ILE  29  -0.256  -9.230  -6.450
  214   1HG1  ILE  29          2HG1      ILE  29  -1.325 -11.356  -5.865
  215   2HG1  ILE  29          1HG1      ILE  29   0.197 -11.167  -5.001
  216   1HG2  ILE  29          1HG2      ILE  29   1.001  -8.927  -4.351
  217   2HG2  ILE  29          2HG2      ILE  29  -0.510  -8.536  -3.526
  218   3HG2  ILE  29          3HG2      ILE  29   0.090  -7.484  -4.807
  219   1HD1  ILE  29          1HD1      ILE  29  -1.068 -10.473  -3.004
  220   2HD1  ILE  29          2HD1      ILE  29  -1.459 -12.107  -3.542
  221   3HD1  ILE  29          3HD1      ILE  29  -2.567 -10.777  -3.883
  222    H    ALA  30           H        ALA  30  -1.404  -8.075  -7.979
  223    HA   ALA  30           HA       ALA  30  -0.816  -5.353  -7.588
  224   1HB   ALA  30          1HB       ALA  30  -0.729  -5.207 -10.033
  225   2HB   ALA  30          2HB       ALA  30  -1.501  -6.790 -10.152
  226   3HB   ALA  30          3HB       ALA  30   0.105  -6.644  -9.440
  227    H    ASN  31           H        ASN  31  -3.762  -7.009  -8.365
  228    HA   ASN  31           HA       ASN  31  -5.237  -4.817  -9.379
  229   1HB   ASN  31          2HB       ASN  31  -5.678  -7.474  -9.263
  230   2HB   ASN  31          1HB       ASN  31  -6.666  -6.960  -7.900
  231   1HD2  ASN  31          1HD2      ASN  31  -7.495  -8.124 -10.411
  232   2HD2  ASN  31          2HD2      ASN  31  -8.562  -6.978 -11.155
  233    H    ASP  32           H        ASP  32  -4.996  -6.266  -6.139
  234    HA   ASP  32           HA       ASP  32  -6.805  -4.437  -4.918
  235   1HB   ASP  32          2HB       ASP  32  -6.293  -6.644  -3.924
  236   2HB   ASP  32          1HB       ASP  32  -4.644  -6.111  -3.614
  237    H    LEU  33           H        LEU  33  -3.290  -4.547  -5.239
  238    HA   LEU  33           HA       LEU  33  -2.821  -2.227  -3.660
  239   1HB   LEU  33          2HB       LEU  33  -1.200  -3.872  -5.546
  240   2HB   LEU  33          1HB       LEU  33  -0.613  -2.279  -5.115
  241    HG   LEU  33           HG       LEU  33   0.416  -3.990  -3.725
  242   1HD1  LEU  33          1HD1      LEU  33  -1.535  -2.274  -2.201
  243   2HD1  LEU  33          2HD1      LEU  33   0.077  -1.803  -2.743
  244   3HD1  LEU  33          3HD1      LEU  33  -0.110  -3.059  -1.519
  245   1HD2  LEU  33          1HD2      LEU  33  -1.383  -5.654  -3.803
  246   2HD2  LEU  33          2HD2      LEU  33  -2.366  -4.627  -2.759
  247   3HD2  LEU  33          3HD2      LEU  33  -0.863  -5.320  -2.151
  248    H    GLY  34           H        GLY  34  -3.970  -2.709  -6.826
  249   1HA   GLY  34          2HA       GLY  34  -4.782  -1.178  -8.340
  250   2HA   GLY  34          1HA       GLY  34  -4.399   0.089  -7.184
  251    H    ILE  35           H        ILE  35  -2.247  -2.272  -8.711
  252    HA   ILE  35           HA       ILE  35  -0.877  -0.083 -10.105
  253    HB   ILE  35           HB       ILE  35   1.302  -1.164  -9.504
  254   1HG1  ILE  35          2HG1      ILE  35  -0.384  -2.601  -7.443
  255   2HG1  ILE  35          1HG1      ILE  35   0.389  -3.351  -8.832
  256   1HG2  ILE  35          1HG2      ILE  35  -0.303  -0.047  -7.216
  257   2HG2  ILE  35          2HG2      ILE  35   0.569   0.886  -8.430
  258   3HG2  ILE  35          3HG2      ILE  35   1.457  -0.130  -7.295
  259   1HD1  ILE  35          1HD1      ILE  35   1.790  -2.024  -6.529
  260   2HD1  ILE  35          2HD1      ILE  35   2.578  -2.739  -7.936
  261   3HD1  ILE  35          3HD1      ILE  35   1.663  -3.757  -6.825
  262    H    ASN  36           H        ASN  36   0.476  -0.795 -11.856
  263    HA   ASN  36           HA       ASN  36  -0.534  -2.839 -13.474
  264   1HB   ASN  36          2HB       ASN  36   0.863  -0.828 -14.134
  265   2HB   ASN  36          1HB       ASN  36   2.264  -1.700 -13.541
  266   1HD2  ASN  36          1HD2      ASN  36   1.571  -0.698 -16.185
  267   2HD2  ASN  36          2HD2      ASN  36   1.677  -2.058 -17.244
  268    H    ARG  37           H        ARG  37   0.169  -4.906 -13.887
  269    HA   ARG  37           HA       ARG  37   1.161  -6.471 -11.794
  270   1HB   ARG  37          2HB       ARG  37  -0.153  -7.315 -13.744
  271   2HB   ARG  37          1HB       ARG  37   1.272  -7.101 -14.750
  272   1HG   ARG  37          2HG       ARG  37   2.453  -8.666 -13.121
  273   2HG   ARG  37          1HG       ARG  37   0.842  -9.052 -12.514
  274   1HD   ARG  37          2HD       ARG  37   1.785  -9.365 -15.361
  275   2HD   ARG  37          1HD       ARG  37   1.593 -10.666 -14.189
  276    HE   ARG  37           HE       ARG  37  -0.795  -9.108 -14.708
  277   1HH1  ARG  37          1HH1      ARG  37   1.100 -11.930 -15.542
  278   2HH1  ARG  37          2HH1      ARG  37  -0.227 -12.763 -16.299
  279   1HH2  ARG  37          1HH2      ARG  37  -2.545 -10.188 -15.714
  280   2HH2  ARG  37          2HH2      ARG  37  -2.295 -11.770 -16.387
  281    H    VAL  38           H        VAL  38   2.756  -4.957 -14.537
  282    HA   VAL  38           HA       VAL  38   5.305  -6.125 -14.223
  283    HB   VAL  38           HB       VAL  38   4.648  -3.403 -15.368
  284   1HG1  VAL  38          1HG1      VAL  38   7.003  -5.233 -15.823
  285   2HG1  VAL  38          2HG1      VAL  38   7.020  -3.712 -14.930
  286   3HG1  VAL  38          3HG1      VAL  38   6.706  -3.712 -16.667
  287   1HG2  VAL  38          1HG2      VAL  38   3.310  -5.088 -16.467
  288   2HG2  VAL  38          2HG2      VAL  38   4.727  -6.108 -16.702
  289   3HG2  VAL  38          3HG2      VAL  38   4.599  -4.568 -17.552
  290    H    THR  39           H        THR  39   3.857  -3.158 -12.943
  291    HA   THR  39           HA       THR  39   6.156  -2.151 -11.673
  292    HB   THR  39           HB       THR  39   3.303  -1.727 -10.768
  293    HG1  THR  39           1HG      THR  39   4.259   0.179 -12.437
  294   1HG2  THR  39          1HG2      THR  39   5.749   0.050 -10.670
  295   2HG2  THR  39          2HG2      THR  39   5.045  -0.803  -9.298
  296   3HG2  THR  39          3HG2      THR  39   4.136   0.481 -10.094
  297    H    LEU  40           H        LEU  40   3.515  -4.217 -10.509
  298    HA   LEU  40           HA       LEU  40   4.314  -4.486  -7.848
  299   1HB   LEU  40          2HB       LEU  40   2.159  -5.273  -8.656
  300   2HB   LEU  40          1HB       LEU  40   2.944  -6.467  -9.671
  301    HG   LEU  40           HG       LEU  40   3.827  -7.549  -7.589
  302   1HD1  LEU  40          1HD1      LEU  40   1.891  -5.684  -6.234
  303   2HD1  LEU  40          2HD1      LEU  40   3.651  -5.631  -6.102
  304   3HD1  LEU  40          3HD1      LEU  40   2.760  -7.018  -5.471
  305   1HD2  LEU  40          1HD2      LEU  40   0.834  -7.356  -7.853
  306   2HD2  LEU  40          2HD2      LEU  40   1.719  -8.634  -7.018
  307   3HD2  LEU  40          3HD2      LEU  40   1.894  -8.433  -8.762
  308    H    LYS  41           H        LYS  41   5.124  -6.464 -10.679
  309    HA   LYS  41           HA       LYS  41   6.701  -8.367  -9.363
  310   1HB   LYS  41          2HB       LYS  41   5.785  -8.469 -11.716
  311   2HB   LYS  41          1HB       LYS  41   7.106  -7.416 -12.196
  312   1HG   LYS  41          2HG       LYS  41   8.727  -9.067 -11.510
  313   2HG   LYS  41          1HG       LYS  41   7.443 -10.114 -10.903
  314   1HD   LYS  41          2HD       LYS  41   6.529 -10.289 -13.169
  315   2HD   LYS  41          1HD       LYS  41   7.825  -9.257 -13.771
  316   1HE   LYS  41          2HE       LYS  41   9.483 -10.889 -13.161
  317   2HE   LYS  41          1HE       LYS  41   8.266 -11.893 -12.375
  318   1HZ   LYS  41          1HZ       LYS  41   8.222 -11.239 -15.271
  319   2HZ   LYS  41          2HZ       LYS  41   7.287 -12.398 -14.455
  320   3HZ   LYS  41          3HZ       LYS  41   8.956 -12.631 -14.638
  321    H    ASN  42           H        ASN  42   7.552  -5.313 -10.894
  322    HA   ASN  42           HA       ASN  42  10.317  -5.382 -10.655
  323   1HB   ASN  42          2HB       ASN  42   8.295  -3.219 -10.807
  324   2HB   ASN  42          1HB       ASN  42   9.887  -2.760 -10.211
  325   1HD2  ASN  42          1HD2      ASN  42   8.069  -3.948 -12.930
  326   2HD2  ASN  42          2HD2      ASN  42   9.301  -3.675 -14.116
  327    H    TRP  43           H        TRP  43   7.908  -4.579  -8.208
  328    HA   TRP  43           HA       TRP  43   9.865  -3.788  -6.263
  329   1HB   TRP  43          2HB       TRP  43   6.957  -4.559  -5.916
  330   2HB   TRP  43          1HB       TRP  43   7.974  -3.860  -4.661
  331    HD1  TRP  43           HD       TRP  43   9.176  -1.875  -7.258
  332    HE1  TRP  43           1HE      TRP  43   7.814   0.275  -7.645
  333    HE3  TRP  43           3HE      TRP  43   4.909  -3.175  -4.781
  334    HZ2  TRP  43           2HZ      TRP  43   5.261   1.285  -6.973
  335    HZ3  TRP  43           3HZ      TRP  43   3.059  -1.565  -4.691
  336    HH2  TRP  43           HH       TRP  43   3.230   0.620  -5.765
  337    H    ILE  44           H        ILE  44   7.946  -6.694  -6.890
  338    HA   ILE  44           HA       ILE  44   8.767  -8.195  -4.679
  339    HB   ILE  44           HB       ILE  44   8.012  -9.189  -7.434
  340   1HG1  ILE  44          2HG1      ILE  44   6.340  -8.828  -4.936
  341   2HG1  ILE  44          1HG1      ILE  44   6.289  -7.785  -6.355
  342   1HG2  ILE  44          1HG2      ILE  44   7.471 -11.305  -6.317
  343   2HG2  ILE  44          2HG2      ILE  44   8.109 -10.662  -4.805
  344   3HG2  ILE  44          3HG2      ILE  44   9.184 -10.909  -6.180
  345   1HD1  ILE  44          1HD1      ILE  44   5.515 -10.690  -6.244
  346   2HD1  ILE  44          2HD1      ILE  44   5.514  -9.688  -7.696
  347   3HD1  ILE  44          3HD1      ILE  44   4.425  -9.309  -6.360
  348    H    ILE  45           H        ILE  45  10.188  -7.916  -7.921
  349    HA   ILE  45           HA       ILE  45  12.254  -9.789  -7.588
  350    HB   ILE  45           HB       ILE  45  12.163  -7.309  -9.325
  351   1HG1  ILE  45          2HG1      ILE  45  11.687 -10.226  -9.988
  352   2HG1  ILE  45          1HG1      ILE  45  10.423  -9.023  -9.774
  353   1HG2  ILE  45          1HG2      ILE  45  14.070  -9.641  -9.416
  354   2HG2  ILE  45          2HG2      ILE  45  14.468  -7.989  -8.948
  355   3HG2  ILE  45          3HG2      ILE  45  13.984  -8.344 -10.607
  356   1HD1  ILE  45          1HD1      ILE  45  10.829  -9.407 -12.124
  357   2HD1  ILE  45          2HD1      ILE  45  12.536  -9.021 -11.909
  358   3HD1  ILE  45          3HD1      ILE  45  11.318  -7.768 -11.686
  359    H    LYS  46           H        LYS  46  12.273  -6.251  -7.095
  360    HA   LYS  46           HA       LYS  46  15.004  -6.168  -6.353
  361   1HB   LYS  46          2HB       LYS  46  13.840  -4.178  -7.187
  362   2HB   LYS  46          1HB       LYS  46  12.827  -4.163  -5.748
  363   1HG   LYS  46          2HG       LYS  46  14.905  -3.911  -4.381
  364   2HG   LYS  46          1HG       LYS  46  15.801  -3.717  -5.886
  365   1HD   LYS  46          2HD       LYS  46  14.458  -1.753  -6.433
  366   2HD   LYS  46          1HD       LYS  46  13.549  -1.948  -4.933
  367   1HE   LYS  46          2HE       LYS  46  15.639  -1.664  -3.655
  368   2HE   LYS  46          1HE       LYS  46  16.516  -1.425  -5.165
  369   1HZ   LYS  46          1HZ       LYS  46  14.416   0.328  -4.020
  370   2HZ   LYS  46          2HZ       LYS  46  15.044   0.508  -5.586
  371   3HZ   LYS  46          3HZ       LYS  46  16.056   0.697  -4.238
  372    H    TYR  47           H        TYR  47  12.037  -6.002  -4.363
  373    HA   TYR  47           HA       TYR  47  13.606  -5.763  -1.969
  374   1HB   TYR  47          2HB       TYR  47  10.635  -6.025  -2.436
  375   2HB   TYR  47          1HB       TYR  47  11.351  -5.864  -0.833
  376    HD1  TYR  47           1HD      TYR  47  12.024  -3.756  -0.001
  377    HD2  TYR  47           2HD      TYR  47  10.958  -4.150  -4.100
  378    HE1  TYR  47           1HE      TYR  47  12.087  -1.310  -0.246
  379    HE2  TYR  47           2HE      TYR  47  11.022  -1.708  -4.358
  380    HH   TYR  47           HH       TYR  47  12.423   0.357  -2.099
  381    H    GLY  48           H        GLY  48  11.958  -8.368  -3.637
  382   1HA   GLY  48          2HA       GLY  48  12.139 -10.251  -1.516
  383   2HA   GLY  48          1HA       GLY  48  11.940 -10.634  -3.223
  384    H    SER  49           H        SER  49  14.304  -9.434  -4.198
  385    HA   SER  49           HA       SER  49  16.206 -11.475  -3.400
  386   1HB   SER  49          2HB       SER  49  16.557  -9.363  -5.530
  387   2HB   SER  49          1HB       SER  49  17.429 -10.886  -5.371
  388    HG   SER  49           HG       SER  49  14.847 -10.385  -6.315
  389    H    ASN  50           H        ASN  50  15.653  -8.134  -2.887
  390    HA   ASN  50           HA       ASN  50  16.709  -6.485  -1.774
  391   1HB   ASN  50          2HB       ASN  50  17.139  -8.141  -0.006
  392   2HB   ASN  50          1HB       ASN  50  18.614  -8.639  -0.829
  393   1HD2  ASN  50          1HD2      ASN  50  17.072  -6.116   1.022
  394   2HD2  ASN  50          2HD2      ASN  50  18.520  -5.254   1.418
  395    H    HIS  51           H        HIS  51  19.667  -8.335  -2.383
  396    HA   HIS  51           HA       HIS  51  20.239  -6.667  -4.714
  397   1HB   HIS  51          2HB       HIS  51  21.221  -5.608  -2.602
  398   2HB   HIS  51          1HB       HIS  51  22.283  -7.008  -2.508
  399    HD1  HIS  51           1HD      HIS  51  21.521  -4.062  -4.755
  400    HD2  HIS  51           2HD      HIS  51  24.524  -6.872  -4.105
  401    HE1  HIS  51           1HE      HIS  51  23.451  -3.339  -6.192
  402    HE2  HIS  51           2HE      HIS  51  25.298  -4.968  -5.687
  403    H    ASN  52           H        ASN  52  19.829  -9.587  -3.538
  404    HA   ASN  52           HA       ASN  52  22.303 -10.834  -4.430
  405   1HB   ASN  52          2HB       ASN  52  21.124 -11.454  -2.265
  406   2HB   ASN  52          1HB       ASN  52  19.873 -12.195  -3.258
  407   1HD2  ASN  52          1HD2      ASN  52  21.589 -13.445  -1.325
  408   2HD2  ASN  52          2HD2      ASN  52  22.489 -14.664  -2.172
  409    H    VAL  53           H        VAL  53  21.728 -10.110  -6.681
  410    HA   VAL  53           HA       VAL  53  19.861 -11.850  -8.041
  411    HB   VAL  53           HB       VAL  53  20.860 -10.822 -10.145
  412   1HG1  VAL  53          1HG1      VAL  53  18.753 -10.093  -9.146
  413   2HG1  VAL  53          2HG1      VAL  53  19.630  -8.742  -9.861
  414   3HG1  VAL  53          3HG1      VAL  53  19.630  -8.967  -8.111
  415   1HG2  VAL  53          1HG2      VAL  53  22.109  -8.744  -9.875
  416   2HG2  VAL  53          2HG2      VAL  53  22.998 -10.109  -9.205
  417   3HG2  VAL  53          3HG2      VAL  53  22.159  -8.990  -8.128
  418    H    GLN  54           H        GLN  54  23.399 -11.411  -8.046
  419    HA   GLN  54           HA       GLN  54  23.658 -14.271  -8.703
  420   1HB   GLN  54          2HB       GLN  54  25.154 -11.920  -9.843
  421   2HB   GLN  54          1HB       GLN  54  25.899 -13.508  -9.783
  422   1HG   GLN  54          2HG       GLN  54  25.040 -13.492 -11.902
  423   2HG   GLN  54          1HG       GLN  54  23.737 -14.273 -11.014
  424   1HE2  GLN  54          1HE2      GLN  54  24.770 -11.403 -12.665
  425   2HE2  GLN  54          2HE2      GLN  54  23.205 -10.664 -12.789
  426    H    GLY  55           H        GLY  55  23.658 -12.710  -6.170
  427   1HA   GLY  55          2HA       GLY  55  26.397 -12.549  -5.293
  428   2HA   GLY  55          1HA       GLY  55  24.968 -12.261  -4.314
  429    H    THR  56           H        THR  56  27.200 -14.614  -5.483
  430    HA   THR  56           HA       THR  56  26.430 -16.458  -3.385
  431    HB   THR  56           HB       THR  56  26.945 -17.615  -6.060
  432    HG1  THR  56           1HG      THR  56  25.114 -16.852  -6.803
  433   1HG2  THR  56          1HG2      THR  56  26.927 -19.064  -4.098
  434   2HG2  THR  56          2HG2      THR  56  25.584 -19.450  -5.173
  435   3HG2  THR  56          3HG2      THR  56  25.299 -18.515  -3.706
  436    H    THR  57           H        THR  57  28.246 -16.410  -2.351
  437    HA   THR  57           HA       THR  57  30.807 -16.104  -3.553
  438    HB   THR  57           HB       THR  57  31.609 -16.519  -1.179
  439    HG1  THR  57           1HG      THR  57  29.971 -16.539   0.418
  440   1HG2  THR  57          1HG2      THR  57  31.246 -14.269  -2.076
  441   2HG2  THR  57          2HG2      THR  57  30.788 -14.350  -0.375
  442   3HG2  THR  57          3HG2      THR  57  29.543 -14.358  -1.624
  443    HA   PRO  58           HA       PRO  58  31.988 -20.294  -4.200
  444   1HB   PRO  58          2HB       PRO  58  34.643 -20.231  -3.655
  445   2HB   PRO  58          1HB       PRO  58  33.942 -19.474  -5.090
  446   1HG   PRO  58          2HG       PRO  58  34.747 -18.226  -2.492
  447   2HG   PRO  58          1HG       PRO  58  35.019 -17.645  -4.146
  448   1HD   PRO  58          2HD       PRO  58  33.035 -16.684  -2.570
  449   2HD   PRO  58          1HD       PRO  58  32.888 -16.793  -4.336
  450    H    SER  59           H        SER  59  31.634 -19.147  -1.166
  451    HA   SER  59           HA       SER  59  33.028 -21.029   0.423
  452   1HB   SER  59          2HB       SER  59  30.463 -19.553   1.049
  453   2HB   SER  59          1HB       SER  59  31.548 -20.306   2.221
  454    HG   SER  59           HG       SER  59  31.684 -17.874   1.560
  455    H    ALA  60           H        ALA  60  30.194 -21.207  -1.499
  456    HA   ALA  60           HA       ALA  60  29.087 -23.542  -0.231
  457   1HB   ALA  60          1HB       ALA  60  27.546 -23.584  -2.122
  458   2HB   ALA  60          2HB       ALA  60  28.495 -22.343  -2.939
  459   3HB   ALA  60          3HB       ALA  60  27.652 -21.961  -1.436
  460    H    ALA  61           H        ALA  61  31.598 -22.917  -2.444
  461    HA   ALA  61           HA       ALA  61  31.387 -25.448  -3.838
  462   1HB   ALA  61          1HB       ALA  61  33.527 -23.334  -4.048
  463   2HB   ALA  61          2HB       ALA  61  32.072 -23.413  -5.041
  464   3HB   ALA  61          3HB       ALA  61  33.280 -24.694  -5.146
  465    H    VAL  62           H        VAL  62  32.440 -24.700  -0.869
  466    HA   VAL  62           HA       VAL  62  34.977 -25.946  -0.717
  467    HB   VAL  62           HB       VAL  62  32.906 -25.601   1.463
  468   1HG1  VAL  62          1HG1      VAL  62  35.856 -26.196   1.692
  469   2HG1  VAL  62          2HG1      VAL  62  34.554 -27.347   1.991
  470   3HG1  VAL  62          3HG1      VAL  62  34.739 -25.934   3.034
  471   1HG2  VAL  62          1HG2      VAL  62  34.239 -23.658   2.121
  472   2HG2  VAL  62          2HG2      VAL  62  33.627 -23.488   0.474
  473   3HG2  VAL  62          3HG2      VAL  62  35.312 -23.932   0.748
  474    H    SER  63           H        SER  63  31.690 -27.121  -0.323
  475    HA   SER  63           HA       SER  63  32.368 -29.792   0.344
  476   1HB   SER  63          2HB       SER  63  29.843 -28.752  -0.971
  477   2HB   SER  63          1HB       SER  63  30.024 -30.266  -0.083
  478    HG   SER  63           HG       SER  63  30.362 -29.093   1.797
  479    H    GLU  64           H        GLU  64  32.050 -28.022  -2.625
  480    HA   GLU  64           HA       GLU  64  31.937 -30.256  -4.375
  481   1HB   GLU  64          2HB       GLU  64  31.729 -27.466  -4.573
  482   2HB   GLU  64          1HB       GLU  64  33.111 -27.905  -5.558
  483   1HG   GLU  64          2HG       GLU  64  31.279 -27.922  -7.018
  484   2HG   GLU  64          1HG       GLU  64  31.591 -29.619  -6.658
  485    H    ALA  65           H        ALA  65  34.466 -28.309  -2.986
  486    HA   ALA  65           HA       ALA  65  36.602 -29.054  -4.621
  487   1HB   ALA  65          1HB       ALA  65  38.045 -28.252  -2.852
  488   2HB   ALA  65          2HB       ALA  65  36.708 -28.305  -1.703
  489   3HB   ALA  65          3HB       ALA  65  36.669 -27.167  -3.051
  490    H    GLU  66           H        GLU  66  35.227 -30.610  -1.787
  491    HA   GLU  66           HA       GLU  66  37.251 -32.455  -1.242
  492   1HB   GLU  66          2HB       GLU  66  35.300 -31.990   0.225
  493   2HB   GLU  66          1HB       GLU  66  34.268 -32.842  -0.913
  494   1HG   GLU  66          2HG       GLU  66  35.462 -34.910  -0.501
  495   2HG   GLU  66          1HG       GLU  66  36.575 -34.075   0.581
  496    H    GLN  67           H        GLN  67  34.410 -32.769  -3.351
  497    HA   GLN  67           HA       GLN  67  35.150 -35.430  -4.148
  498   1HB   GLN  67          2HB       GLN  67  33.186 -35.261  -5.647
  499   2HB   GLN  67          1HB       GLN  67  32.809 -34.879  -3.973
  500   1HG   GLN  67          2HG       GLN  67  33.079 -32.448  -4.606
  501   2HG   GLN  67          1HG       GLN  67  33.090 -32.986  -6.286
  502   1HE2  GLN  67          1HE2      GLN  67  31.215 -32.589  -3.404
  503   2HE2  GLN  67          2HE2      GLN  67  29.665 -32.829  -4.134
  504    H    ILE  68           H        ILE  68  35.435 -32.184  -5.495
  505    HA   ILE  68           HA       ILE  68  36.188 -32.976  -8.105
  506    HB   ILE  68           HB       ILE  68  36.700 -30.434  -6.557
  507   1HG1  ILE  68          2HG1      ILE  68  34.822 -31.070  -8.849
  508   2HG1  ILE  68          1HG1      ILE  68  34.361 -30.923  -7.158
  509   1HG2  ILE  68          1HG2      ILE  68  38.489 -30.683  -8.186
  510   2HG2  ILE  68          2HG2      ILE  68  37.380 -29.401  -8.676
  511   3HG2  ILE  68          3HG2      ILE  68  37.310 -30.978  -9.462
  512   1HD1  ILE  68          1HD1      ILE  68  34.987 -28.582  -7.169
  513   2HD1  ILE  68          2HD1      ILE  68  33.803 -28.924  -8.431
  514   3HD1  ILE  68          3HD1      ILE  68  35.505 -28.715  -8.849
  515    H    ARG  69           H        ARG  69  38.038 -32.337  -5.171
  516    HA   ARG  69           HA       ARG  69  40.626 -32.421  -6.164
  517   1HB   ARG  69          2HB       ARG  69  40.172 -31.812  -3.883
  518   2HB   ARG  69          1HB       ARG  69  39.514 -33.402  -3.535
  519   1HG   ARG  69          2HG       ARG  69  41.730 -34.391  -3.833
  520   2HG   ARG  69          1HG       ARG  69  42.393 -32.794  -4.194
  521   1HD   ARG  69          2HD       ARG  69  41.884 -32.010  -2.000
  522   2HD   ARG  69          1HD       ARG  69  40.968 -33.469  -1.632
  523    HE   ARG  69           HE       ARG  69  43.662 -34.101  -2.276
  524   1HH1  ARG  69          1HH1      ARG  69  41.672 -32.745   0.268
  525   2HH1  ARG  69          2HH1      ARG  69  42.714 -33.294   1.544
  526   1HH2  ARG  69          1HH2      ARG  69  45.023 -34.842  -0.626
  527   2HH2  ARG  69          2HH2      ARG  69  44.637 -34.492   1.039
  528    H    GLN  70           H        GLN  70  38.499 -35.091  -5.289
  529    HA   GLN  70           HA       GLN  70  40.411 -37.128  -5.866
  530   1HB   GLN  70          2HB       GLN  70  38.473 -37.346  -4.290
  531   2HB   GLN  70          1HB       GLN  70  37.413 -37.337  -5.682
  532   1HG   GLN  70          2HG       GLN  70  38.400 -39.357  -6.513
  533   2HG   GLN  70          1HG       GLN  70  39.575 -39.359  -5.200
  534   1HE2  GLN  70          1HE2      GLN  70  37.593 -41.394  -5.924
  535   2HE2  GLN  70          2HE2      GLN  70  36.598 -41.593  -4.516
  536    H    LEU  71           H        LEU  71  37.545 -35.839  -7.431
  537    HA   LEU  71           HA       LEU  71  37.271 -37.495  -9.590
  538   1HB   LEU  71          2HB       LEU  71  35.848 -35.509  -8.793
  539   2HB   LEU  71          1HB       LEU  71  36.871 -34.525  -9.816
  540    HG   LEU  71           HG       LEU  71  35.334 -36.875 -10.905
  541   1HD1  LEU  71          1HD1      LEU  71  33.731 -35.395  -9.841
  542   2HD1  LEU  71          2HD1      LEU  71  33.613 -35.268 -11.596
  543   3HD1  LEU  71          3HD1      LEU  71  34.432 -34.007 -10.673
  544   1HD2  LEU  71          1HD2      LEU  71  37.109 -36.034 -12.331
  545   2HD2  LEU  71          2HD2      LEU  71  36.491 -34.392 -12.171
  546   3HD2  LEU  71          3HD2      LEU  71  35.539 -35.613 -13.012
  547    H    LYS  72           H        LYS  72  39.345 -34.574  -9.484
  548    HA   LYS  72           HA       LYS  72  40.162 -35.008 -12.220
  549   1HB   LYS  72          2HB       LYS  72  41.666 -33.030 -11.816
  550   2HB   LYS  72          1HB       LYS  72  39.949 -32.733 -11.618
  551   1HG   LYS  72          2HG       LYS  72  41.053 -31.578  -9.883
  552   2HG   LYS  72          1HG       LYS  72  40.284 -32.978  -9.142
  553   1HD   LYS  72          2HD       LYS  72  42.411 -32.859  -8.163
  554   2HD   LYS  72          1HD       LYS  72  42.538 -34.138  -9.366
  555   1HE   LYS  72          2HE       LYS  72  43.413 -31.287  -9.820
  556   2HE   LYS  72          1HE       LYS  72  44.488 -32.572  -9.280
  557   1HZ   LYS  72          1HZ       LYS  72  43.175 -32.239 -11.900
  558   2HZ   LYS  72          2HZ       LYS  72  43.683 -33.772 -11.390
  559   3HZ   LYS  72          3HZ       LYS  72  44.811 -32.516 -11.552
  560    H    LYS  73           H        LYS  73  40.991 -36.650  -9.601
  561    HA   LYS  73           HA       LYS  73  43.830 -36.890 -10.374
  562   1HB   LYS  73          2HB       LYS  73  43.666 -35.938  -8.164
  563   2HB   LYS  73          1HB       LYS  73  42.525 -37.176  -7.661
  564   1HG   LYS  73          2HG       LYS  73  44.287 -38.868  -7.900
  565   2HG   LYS  73          1HG       LYS  73  45.427 -37.594  -8.339
  566   1HD   LYS  73          2HD       LYS  73  45.138 -36.540  -6.181
  567   2HD   LYS  73          1HD       LYS  73  43.897 -37.716  -5.743
  568   1HE   LYS  73          2HE       LYS  73  46.093 -38.215  -4.732
  569   2HE   LYS  73          1HE       LYS  73  45.510 -39.503  -5.783
  570   1HZ   LYS  73          1HZ       LYS  73  47.439 -37.418  -6.640
  571   2HZ   LYS  73          2HZ       LYS  73  46.987 -38.810  -7.495
  572   3HZ   LYS  73          3HZ       LYS  73  47.893 -38.949  -6.068
  573    H    GLU  74           H        GLU  74  40.839 -38.485  -9.723
  574    HA   GLU  74           HA       GLU  74  41.912 -41.103  -9.347
  575   1HB   GLU  74          2HB       GLU  74  39.754 -40.244  -8.394
  576   2HB   GLU  74          1HB       GLU  74  39.075 -40.310 -10.012
  577   1HG   GLU  74          2HG       GLU  74  39.332 -42.688 -10.087
  578   2HG   GLU  74          1HG       GLU  74  40.195 -42.683  -8.548
  579    H    ASN  75           H        ASN  75  41.494 -42.930 -10.734
  580    HA   ASN  75           HA       ASN  75  41.218 -42.281 -13.578
  581   1HB   ASN  75          2HB       ASN  75  43.112 -43.770 -14.107
  582   2HB   ASN  75          1HB       ASN  75  43.619 -42.394 -13.136
  583   1HD2  ASN  75          1HD2      ASN  75  44.399 -42.730 -11.087
  584   2HD2  ASN  75          2HD2      ASN  75  44.710 -44.307 -10.440
  585    H    ALA  76           H        ALA  76  40.921 -44.281 -14.904
  586    HA   ALA  76           HA       ALA  76  38.773 -45.770 -13.838
  587   1HB   ALA  76          1HB       ALA  76  40.255 -46.224 -16.414
  588   2HB   ALA  76          2HB       ALA  76  38.920 -45.092 -16.198
  589   3HB   ALA  76          3HB       ALA  76  38.648 -46.823 -16.006
  590    H    LEU  77           H        LEU  77  42.169 -46.398 -14.078
  591    HA   LEU  77           HA       LEU  77  42.127 -49.203 -14.138
  592   1HB   LEU  77          2HB       LEU  77  44.210 -47.323 -13.033
  593   2HB   LEU  77          1HB       LEU  77  44.456 -49.030 -13.323
  594    HG   LEU  77           HG       LEU  77  43.857 -46.967 -15.440
  595   1HD1  LEU  77          1HD1      LEU  77  46.102 -46.756 -14.487
  596   2HD1  LEU  77          2HD1      LEU  77  46.153 -47.338 -16.150
  597   3HD1  LEU  77          3HD1      LEU  77  46.398 -48.464 -14.816
  598   1HD2  LEU  77          1HD2      LEU  77  44.524 -49.900 -15.696
  599   2HD2  LEU  77          2HD2      LEU  77  44.309 -48.763 -17.025
  600   3HD2  LEU  77          3HD2      LEU  77  42.944 -49.173 -15.988
  601    H    GLN  78           H        GLN  78  42.104 -46.910 -11.446
  602    HA   GLN  78           HA       GLN  78  42.183 -49.026  -9.490
  603   1HB   GLN  78          2HB       GLN  78  42.065 -46.059  -9.399
  604   2HB   GLN  78          1HB       GLN  78  41.425 -46.925  -8.010
  605   1HG   GLN  78          2HG       GLN  78  43.714 -46.352  -7.599
  606   2HG   GLN  78          1HG       GLN  78  43.582 -48.097  -7.781
  607   1HE2  GLN  78          1HE2      GLN  78  44.517 -49.094  -9.582
  608   2HE2  GLN  78          2HE2      GLN  78  45.656 -48.273 -10.595
  609    H    ARG  79           H        ARG  79  39.737 -47.206 -11.167
  610    HA   ARG  79           HA       ARG  79  37.622 -47.802  -9.343
  611   1HB   ARG  79          2HB       ARG  79  37.782 -46.561 -12.044
  612   2HB   ARG  79          1HB       ARG  79  36.222 -47.132 -11.468
  613   1HG   ARG  79          2HG       ARG  79  37.999 -45.144 -10.075
  614   2HG   ARG  79          1HG       ARG  79  36.525 -44.775 -10.975
  615   1HD   ARG  79          2HD       ARG  79  35.247 -46.182  -9.397
  616   2HD   ARG  79          1HD       ARG  79  36.724 -46.457  -8.474
  617    HE   ARG  79           HE       ARG  79  36.390 -43.699  -8.708
  618   1HH1  ARG  79          1HH1      ARG  79  34.780 -46.418  -7.177
  619   2HH1  ARG  79          2HH1      ARG  79  34.036 -45.444  -5.949
  620   1HH2  ARG  79          1HH2      ARG  79  35.469 -42.439  -7.081
  621   2HH2  ARG  79          2HH2      ARG  79  34.470 -43.166  -5.857
  622    H    ALA  80           H        ALA  80  39.183 -49.620 -11.715
  623    HA   ALA  80           HA       ALA  80  37.143 -51.242 -12.718
  624   1HB   ALA  80          1HB       ALA  80  39.992 -52.033 -12.139
  625   2HB   ALA  80          2HB       ALA  80  39.435 -51.212 -13.598
  626   3HB   ALA  80          3HB       ALA  80  38.881 -52.849 -13.240
  627    H    ARG  81           H        ARG  81  38.504 -51.102  -9.578
  628    HA   ARG  81           HA       ARG  81  37.615 -53.740  -8.806
  629   1HB   ARG  81          2HB       ARG  81  39.001 -51.498  -7.376
  630   2HB   ARG  81          1HB       ARG  81  38.323 -52.851  -6.480
  631   1HG   ARG  81          2HG       ARG  81  39.718 -54.400  -7.721
  632   2HG   ARG  81          1HG       ARG  81  40.367 -53.071  -8.680
  633   1HD   ARG  81          2HD       ARG  81  40.575 -52.942  -5.711
  634   2HD   ARG  81          1HD       ARG  81  41.666 -54.007  -6.595
  635    HE   ARG  81           HE       ARG  81  42.132 -51.844  -7.938
  636   1HH1  ARG  81          1HH1      ARG  81  41.463 -51.973  -4.507
  637   2HH1  ARG  81          2HH1      ARG  81  42.489 -50.631  -4.126
  638   1HH2  ARG  81          1HH2      ARG  81  43.512 -50.110  -7.441
  639   2HH2  ARG  81          2HH2      ARG  81  43.681 -49.576  -5.789
  640    H    THR  82           H        THR  82  36.407 -50.521  -8.749
  641    HA   THR  82           HA       THR  82  34.457 -50.884  -6.697
  642    HB   THR  82           HB       THR  82  34.462 -48.822  -8.907
  643    HG1  THR  82           1HG      THR  82  35.554 -48.745  -6.262
  644   1HG2  THR  82          1HG2      THR  82  33.108 -48.825  -6.205
  645   2HG2  THR  82          2HG2      THR  82  32.301 -49.057  -7.756
  646   3HG2  THR  82          3HG2      THR  82  33.070 -47.514  -7.386
  647    H    ARG  83           H        ARG  83  33.590 -49.945  -9.960
  648    HA   ARG  83           HA       ARG  83  31.536 -52.025  -9.942
  649   1HB   ARG  83          2HB       ARG  83  31.807 -49.481 -11.518
  650   2HB   ARG  83          1HB       ARG  83  30.589 -50.690 -11.859
  651   1HG   ARG  83          2HG       ARG  83  30.841 -49.482  -9.130
  652   2HG   ARG  83          1HG       ARG  83  29.932 -48.680 -10.410
  653   1HD   ARG  83          2HD       ARG  83  28.495 -50.057  -8.959
  654   2HD   ARG  83          1HD       ARG  83  28.477 -50.595 -10.637
  655    HE   ARG  83           HE       ARG  83  30.173 -51.946  -8.639
  656   1HH1  ARG  83          1HH1      ARG  83  27.574 -52.009 -10.987
  657   2HH1  ARG  83          2HH1      ARG  83  27.457 -53.743 -11.022
  658   1HH2  ARG  83          1HH2      ARG  83  30.022 -54.240  -8.649
  659   2HH2  ARG  83          2HH2      ARG  83  28.843 -55.014  -9.671
  660    H    HIS  84           H        HIS  84  31.983 -53.766 -10.998
  661    HA   HIS  84           HA       HIS  84  33.986 -53.666 -13.150
  662   1HB   HIS  84          2HB       HIS  84  34.712 -54.734 -10.972
  663   2HB   HIS  84          1HB       HIS  84  33.503 -55.977 -11.261
  664    HD1  HIS  84           1HD      HIS  84  36.869 -54.830 -12.318
  665    HD2  HIS  84           2HD      HIS  84  34.143 -57.802 -13.310
  666    HE1  HIS  84           1HE      HIS  84  38.147 -56.476 -13.724
  667    HE2  HIS  84           2HE      HIS  84  36.544 -58.393 -14.067
  668    HA   PRO  85           HA       PRO  85  30.398 -55.620 -15.134
  669   1HB   PRO  85          2HB       PRO  85  30.342 -54.118 -17.334
  670   2HB   PRO  85          1HB       PRO  85  29.763 -53.482 -15.791
  671   1HG   PRO  85          2HG       PRO  85  32.293 -52.909 -17.241
  672   2HG   PRO  85          1HG       PRO  85  31.326 -51.852 -16.202
  673   1HD   PRO  85          2HD       PRO  85  33.650 -53.300 -15.469
  674   2HD   PRO  85          1HD       PRO  85  32.562 -52.409 -14.389
  675    H    ALA  86           H        ALA  86  30.284 -56.215 -17.664
  676    HA   ALA  86           HA       ALA  86  32.859 -57.466 -18.354
  677   1HB   ALA  86          1HB       ALA  86  31.072 -59.072 -17.859
  678   2HB   ALA  86          2HB       ALA  86  31.601 -59.168 -19.537
  679   3HB   ALA  86          3HB       ALA  86  30.083 -58.363 -19.137
  680    H    GLU  87           H        GLU  87  33.794 -56.900 -20.203
  681    HA   GLU  87           HA       GLU  87  32.902 -54.587 -21.550
  682   1HB   GLU  87          2HB       GLU  87  35.040 -56.552 -22.371
  683   2HB   GLU  87          1HB       GLU  87  34.850 -54.919 -22.989
  684   1HG   GLU  87          2HG       GLU  87  35.366 -53.984 -20.846
  685   2HG   GLU  87          1HG       GLU  87  35.393 -55.588 -20.113
  686    H    SER  88           H        SER  88  33.316 -57.922 -22.768
  687    HA   SER  88           HA       SER  88  32.183 -57.184 -25.295
  688   1HB   SER  88          2HB       SER  88  33.978 -58.984 -24.823
  689   2HB   SER  88          1HB       SER  88  32.609 -60.031 -24.434
  690    HG   SER  88           HG       SER  88  32.616 -58.539 -26.828
  691    H    CYS  89           H        CYS  89  30.917 -58.525 -22.358
  692    HA   CYS  89           HA       CYS  89  28.545 -59.627 -23.419
  693   1HB   CYS  89          2HB       CYS  89  29.118 -58.515 -20.672
  694   2HB   CYS  89          1HB       CYS  89  27.640 -59.369 -21.101
  695    HG   CYS  89           HG       CYS  89  30.773 -60.746 -21.304
  696    H    LEU  90           H        LEU  90  29.526 -56.383 -22.817
  697    HA   LEU  90           HA       LEU  90  26.984 -55.130 -22.908
  698   1HB   LEU  90          2HB       LEU  90  28.966 -53.920 -22.182
  699   2HB   LEU  90          1HB       LEU  90  29.711 -54.135 -23.755
  700    HG   LEU  90           HG       LEU  90  27.918 -52.725 -24.752
  701   1HD1  LEU  90          1HD1      LEU  90  26.204 -53.114 -23.037
  702   2HD1  LEU  90          2HD1      LEU  90  26.494 -51.395 -23.302
  703   3HD1  LEU  90          3HD1      LEU  90  27.165 -52.194 -21.880
  704   1HD2  LEU  90          1HD2      LEU  90  29.514 -51.460 -22.531
  705   2HD2  LEU  90          2HD2      LEU  90  28.781 -50.603 -23.885
  706   3HD2  LEU  90          3HD2      LEU  90  30.074 -51.765 -24.173
  707    H    GLU  91           H        GLU  91  29.244 -56.245 -25.344
  708    HA   GLU  91           HA       GLU  91  27.716 -55.222 -27.570
  709   1HB   GLU  91          2HB       GLU  91  29.825 -57.360 -27.730
  710   2HB   GLU  91          1HB       GLU  91  29.393 -56.156 -28.933
  711   1HG   GLU  91          2HG       GLU  91  30.451 -54.422 -27.688
  712   2HG   GLU  91          1HG       GLU  91  30.702 -55.497 -26.309
  713    H    HIS  92           H        HIS  92  28.512 -58.395 -26.221
  714    HA   HIS  92           HA       HIS  92  26.453 -59.634 -27.907
  715   1HB   HIS  92          2HB       HIS  92  28.669 -60.952 -26.312
  716   2HB   HIS  92          1HB       HIS  92  27.569 -61.758 -27.422
  717    HD1  HIS  92           1HD      HIS  92  28.337 -61.967 -29.778
  718    HD2  HIS  92           2HD      HIS  92  30.454 -59.066 -27.683
  719    HE1  HIS  92           1HE      HIS  92  30.187 -61.226 -31.319
  720    HE2  HIS  92           2HE      HIS  92  31.296 -59.308 -30.111
  721    H    HIS  93           H        HIS  93  24.969 -58.505 -26.272
  722    HA   HIS  93           HA       HIS  93  24.720 -59.588 -23.678
  723   1HB   HIS  93          2HB       HIS  93  22.489 -58.594 -23.613
  724   2HB   HIS  93          1HB       HIS  93  23.653 -57.460 -24.282
  725    HD1  HIS  93           1HD      HIS  93  20.386 -57.817 -24.673
  726    HD2  HIS  93           2HD      HIS  93  23.449 -58.357 -27.441
  727    HE1  HIS  93           1HE      HIS  93  19.326 -57.508 -26.935
  728    HE2  HIS  93           2HE      HIS  93  21.171 -57.946 -28.600
  729    H    HIS  94           H        HIS  94  24.013 -61.479 -23.008
  730    HA   HIS  94           HA       HIS  94  23.617 -63.484 -25.021
  731   1HB   HIS  94          2HB       HIS  94  23.594 -63.697 -22.004
  732   2HB   HIS  94          1HB       HIS  94  23.607 -65.061 -23.116
  733    HD1  HIS  94           1HD      HIS  94  25.833 -65.677 -24.205
  734    HD2  HIS  94           2HD      HIS  94  26.041 -62.326 -21.750
  735    HE1  HIS  94           1HE      HIS  94  28.289 -65.211 -23.899
  736    HE2  HIS  94           2HE      HIS  94  28.375 -63.347 -22.208
  737    H    HIS  95           H        HIS  95  21.890 -64.984 -25.126
  738    HA   HIS  95           HA       HIS  95  19.415 -64.070 -23.814
  739   1HB   HIS  95          2HB       HIS  95  18.103 -64.851 -25.620
  740   2HB   HIS  95          1HB       HIS  95  19.448 -64.008 -26.374
  741    HD1  HIS  95           1HD      HIS  95  17.807 -67.313 -26.129
  742    HD2  HIS  95           2HD      HIS  95  21.313 -65.725 -27.699
  743    HE1  HIS  95           1HE      HIS  95  18.715 -69.079 -27.677
  744    HE2  HIS  95           2HE      HIS  95  20.702 -67.993 -28.792
  745    H    HIS  96           H        HIS  96  18.630 -65.386 -22.310
  746    HA   HIS  96           HA       HIS  96  19.749 -68.102 -22.180
  747   1HB   HIS  96          2HB       HIS  96  20.193 -66.578 -20.247
  748   2HB   HIS  96          1HB       HIS  96  18.456 -66.499 -19.961
  749    HD1  HIS  96           1HD      HIS  96  17.347 -68.511 -18.818
  750    HD2  HIS  96           2HD      HIS  96  21.405 -69.032 -19.591
  751    HE1  HIS  96           1HE      HIS  96  18.019 -70.586 -17.566
  752    HE2  HIS  96           2HE      HIS  96  20.445 -70.952 -18.151
  753    H    HIS  97           H        HIS  97  18.420 -69.657 -22.833
  754    HA   HIS  97           HA       HIS  97  15.553 -69.149 -22.892
  755   1HB   HIS  97          2HB       HIS  97  16.841 -70.189 -24.838
  756   2HB   HIS  97          1HB       HIS  97  16.972 -71.638 -23.847
  757    HD1  HIS  97           1HD      HIS  97  14.887 -70.100 -26.321
  758    HD2  HIS  97           2HD      HIS  97  14.260 -72.644 -23.093
  759    HE1  HIS  97           1HE      HIS  97  12.650 -71.178 -26.728
  760    HE2  HIS  97           2HE      HIS  97  12.400 -72.869 -24.877
  Start of MODEL   16
    1   1H    MET   1          1HT       MET   1  -2.724  15.792  -8.471
    2   2H    MET   1          2HT       MET   1  -3.497  15.615  -6.979
    3   3H    MET   1          3HT       MET   1  -2.273  14.533  -7.428
    4    HA   MET   1           HA       MET   1  -1.877  17.436  -7.010
    5   1HB   MET   1          2HB       MET   1  -1.380  15.081  -5.180
    6   2HB   MET   1          1HB       MET   1  -0.620  16.648  -4.948
    7   1HG   MET   1          2HG       MET   1  -2.534  16.427  -3.501
    8   2HG   MET   1          1HG       MET   1  -2.829  17.677  -4.708
    9   1HE   MET   1          1HE       MET   1  -5.418  17.583  -4.044
   10   2HE   MET   1          2HE       MET   1  -5.085  16.299  -2.880
   11   3HE   MET   1          3HE       MET   1  -6.377  16.101  -4.065
   12    HA   PRO   2           HA       PRO   2   2.064  16.684  -8.973
   13   1HB   PRO   2          2HB       PRO   2   3.635  18.453  -7.612
   14   2HB   PRO   2          1HB       PRO   2   2.507  18.939  -8.882
   15   1HG   PRO   2          2HG       PRO   2   2.166  19.030  -5.908
   16   2HG   PRO   2          1HG       PRO   2   1.708  20.235  -7.124
   17   1HD   PRO   2          2HD       PRO   2  -0.083  18.544  -6.022
   18   2HD   PRO   2          1HD       PRO   2  -0.216  19.108  -7.701
   19    H    THR   3           H        THR   3   1.643  16.538  -5.560
   20    HA   THR   3           HA       THR   3   4.027  14.874  -5.238
   21    HB   THR   3           HB       THR   3   3.286  15.160  -2.729
   22    HG1  THR   3           1HG      THR   3   1.389  16.270  -2.922
   23   1HG2  THR   3          1HG2      THR   3   4.511  17.417  -4.319
   24   2HG2  THR   3          2HG2      THR   3   5.369  16.019  -3.672
   25   3HG2  THR   3          3HG2      THR   3   4.644  17.194  -2.576
   26    H    LYS   4           H        LYS   4   3.671  12.777  -5.459
   27    HA   LYS   4           HA       LYS   4   1.297  11.605  -4.179
   28   1HB   LYS   4          2HB       LYS   4   1.289  11.835  -6.823
   29   2HB   LYS   4          1HB       LYS   4   2.326  10.422  -6.736
   30   1HG   LYS   4          2HG       LYS   4  -0.426  10.587  -5.521
   31   2HG   LYS   4          1HG       LYS   4  -0.073   9.915  -7.112
   32   1HD   LYS   4          2HD       LYS   4   1.367   8.225  -6.077
   33   2HD   LYS   4          1HD       LYS   4   1.019   8.904  -4.487
   34   1HE   LYS   4          2HE       LYS   4  -0.356   6.945  -4.874
   35   2HE   LYS   4          1HE       LYS   4  -1.363   8.388  -4.797
   36   1HZ   LYS   4          1HZ       LYS   4  -1.488   8.409  -7.203
   37   2HZ   LYS   4          2HZ       LYS   4  -2.018   6.913  -6.610
   38   3HZ   LYS   4          3HZ       LYS   4  -0.477   7.053  -7.305
   39    H    THR   5           H        THR   5   2.609  11.035  -2.453
   40    HA   THR   5           HA       THR   5   5.147   9.755  -2.880
   41    HB   THR   5           HB       THR   5   3.832   9.844  -0.203
   42    HG1  THR   5           1HG      THR   5   4.899  12.092  -1.609
   43   1HG2  THR   5          1HG2      THR   5   6.083   8.910  -0.434
   44   2HG2  THR   5          2HG2      THR   5   6.104  10.392   0.523
   45   3HG2  THR   5          3HG2      THR   5   6.635  10.419  -1.158
   46    H    TYR   6           H        TYR   6   5.722   7.712  -2.065
   47    HA   TYR   6           HA       TYR   6   3.555   5.823  -1.525
   48   1HB   TYR   6          2HB       TYR   6   4.782   4.112  -2.798
   49   2HB   TYR   6          1HB       TYR   6   4.320   5.451  -3.833
   50    HD1  TYR   6           1HD      TYR   6   7.086   3.607  -2.341
   51    HD2  TYR   6           2HD      TYR   6   6.047   7.000  -4.690
   52    HE1  TYR   6           1HE      TYR   6   9.420   3.803  -3.080
   53    HE2  TYR   6           2HE      TYR   6   8.385   7.207  -5.432
   54    HH   TYR   6           HH       TYR   6  10.650   6.541  -4.650
   55    H    SER   7           H        SER   7   4.460   3.829  -0.391
   56    HA   SER   7           HA       SER   7   6.721   4.628   1.312
   57   1HB   SER   7          2HB       SER   7   4.341   2.926   2.083
   58   2HB   SER   7          1HB       SER   7   5.682   3.372   3.140
   59    HG   SER   7           HG       SER   7   3.566   4.929   2.161
   60    H    GLU   8           H        GLU   8   8.308   3.192   1.697
   61    HA   GLU   8           HA       GLU   8   8.730   1.022  -0.041
   62   1HB   GLU   8          2HB       GLU   8  10.695   0.537   1.287
   63   2HB   GLU   8          1HB       GLU   8  10.547   2.275   1.099
   64   1HG   GLU   8          2HG       GLU   8   9.787   0.699   3.555
   65   2HG   GLU   8          1HG       GLU   8  11.254   1.652   3.355
   66    H    GLU   9           H        GLU   9   7.407   1.258   3.195
   67    HA   GLU   9           HA       GLU   9   7.274  -1.472   3.824
   68   1HB   GLU   9          2HB       GLU   9   6.882   0.440   5.390
   69   2HB   GLU   9          1HB       GLU   9   5.315   0.677   4.637
   70   1HG   GLU   9          2HG       GLU   9   4.617  -1.541   5.337
   71   2HG   GLU   9          1HG       GLU   9   6.200  -1.817   6.067
   72    H    PHE  10           H        PHE  10   5.196   0.579   1.905
   73    HA   PHE  10           HA       PHE  10   3.031  -1.213   1.593
   74   1HB   PHE  10          2HB       PHE  10   2.832   1.164   1.051
   75   2HB   PHE  10          1HB       PHE  10   4.031   0.997  -0.224
   76    HD1  PHE  10           1HD      PHE  10   3.341   0.628  -2.397
   77    HD2  PHE  10           2HD      PHE  10   0.694  -0.292   0.810
   78    HE1  PHE  10           1HE      PHE  10   1.549   0.157  -4.013
   79    HE2  PHE  10           2HE      PHE  10  -1.099  -0.768  -0.806
   80    HZ   PHE  10           HZ       PHE  10  -0.671  -0.543  -3.220
   81    H    LYS  11           H        LYS  11   5.980  -0.646  -0.272
   82    HA   LYS  11           HA       LYS  11   5.462  -2.606  -2.267
   83   1HB   LYS  11          2HB       LYS  11   8.144  -1.494  -1.389
   84   2HB   LYS  11          1HB       LYS  11   7.771  -2.247  -2.935
   85   1HG   LYS  11          2HG       LYS  11   6.312  -0.424  -3.526
   86   2HG   LYS  11          1HG       LYS  11   6.520   0.305  -1.937
   87   1HD   LYS  11          2HD       LYS  11   7.898   1.513  -3.444
   88   2HD   LYS  11          1HD       LYS  11   8.969   0.505  -2.477
   89   1HE   LYS  11          2HE       LYS  11   9.353  -0.980  -4.230
   90   2HE   LYS  11          1HE       LYS  11   7.954  -0.408  -5.136
   91   1HZ   LYS  11          1HZ       LYS  11   9.066   1.648  -5.576
   92   2HZ   LYS  11          2HZ       LYS  11  10.088   0.384  -6.045
   93   3HZ   LYS  11          3HZ       LYS  11  10.382   1.223  -4.600
   94    H    ARG  12           H        ARG  12   6.990  -2.635   0.873
   95    HA   ARG  12           HA       ARG  12   8.026  -5.272   0.815
   96   1HB   ARG  12          2HB       ARG  12   8.735  -3.676   2.496
   97   2HB   ARG  12          1HB       ARG  12   7.094  -3.515   3.094
   98   1HG   ARG  12          2HG       ARG  12   7.215  -5.956   3.734
   99   2HG   ARG  12          1HG       ARG  12   8.941  -5.870   3.373
  100   1HD   ARG  12          2HD       ARG  12   9.231  -4.112   5.012
  101   2HD   ARG  12          1HD       ARG  12   7.500  -4.080   5.326
  102    HE   ARG  12           HE       ARG  12   9.422  -6.065   6.253
  103   1HH1  ARG  12          1HH1      ARG  12   6.059  -5.138   5.909
  104   2HH1  ARG  12          2HH1      ARG  12   5.522  -6.116   7.246
  105   1HH2  ARG  12          1HH2      ARG  12   8.739  -7.327   8.012
  106   2HH2  ARG  12          2HH2      ARG  12   7.055  -7.373   8.434
  107    H    ASP  13           H        ASP  13   4.900  -3.910   1.714
  108    HA   ASP  13           HA       ASP  13   3.741  -6.253   2.782
  109   1HB   ASP  13          2HB       ASP  13   2.851  -3.957   3.140
  110   2HB   ASP  13          1HB       ASP  13   2.356  -3.913   1.452
  111    H    ALA  14           H        ALA  14   3.900  -4.909  -0.461
  112    HA   ALA  14           HA       ALA  14   2.180  -6.695  -1.772
  113   1HB   ALA  14          1HB       ALA  14   4.648  -5.342  -2.868
  114   2HB   ALA  14          2HB       ALA  14   3.037  -4.629  -2.787
  115   3HB   ALA  14          3HB       ALA  14   3.328  -6.032  -3.814
  116    H    VAL  15           H        VAL  15   5.568  -6.968  -0.857
  117    HA   VAL  15           HA       VAL  15   6.062  -9.403  -2.242
  118    HB   VAL  15           HB       VAL  15   7.460  -8.307   0.203
  119   1HG1  VAL  15          1HG1      VAL  15   8.369 -10.388  -1.783
  120   2HG1  VAL  15          2HG1      VAL  15   7.877 -10.697  -0.117
  121   3HG1  VAL  15          3HG1      VAL  15   9.324  -9.742  -0.450
  122   1HG2  VAL  15          1HG2      VAL  15   8.093  -8.020  -2.727
  123   2HG2  VAL  15          2HG2      VAL  15   9.120  -7.482  -1.400
  124   3HG2  VAL  15          3HG2      VAL  15   7.538  -6.743  -1.641
  125    H    ALA  16           H        ALA  16   5.015  -8.630   1.047
  126    HA   ALA  16           HA       ALA  16   4.923 -11.266   2.036
  127   1HB   ALA  16          1HB       ALA  16   3.467 -10.391   3.776
  128   2HB   ALA  16          2HB       ALA  16   3.189  -8.926   2.831
  129   3HB   ALA  16          3HB       ALA  16   4.797  -9.276   3.464
  130    H    LEU  17           H        LEU  17   2.587  -9.300   0.287
  131    HA   LEU  17           HA       LEU  17   0.454 -11.131   0.249
  132   1HB   LEU  17          2HB       LEU  17   1.308  -8.978  -1.677
  133   2HB   LEU  17          1HB       LEU  17  -0.159  -9.908  -1.896
  134    HG   LEU  17           HG       LEU  17   0.427  -8.201   0.522
  135   1HD1  LEU  17          1HD1      LEU  17   0.196  -6.825  -1.475
  136   2HD1  LEU  17          2HD1      LEU  17  -1.210  -6.650  -0.424
  137   3HD1  LEU  17          3HD1      LEU  17  -1.313  -7.646  -1.876
  138   1HD2  LEU  17          1HD2      LEU  17  -2.087  -9.578  -0.413
  139   2HD2  LEU  17          2HD2      LEU  17  -1.958  -8.510   0.985
  140   3HD2  LEU  17          3HD2      LEU  17  -1.095 -10.049   0.968
  141    H    TYR  18           H        TYR  18   3.352 -10.843  -1.720
  142    HA   TYR  18           HA       TYR  18   2.568 -12.773  -3.664
  143   1HB   TYR  18          2HB       TYR  18   4.262 -11.027  -4.114
  144   2HB   TYR  18          1HB       TYR  18   5.348 -11.804  -2.967
  145    HD1  TYR  18           1HD      TYR  18   6.877 -13.375  -3.750
  146    HD2  TYR  18           2HD      TYR  18   3.417 -12.528  -6.073
  147    HE1  TYR  18           1HE      TYR  18   7.746 -14.806  -5.554
  148    HE2  TYR  18           2HE      TYR  18   4.276 -13.950  -7.885
  149    HH   TYR  18           HH       TYR  18   6.935 -16.055  -7.463
  150    H    GLU  19           H        GLU  19   4.170 -12.936  -0.554
  151    HA   GLU  19           HA       GLU  19   5.114 -15.588  -0.712
  152   1HB   GLU  19          2HB       GLU  19   3.968 -14.165   1.707
  153   2HB   GLU  19          1HB       GLU  19   4.918 -15.641   1.746
  154   1HG   GLU  19          2HG       GLU  19   6.828 -14.393   0.795
  155   2HG   GLU  19          1HG       GLU  19   5.867 -12.916   0.891
  156    H    ASN  20           H        ASN  20   1.990 -14.204  -0.109
  157    HA   ASN  20           HA       ASN  20   0.782 -16.828   0.370
  158   1HB   ASN  20          2HB       ASN  20  -0.233 -14.013   0.800
  159   2HB   ASN  20          1HB       ASN  20  -1.185 -15.460   1.101
  160   1HD2  ASN  20          1HD2      ASN  20   1.479 -13.501   2.161
  161   2HD2  ASN  20          2HD2      ASN  20   1.691 -14.254   3.705
  162    H    SER  21           H        SER  21   1.661 -15.778  -2.271
  163    HA   SER  21           HA       SER  21  -0.542 -14.815  -3.748
  164   1HB   SER  21          2HB       SER  21   0.841 -15.486  -5.740
  165   2HB   SER  21          1HB       SER  21   1.653 -14.422  -4.592
  166    HG   SER  21           HG       SER  21   3.051 -15.935  -4.178
  167    H    ASP  22           H        ASP  22   0.310 -17.986  -2.744
  168    HA   ASP  22           HA       ASP  22  -0.997 -19.489  -4.735
  169   1HB   ASP  22          2HB       ASP  22   0.518 -20.504  -3.089
  170   2HB   ASP  22          1HB       ASP  22  -0.633 -20.152  -1.805
  171    H    GLY  23           H        GLY  23  -2.176 -17.585  -2.120
  172   1HA   GLY  23          2HA       GLY  23  -4.919 -18.508  -2.701
  173   2HA   GLY  23          1HA       GLY  23  -4.425 -17.754  -1.191
  174    H    ALA  24           H        ALA  24  -2.784 -16.122  -3.488
  175    HA   ALA  24           HA       ALA  24  -4.928 -14.263  -4.148
  176   1HB   ALA  24          1HB       ALA  24  -2.468 -13.425  -2.620
  177   2HB   ALA  24          2HB       ALA  24  -4.114 -13.487  -1.990
  178   3HB   ALA  24          3HB       ALA  24  -3.703 -12.346  -3.269
  179    H    SER  25           H        SER  25  -4.688 -14.523  -6.294
  180    HA   SER  25           HA       SER  25  -2.244 -14.945  -7.618
  181   1HB   SER  25          2HB       SER  25  -4.430 -15.603  -8.554
  182   2HB   SER  25          1HB       SER  25  -4.857 -13.904  -8.744
  183    HG   SER  25           HG       SER  25  -2.640 -15.186  -9.987
  184    H    LEU  26           H        LEU  26  -1.112 -13.560  -9.088
  185    HA   LEU  26           HA       LEU  26  -0.389 -11.102  -8.061
  186   1HB   LEU  26          2HB       LEU  26  -0.086 -12.314 -10.788
  187   2HB   LEU  26          1HB       LEU  26   0.608 -10.770 -10.369
  188    HG   LEU  26           HG       LEU  26   1.255 -13.384  -9.017
  189   1HD1  LEU  26          1HD1      LEU  26   2.863 -11.719 -10.948
  190   2HD1  LEU  26          2HD1      LEU  26   2.121 -13.280 -11.294
  191   3HD1  LEU  26          3HD1      LEU  26   3.427 -13.167 -10.114
  192   1HD2  LEU  26          1HD2      LEU  26   3.012 -12.124  -7.897
  193   2HD2  LEU  26          2HD2      LEU  26   1.425 -11.452  -7.521
  194   3HD2  LEU  26          3HD2      LEU  26   2.472 -10.644  -8.689
  195    H    GLN  27           H        GLN  27  -2.767 -11.881 -10.553
  196    HA   GLN  27           HA       GLN  27  -3.289  -9.226 -11.363
  197   1HB   GLN  27          2HB       GLN  27  -4.013 -11.258 -12.624
  198   2HB   GLN  27          1HB       GLN  27  -5.211 -11.564 -11.373
  199   1HG   GLN  27          2HG       GLN  27  -6.284 -10.500 -13.231
  200   2HG   GLN  27          1HG       GLN  27  -6.240  -9.376 -11.875
  201   1HE2  GLN  27          1HE2      GLN  27  -6.474  -7.603 -13.235
  202   2HE2  GLN  27          2HE2      GLN  27  -5.180  -7.031 -14.227
  203    H    GLN  28           H        GLN  28  -4.608 -11.263  -8.820
  204    HA   GLN  28           HA       GLN  28  -6.705  -9.522  -8.039
  205   1HB   GLN  28          2HB       GLN  28  -6.578 -11.969  -7.514
  206   2HB   GLN  28          1HB       GLN  28  -5.282 -11.622  -6.380
  207   1HG   GLN  28          2HG       GLN  28  -7.781 -10.109  -5.996
  208   2HG   GLN  28          1HG       GLN  28  -7.863 -11.842  -5.691
  209   1HE2  GLN  28          1HE2      GLN  28  -6.556  -8.805  -4.654
  210   2HE2  GLN  28          2HE2      GLN  28  -5.937  -9.361  -3.137
  211    H    ILE  29           H        ILE  29  -3.381 -10.010  -6.920
  212    HA   ILE  29           HA       ILE  29  -3.433  -8.148  -4.808
  213    HB   ILE  29           HB       ILE  29  -1.078  -8.998  -6.506
  214   1HG1  ILE  29          2HG1      ILE  29  -2.191 -10.894  -5.421
  215   2HG1  ILE  29          1HG1      ILE  29  -0.620 -10.592  -4.690
  216   1HG2  ILE  29          1HG2      ILE  29  -1.153  -7.677  -3.797
  217   2HG2  ILE  29          2HG2      ILE  29  -0.581  -6.956  -5.301
  218   3HG2  ILE  29          3HG2      ILE  29   0.295  -8.309  -4.583
  219   1HD1  ILE  29          1HD1      ILE  29  -3.294  -9.795  -3.567
  220   2HD1  ILE  29          2HD1      ILE  29  -1.729  -9.428  -2.841
  221   3HD1  ILE  29          3HD1      ILE  29  -2.255 -11.104  -2.999
  222    H    ALA  30           H        ALA  30  -2.257  -7.798  -8.158
  223    HA   ALA  30           HA       ALA  30  -1.584  -5.081  -7.986
  224   1HB   ALA  30          1HB       ALA  30  -2.442  -6.647 -10.417
  225   2HB   ALA  30          2HB       ALA  30  -0.798  -6.537  -9.781
  226   3HB   ALA  30          3HB       ALA  30  -1.595  -5.100 -10.426
  227    H    ASN  31           H        ASN  31  -4.614  -6.683  -8.792
  228    HA   ASN  31           HA       ASN  31  -5.984  -4.392  -9.736
  229   1HB   ASN  31          2HB       ASN  31  -6.547  -7.001  -9.822
  230   2HB   ASN  31          1HB       ASN  31  -7.489  -6.592  -8.394
  231   1HD2  ASN  31          1HD2      ASN  31  -8.463  -7.531 -10.899
  232   2HD2  ASN  31          2HD2      ASN  31  -9.500  -6.299 -11.532
  233    H    ASP  32           H        ASP  32  -5.731  -5.921  -6.552
  234    HA   ASP  32           HA       ASP  32  -7.645  -4.246  -5.276
  235   1HB   ASP  32          2HB       ASP  32  -6.972  -6.476  -4.412
  236   2HB   ASP  32          1HB       ASP  32  -5.385  -5.820  -4.022
  237    H    LEU  33           H        LEU  33  -4.116  -4.192  -5.503
  238    HA   LEU  33           HA       LEU  33  -3.835  -1.887  -3.826
  239   1HB   LEU  33          2HB       LEU  33  -1.983  -3.482  -5.557
  240   2HB   LEU  33          1HB       LEU  33  -1.471  -1.925  -4.945
  241    HG   LEU  33           HG       LEU  33  -1.819  -2.736  -2.631
  242   1HD1  LEU  33          1HD1      LEU  33  -2.173  -5.098  -2.199
  243   2HD1  LEU  33          2HD1      LEU  33  -2.341  -5.404  -3.928
  244   3HD1  LEU  33          3HD1      LEU  33  -3.533  -4.413  -3.091
  245   1HD2  LEU  33          1HD2      LEU  33   0.378  -2.864  -3.688
  246   2HD2  LEU  33          2HD2      LEU  33  -0.007  -4.468  -4.308
  247   3HD2  LEU  33          3HD2      LEU  33   0.125  -4.203  -2.569
  248    H    GLY  34           H        GLY  34  -4.506  -2.402  -7.160
  249   1HA   GLY  34          2HA       GLY  34  -5.163  -0.838  -8.739
  250   2HA   GLY  34          1HA       GLY  34  -4.794   0.436  -7.585
  251    H    ILE  35           H        ILE  35  -2.689  -2.115  -8.804
  252    HA   ILE  35           HA       ILE  35  -1.026  -0.073 -10.108
  253    HB   ILE  35           HB       ILE  35   0.989  -1.282  -9.268
  254   1HG1  ILE  35          2HG1      ILE  35  -0.988  -2.611  -7.401
  255   2HG1  ILE  35          1HG1      ILE  35  -0.118  -3.407  -8.709
  256   1HG2  ILE  35          1HG2      ILE  35   0.960  -0.278  -7.031
  257   2HG2  ILE  35          2HG2      ILE  35  -0.783  -0.058  -7.164
  258   3HG2  ILE  35          3HG2      ILE  35   0.299   0.808  -8.253
  259   1HD1  ILE  35          1HD1      ILE  35   0.898  -3.871  -6.557
  260   2HD1  ILE  35          2HD1      ILE  35   1.133  -2.146  -6.283
  261   3HD1  ILE  35          3HD1      ILE  35   1.991  -2.956  -7.592
  262    H    ASN  36           H        ASN  36   0.778  -1.276 -11.407
  263    HA   ASN  36           HA       ASN  36  -0.504  -3.212 -13.108
  264   1HB   ASN  36          2HB       ASN  36   0.840  -1.435 -14.088
  265   2HB   ASN  36          1HB       ASN  36   2.236  -1.929 -13.147
  266   1HD2  ASN  36          1HD2      ASN  36   3.472  -2.216 -14.948
  267   2HD2  ASN  36          2HD2      ASN  36   3.248  -3.539 -16.024
  268    H    ARG  37           H        ARG  37   0.118  -5.344 -13.365
  269    HA   ARG  37           HA       ARG  37   1.133  -6.654 -11.087
  270   1HB   ARG  37          2HB       ARG  37   1.085  -8.664 -12.619
  271   2HB   ARG  37          1HB       ARG  37  -0.428  -7.824 -12.382
  272   1HG   ARG  37          2HG       ARG  37  -0.238  -6.766 -14.533
  273   2HG   ARG  37          1HG       ARG  37   1.356  -7.488 -14.774
  274   1HD   ARG  37          2HD       ARG  37   0.475  -9.636 -15.005
  275   2HD   ARG  37          1HD       ARG  37  -1.055  -9.185 -14.251
  276    HE   ARG  37           HE       ARG  37  -1.371  -7.764 -16.329
  277   1HH1  ARG  37          1HH1      ARG  37   0.426 -10.762 -16.308
  278   2HH1  ARG  37          2HH1      ARG  37   0.104 -11.122 -17.981
  279   1HH2  ARG  37          1HH2      ARG  37  -1.860  -8.244 -18.494
  280   2HH2  ARG  37          2HH2      ARG  37  -1.218  -9.686 -19.229
  281    H    VAL  38           H        VAL  38   2.565  -5.660 -14.117
  282    HA   VAL  38           HA       VAL  38   5.007  -7.081 -13.805
  283    HB   VAL  38           HB       VAL  38   4.581  -4.498 -15.320
  284   1HG1  VAL  38          1HG1      VAL  38   6.487  -5.255 -16.670
  285   2HG1  VAL  38          2HG1      VAL  38   6.689  -6.634 -15.586
  286   3HG1  VAL  38          3HG1      VAL  38   6.919  -4.992 -14.981
  287   1HG2  VAL  38          1HG2      VAL  38   4.297  -7.342 -16.287
  288   2HG2  VAL  38          2HG2      VAL  38   4.201  -5.894 -17.292
  289   3HG2  VAL  38          3HG2      VAL  38   2.985  -6.187 -16.047
  290    H    THR  39           H        THR  39   4.021  -3.743 -13.033
  291    HA   THR  39           HA       THR  39   6.454  -2.915 -11.892
  292    HB   THR  39           HB       THR  39   3.730  -1.978 -10.985
  293    HG1  THR  39           1HG      THR  39   5.217  -1.098 -13.268
  294   1HG2  THR  39          1HG2      THR  39   6.401  -0.590 -11.240
  295   2HG2  THR  39          2HG2      THR  39   5.626  -1.085  -9.735
  296   3HG2  THR  39          3HG2      THR  39   4.896   0.176 -10.728
  297    H    LEU  40           H        LEU  40   3.599  -4.461 -10.510
  298    HA   LEU  40           HA       LEU  40   4.324  -4.568  -7.825
  299   1HB   LEU  40          2HB       LEU  40   2.117  -5.176  -8.568
  300   2HB   LEU  40          1HB       LEU  40   2.751  -6.484  -9.546
  301    HG   LEU  40           HG       LEU  40   3.490  -7.595  -7.408
  302   1HD1  LEU  40          1HD1      LEU  40   2.396  -6.861  -5.345
  303   2HD1  LEU  40          2HD1      LEU  40   1.761  -5.450  -6.193
  304   3HD1  LEU  40          3HD1      LEU  40   3.502  -5.638  -5.973
  305   1HD2  LEU  40          1HD2      LEU  40   1.482  -8.266  -8.629
  306   2HD2  LEU  40          2HD2      LEU  40   0.543  -7.061  -7.749
  307   3HD2  LEU  40          3HD2      LEU  40   1.258  -8.423  -6.887
  308    H    LYS  41           H        LYS  41   4.917  -6.938 -10.402
  309    HA   LYS  41           HA       LYS  41   6.264  -8.820  -8.813
  310   1HB   LYS  41          2HB       LYS  41   5.258  -9.009 -11.206
  311   2HB   LYS  41          1HB       LYS  41   6.838  -8.462 -11.738
  312   1HG   LYS  41          2HG       LYS  41   7.890 -10.371 -10.678
  313   2HG   LYS  41          1HG       LYS  41   6.327 -10.908 -10.056
  314   1HD   LYS  41          2HD       LYS  41   5.540 -11.009 -12.448
  315   2HD   LYS  41          1HD       LYS  41   7.219 -10.755 -12.928
  316   1HE   LYS  41          2HE       LYS  41   7.869 -12.773 -11.703
  317   2HE   LYS  41          1HE       LYS  41   6.188 -13.030 -11.237
  318   1HZ   LYS  41          1HZ       LYS  41   6.725 -14.402 -13.119
  319   2HZ   LYS  41          2HZ       LYS  41   7.282 -13.061 -13.999
  320   3HZ   LYS  41          3HZ       LYS  41   5.633 -13.197 -13.614
  321    H    ASN  42           H        ASN  42   7.414  -6.099 -10.715
  322    HA   ASN  42           HA       ASN  42  10.172  -6.606 -10.460
  323   1HB   ASN  42          2HB       ASN  42   8.593  -4.118 -11.057
  324   2HB   ASN  42          1HB       ASN  42  10.345  -4.068 -10.900
  325   1HD2  ASN  42          1HD2      ASN  42  10.592  -3.486 -13.060
  326   2HD2  ASN  42          2HD2      ASN  42  10.351  -4.608 -14.348
  327    H    TRP  43           H        TRP  43   7.903  -4.875  -8.371
  328    HA   TRP  43           HA       TRP  43   9.787  -3.829  -6.554
  329   1HB   TRP  43          2HB       TRP  43   6.930  -4.735  -6.165
  330   2HB   TRP  43          1HB       TRP  43   7.879  -4.020  -4.871
  331    HD1  TRP  43           HD       TRP  43   9.085  -2.010  -7.480
  332    HE1  TRP  43           1HE      TRP  43   7.691   0.118  -7.855
  333    HE3  TRP  43           3HE      TRP  43   4.852  -3.362  -4.961
  334    HZ2  TRP  43           2HZ      TRP  43   5.144   1.104  -7.153
  335    HZ3  TRP  43           3HZ      TRP  43   2.988  -1.764  -4.845
  336    HH2  TRP  43           HH       TRP  43   3.132   0.422  -5.919
  337    H    ILE  44           H        ILE  44   8.128  -6.915  -6.718
  338    HA   ILE  44           HA       ILE  44   9.014  -8.009  -4.295
  339    HB   ILE  44           HB       ILE  44   8.306  -9.506  -6.826
  340   1HG1  ILE  44          2HG1      ILE  44   6.468  -8.716  -4.554
  341   2HG1  ILE  44          1HG1      ILE  44   6.617  -7.783  -6.038
  342   1HG2  ILE  44          1HG2      ILE  44   7.664 -11.306  -5.298
  343   2HG2  ILE  44          2HG2      ILE  44   8.188 -10.330  -3.925
  344   3HG2  ILE  44          3HG2      ILE  44   9.367 -10.888  -5.111
  345   1HD1  ILE  44          1HD1      ILE  44   5.701 -10.643  -5.843
  346   2HD1  ILE  44          2HD1      ILE  44   5.841  -9.698  -7.325
  347   3HD1  ILE  44          3HD1      ILE  44   4.672  -9.232  -6.092
  348    H    ILE  45           H        ILE  45  10.513  -7.818  -7.454
  349    HA   ILE  45           HA       ILE  45  12.489  -9.791  -7.161
  350    HB   ILE  45           HB       ILE  45  12.672  -7.205  -8.714
  351   1HG1  ILE  45          2HG1      ILE  45  11.796  -9.958  -9.607
  352   2HG1  ILE  45          1HG1      ILE  45  10.716  -8.594  -9.315
  353   1HG2  ILE  45          1HG2      ILE  45  14.856  -8.232  -8.388
  354   2HG2  ILE  45          2HG2      ILE  45  14.344  -8.368 -10.070
  355   3HG2  ILE  45          3HG2      ILE  45  14.238  -9.766  -9.001
  356   1HD1  ILE  45          1HD1      ILE  45  12.863  -8.763 -11.429
  357   2HD1  ILE  45          2HD1      ILE  45  11.833  -7.365 -11.122
  358   3HD1  ILE  45          3HD1      ILE  45  11.121  -8.875 -11.680
  359    H    LYS  46           H        LYS  46  12.397  -6.440  -6.069
  360    HA   LYS  46           HA       LYS  46  15.218  -6.464  -5.390
  361   1HB   LYS  46          2HB       LYS  46  14.067  -4.439  -6.326
  362   2HB   LYS  46          1HB       LYS  46  13.185  -4.308  -4.810
  363   1HG   LYS  46          2HG       LYS  46  15.385  -4.146  -3.635
  364   2HG   LYS  46          1HG       LYS  46  16.156  -4.067  -5.220
  365   1HD   LYS  46          2HD       LYS  46  14.753  -2.079  -5.733
  366   2HD   LYS  46          1HD       LYS  46  14.155  -2.126  -4.073
  367   1HE   LYS  46          2HE       LYS  46  17.003  -1.697  -4.972
  368   2HE   LYS  46          1HE       LYS  46  15.933  -0.511  -4.222
  369   1HZ   LYS  46          1HZ       LYS  46  17.120  -2.926  -2.968
  370   2HZ   LYS  46          2HZ       LYS  46  15.875  -2.028  -2.246
  371   3HZ   LYS  46          3HZ       LYS  46  17.377  -1.302  -2.544
  372    H    TYR  47           H        TYR  47  12.112  -6.483  -3.702
  373    HA   TYR  47           HA       TYR  47  13.441  -6.279  -1.126
  374   1HB   TYR  47          2HB       TYR  47  10.523  -6.447  -1.869
  375   2HB   TYR  47          1HB       TYR  47  11.111  -6.277  -0.222
  376    HD1  TYR  47           1HD      TYR  47  10.690  -4.597  -3.458
  377    HD2  TYR  47           2HD      TYR  47  11.983  -4.151   0.568
  378    HE1  TYR  47           1HE      TYR  47  10.707  -2.159  -3.742
  379    HE2  TYR  47           2HE      TYR  47  12.006  -1.705   0.290
  380    HH   TYR  47           HH       TYR  47  12.188  -0.055  -1.544
  381    H    GLY  48           H        GLY  48  11.876  -8.714  -3.093
  382   1HA   GLY  48          2HA       GLY  48  12.016 -10.658  -0.900
  383   2HA   GLY  48          1HA       GLY  48  11.206 -10.894  -2.447
  384    H    SER  49           H        SER  49  14.310 -10.770  -0.829
  385    HA   SER  49           HA       SER  49  15.819 -11.461  -3.159
  386   1HB   SER  49          2HB       SER  49  16.697 -11.538  -0.267
  387   2HB   SER  49          1HB       SER  49  17.733 -11.445  -1.690
  388    HG   SER  49           HG       SER  49  16.129  -9.442  -1.962
  389    H    ASN  50           H        ASN  50  14.196 -13.301  -0.712
  390    HA   ASN  50           HA       ASN  50  15.888 -15.605  -0.910
  391   1HB   ASN  50          2HB       ASN  50  13.102 -15.406   0.206
  392   2HB   ASN  50          1HB       ASN  50  14.200 -16.754   0.430
  393   1HD2  ASN  50          1HD2      ASN  50  16.036 -16.493   1.735
  394   2HD2  ASN  50          2HD2      ASN  50  16.111 -15.235   2.922
  395    H    HIS  51           H        HIS  51  15.981 -16.849  -2.529
  396    HA   HIS  51           HA       HIS  51  15.556 -18.073  -4.376
  397   1HB   HIS  51          2HB       HIS  51  14.059 -19.308  -2.889
  398   2HB   HIS  51          1HB       HIS  51  12.754 -18.184  -3.246
  399    HD1  HIS  51           1HD      HIS  51  11.118 -19.483  -4.579
  400    HD2  HIS  51           2HD      HIS  51  15.034 -20.155  -5.827
  401    HE1  HIS  51           1HE      HIS  51  10.944 -20.959  -6.617
  402    HE2  HIS  51           2HE      HIS  51  13.322 -21.334  -7.374
  403    H    ASN  52           H        ASN  52  15.826 -16.888  -6.123
  404    HA   ASN  52           HA       ASN  52  14.130 -14.724  -6.840
  405   1HB   ASN  52          2HB       ASN  52  15.604 -14.699  -8.910
  406   2HB   ASN  52          1HB       ASN  52  16.411 -14.441  -7.372
  407   1HD2  ASN  52          1HD2      ASN  52  16.034 -16.546 -10.094
  408   2HD2  ASN  52          2HD2      ASN  52  17.319 -17.635  -9.694
  409    H    VAL  53           H        VAL  53  12.164 -15.965  -6.895
  410    HA   VAL  53           HA       VAL  53  11.508 -17.857  -8.852
  411    HB   VAL  53           HB       VAL  53   9.664 -15.670  -7.872
  412   1HG1  VAL  53          1HG1      VAL  53   7.911 -17.367  -8.268
  413   2HG1  VAL  53          2HG1      VAL  53   9.137 -18.444  -8.937
  414   3HG1  VAL  53          3HG1      VAL  53   8.774 -16.918  -9.741
  415   1HG2  VAL  53          1HG2      VAL  53  10.300 -18.329  -6.597
  416   2HG2  VAL  53          2HG2      VAL  53   8.992 -17.254  -6.104
  417   3HG2  VAL  53          3HG2      VAL  53  10.670 -16.733  -5.946
  418    H    GLN  54           H        GLN  54  11.525 -14.330  -8.949
  419    HA   GLN  54           HA       GLN  54  10.799 -14.185 -11.718
  420   1HB   GLN  54          2HB       GLN  54  12.113 -12.073  -9.989
  421   2HB   GLN  54          1HB       GLN  54  11.350 -11.806 -11.546
  422   1HG   GLN  54          2HG       GLN  54   9.779 -11.049 -10.024
  423   2HG   GLN  54          1HG       GLN  54   9.208 -12.668 -10.423
  424   1HE2  GLN  54          1HE2      GLN  54  10.709 -10.674  -7.995
  425   2HE2  GLN  54          2HE2      GLN  54  10.452 -11.748  -6.667
  426    H    GLY  55           H        GLY  55  12.311 -15.662 -12.617
  427   1HA   GLY  55          2HA       GLY  55  15.056 -14.590 -12.773
  428   2HA   GLY  55          1HA       GLY  55  14.708 -16.307 -12.716
  429    H    THR  56           H        THR  56  13.793 -17.306 -14.499
  430    HA   THR  56           HA       THR  56  13.924 -17.903 -16.666
  431    HB   THR  56           HB       THR  56  12.789 -16.293 -18.268
  432    HG1  THR  56           1HG      THR  56  13.237 -14.546 -16.415
  433   1HG2  THR  56          1HG2      THR  56  11.606 -18.122 -17.182
  434   2HG2  THR  56          2HG2      THR  56  10.574 -16.696 -17.314
  435   3HG2  THR  56          3HG2      THR  56  11.321 -17.106 -15.768
  436    H    THR  57           H        THR  57  16.017 -18.115 -17.167
  437    HA   THR  57           HA       THR  57  17.700 -15.802 -17.601
  438    HB   THR  57           HB       THR  57  18.369 -18.738 -17.885
  439    HG1  THR  57           1HG      THR  57  19.109 -18.566 -15.749
  440   1HG2  THR  57          1HG2      THR  57  20.143 -16.323 -17.500
  441   2HG2  THR  57          2HG2      THR  57  19.978 -17.258 -18.985
  442   3HG2  THR  57          3HG2      THR  57  20.683 -18.004 -17.551
  443    HA   PRO  58           HA       PRO  58  17.357 -16.274 -22.087
  444   1HB   PRO  58          2HB       PRO  58  17.394 -13.667 -22.677
  445   2HB   PRO  58          1HB       PRO  58  15.940 -14.428 -22.021
  446   1HG   PRO  58          2HG       PRO  58  17.859 -12.596 -20.713
  447   2HG   PRO  58          1HG       PRO  58  16.147 -12.871 -20.361
  448   1HD   PRO  58          2HD       PRO  58  18.426 -13.992 -19.027
  449   2HD   PRO  58          1HD       PRO  58  16.711 -14.284 -18.686
  450    H    SER  59           H        SER  59  18.778 -14.896 -23.800
  451    HA   SER  59           HA       SER  59  21.483 -15.558 -23.282
  452   1HB   SER  59          2HB       SER  59  20.507 -15.528 -25.550
  453   2HB   SER  59          1HB       SER  59  20.325 -13.780 -25.443
  454    HG   SER  59           HG       SER  59  22.221 -13.888 -26.399
  455    H    ALA  60           H        ALA  60  19.614 -12.706 -22.734
  456    HA   ALA  60           HA       ALA  60  21.756 -10.838 -22.662
  457   1HB   ALA  60          1HB       ALA  60  19.012 -10.643 -21.426
  458   2HB   ALA  60          2HB       ALA  60  19.438 -10.161 -23.068
  459   3HB   ALA  60          3HB       ALA  60  20.134  -9.307 -21.692
  460    H    ALA  61           H        ALA  61  20.675 -13.213 -20.462
  461    HA   ALA  61           HA       ALA  61  21.414 -11.807 -18.071
  462   1HB   ALA  61          1HB       ALA  61  20.786 -14.733 -18.418
  463   2HB   ALA  61          2HB       ALA  61  19.602 -13.470 -18.079
  464   3HB   ALA  61          3HB       ALA  61  20.855 -13.844 -16.895
  465    H    VAL  62           H        VAL  62  23.197 -13.234 -20.439
  466    HA   VAL  62           HA       VAL  62  25.214 -14.515 -18.893
  467    HB   VAL  62           HB       VAL  62  25.387 -13.376 -21.689
  468   1HG1  VAL  62          1HG1      VAL  62  27.318 -14.838 -21.981
  469   2HG1  VAL  62          2HG1      VAL  62  27.198 -15.346 -20.297
  470   3HG1  VAL  62          3HG1      VAL  62  27.596 -13.673 -20.684
  471   1HG2  VAL  62          1HG2      VAL  62  24.818 -16.185 -20.744
  472   2HG2  VAL  62          2HG2      VAL  62  25.050 -15.694 -22.422
  473   3HG2  VAL  62          3HG2      VAL  62  23.669 -15.086 -21.511
  474    H    SER  63           H        SER  63  24.785 -11.283 -20.194
  475    HA   SER  63           HA       SER  63  27.317 -10.330 -19.238
  476   1HB   SER  63          2HB       SER  63  24.902  -8.768 -20.189
  477   2HB   SER  63          1HB       SER  63  26.544  -8.148 -20.011
  478    HG   SER  63           HG       SER  63  27.149  -9.813 -21.577
  479    H    GLU  64           H        GLU  64  24.009 -10.367 -18.110
  480    HA   GLU  64           HA       GLU  64  24.305  -8.472 -16.015
  481   1HB   GLU  64          2HB       GLU  64  22.189  -9.627 -17.221
  482   2HB   GLU  64          1HB       GLU  64  22.270 -10.616 -15.770
  483   1HG   GLU  64          2HG       GLU  64  20.744  -8.828 -15.389
  484   2HG   GLU  64          1HG       GLU  64  22.189  -8.542 -14.418
  485    H    ALA  65           H        ALA  65  25.031 -11.797 -16.352
  486    HA   ALA  65           HA       ALA  65  24.823 -12.764 -13.761
  487   1HB   ALA  65          1HB       ALA  65  26.278 -14.554 -14.464
  488   2HB   ALA  65          2HB       ALA  65  26.818 -13.608 -15.850
  489   3HB   ALA  65          3HB       ALA  65  25.146 -14.157 -15.756
  490    H    GLU  66           H        GLU  66  27.206 -10.618 -15.088
  491    HA   GLU  66           HA       GLU  66  29.434 -11.283 -13.526
  492   1HB   GLU  66          2HB       GLU  66  29.448  -9.699 -15.463
  493   2HB   GLU  66          1HB       GLU  66  28.663  -8.506 -14.445
  494   1HG   GLU  66          2HG       GLU  66  31.008  -8.034 -14.534
  495   2HG   GLU  66          1HG       GLU  66  30.592  -8.582 -12.911
  496    H    GLN  67           H        GLN  67  26.814  -8.970 -12.851
  497    HA   GLN  67           HA       GLN  67  27.920  -8.304 -10.274
  498   1HB   GLN  67          2HB       GLN  67  25.938  -6.906  -9.996
  499   2HB   GLN  67          1HB       GLN  67  26.668  -6.636 -11.571
  500   1HG   GLN  67          2HG       GLN  67  24.950  -8.317 -12.443
  501   2HG   GLN  67          1HG       GLN  67  24.128  -8.068 -10.903
  502   1HE2  GLN  67          1HE2      GLN  67  25.027  -6.672 -13.927
  503   2HE2  GLN  67          2HE2      GLN  67  24.022  -5.280 -13.827
  504    H    ILE  68           H        ILE  68  25.464 -10.437 -11.547
  505    HA   ILE  68           HA       ILE  68  24.249 -11.255  -9.155
  506    HB   ILE  68           HB       ILE  68  24.765 -12.803 -11.710
  507   1HG1  ILE  68          2HG1      ILE  68  23.388 -10.814 -12.028
  508   2HG1  ILE  68          1HG1      ILE  68  22.420 -12.271 -12.220
  509   1HG2  ILE  68          1HG2      ILE  68  24.367 -14.345  -9.861
  510   2HG2  ILE  68          2HG2      ILE  68  23.001 -14.334 -10.977
  511   3HG2  ILE  68          3HG2      ILE  68  22.891 -13.474  -9.439
  512   1HD1  ILE  68          1HD1      ILE  68  21.554 -11.964  -9.941
  513   2HD1  ILE  68          2HD1      ILE  68  21.188 -10.601 -10.997
  514   3HD1  ILE  68          3HD1      ILE  68  22.483 -10.470  -9.806
  515    H    ARG  69           H        ARG  69  27.073 -12.406 -10.879
  516    HA   ARG  69           HA       ARG  69  27.885 -14.543  -9.336
  517   1HB   ARG  69          2HB       ARG  69  28.906 -14.116 -11.419
  518   2HB   ARG  69          1HB       ARG  69  29.334 -12.478 -10.966
  519   1HG   ARG  69          2HG       ARG  69  30.997 -13.390  -9.384
  520   2HG   ARG  69          1HG       ARG  69  30.603 -15.015  -9.962
  521   1HD   ARG  69          2HD       ARG  69  31.299 -14.466 -12.184
  522   2HD   ARG  69          1HD       ARG  69  31.494 -12.768 -11.760
  523    HE   ARG  69           HE       ARG  69  33.181 -14.807 -10.482
  524   1HH1  ARG  69          1HH1      ARG  69  32.812 -11.950 -12.487
  525   2HH1  ARG  69          2HH1      ARG  69  34.524 -11.679 -12.629
  526   1HH2  ARG  69          1HH2      ARG  69  35.428 -14.434 -10.644
  527   2HH2  ARG  69          2HH2      ARG  69  36.011 -13.061 -11.547
  528    H    GLN  70           H        GLN  70  28.271 -11.111  -8.720
  529    HA   GLN  70           HA       GLN  70  30.209 -11.452  -6.631
  530   1HB   GLN  70          2HB       GLN  70  29.698  -9.427  -8.248
  531   2HB   GLN  70          1HB       GLN  70  28.589  -8.971  -6.970
  532   1HG   GLN  70          2HG       GLN  70  31.334  -9.645  -6.141
  533   2HG   GLN  70          1HG       GLN  70  31.126  -8.172  -7.078
  534   1HE2  GLN  70          1HE2      GLN  70  31.712  -6.877  -5.350
  535   2HE2  GLN  70          2HE2      GLN  70  30.658  -6.614  -4.001
  536    H    LEU  71           H        LEU  71  26.758 -10.728  -6.809
  537    HA   LEU  71           HA       LEU  71  26.540 -10.348  -3.962
  538   1HB   LEU  71          2HB       LEU  71  25.227  -9.059  -5.630
  539   2HB   LEU  71          1HB       LEU  71  24.359 -10.523  -6.035
  540    HG   LEU  71           HG       LEU  71  23.499 -10.628  -3.715
  541   1HD1  LEU  71          1HD1      LEU  71  23.737  -8.672  -2.269
  542   2HD1  LEU  71          2HD1      LEU  71  24.829  -7.935  -3.445
  543   3HD1  LEU  71          3HD1      LEU  71  25.303  -9.416  -2.608
  544   1HD2  LEU  71          1HD2      LEU  71  22.957  -8.026  -5.143
  545   2HD2  LEU  71          2HD2      LEU  71  21.909  -8.800  -3.954
  546   3HD2  LEU  71          3HD2      LEU  71  22.201  -9.575  -5.511
  547    H    LYS  72           H        LYS  72  25.924 -12.962  -6.194
  548    HA   LYS  72           HA       LYS  72  24.051 -14.299  -4.457
  549   1HB   LYS  72          2HB       LYS  72  24.042 -14.297  -7.008
  550   2HB   LYS  72          1HB       LYS  72  25.349 -15.466  -6.911
  551   1HG   LYS  72          2HG       LYS  72  23.903 -16.997  -5.690
  552   2HG   LYS  72          1HG       LYS  72  22.594 -15.817  -5.751
  553   1HD   LYS  72          2HD       LYS  72  22.614 -15.933  -8.202
  554   2HD   LYS  72          1HD       LYS  72  23.911 -17.126  -8.132
  555   1HE   LYS  72          2HE       LYS  72  22.429 -18.625  -6.860
  556   2HE   LYS  72          1HE       LYS  72  21.133 -17.440  -7.001
  557   1HZ   LYS  72          1HZ       LYS  72  20.972 -19.227  -8.646
  558   2HZ   LYS  72          2HZ       LYS  72  22.471 -18.772  -9.296
  559   3HZ   LYS  72          3HZ       LYS  72  21.154 -17.709  -9.382
  560    H    LYS  73           H        LYS  73  27.250 -14.020  -4.096
  561    HA   LYS  73           HA       LYS  73  27.815 -16.821  -3.495
  562   1HB   LYS  73          2HB       LYS  73  30.080 -16.003  -2.895
  563   2HB   LYS  73          1HB       LYS  73  29.615 -15.584  -4.540
  564   1HG   LYS  73          2HG       LYS  73  29.393 -13.353  -4.058
  565   2HG   LYS  73          1HG       LYS  73  29.136 -13.638  -2.336
  566   1HD   LYS  73          2HD       LYS  73  31.452 -14.142  -2.011
  567   2HD   LYS  73          1HD       LYS  73  31.751 -14.127  -3.750
  568   1HE   LYS  73          2HE       LYS  73  32.465 -12.062  -2.474
  569   2HE   LYS  73          1HE       LYS  73  31.449 -11.798  -3.888
  570   1HZ   LYS  73          1HZ       LYS  73  29.557 -11.482  -2.477
  571   2HZ   LYS  73          2HZ       LYS  73  30.795 -10.460  -1.946
  572   3HZ   LYS  73          3HZ       LYS  73  30.445 -11.881  -1.088
  573    H    GLU  74           H        GLU  74  29.291 -16.911  -1.346
  574    HA   GLU  74           HA       GLU  74  29.343 -17.004   0.906
  575   1HB   GLU  74          2HB       GLU  74  27.923 -14.344   0.705
  576   2HB   GLU  74          1HB       GLU  74  28.598 -15.010   2.188
  577   1HG   GLU  74          2HG       GLU  74  30.821 -15.007   1.183
  578   2HG   GLU  74          1HG       GLU  74  30.151 -14.353  -0.307
  579    H    ASN  75           H        ASN  75  27.553 -16.486   2.932
  580    HA   ASN  75           HA       ASN  75  25.209 -18.008   2.040
  581   1HB   ASN  75          2HB       ASN  75  25.249 -19.262   4.159
  582   2HB   ASN  75          1HB       ASN  75  26.656 -19.549   3.160
  583   1HD2  ASN  75          1HD2      ASN  75  26.369 -20.037   5.962
  584   2HD2  ASN  75          2HD2      ASN  75  27.542 -19.064   6.779
  585    H    ALA  76           H        ALA  76  23.337 -17.350   2.605
  586    HA   ALA  76           HA       ALA  76  23.067 -14.915   4.108
  587   1HB   ALA  76          1HB       ALA  76  20.771 -14.925   3.359
  588   2HB   ALA  76          2HB       ALA  76  20.957 -16.568   2.739
  589   3HB   ALA  76          3HB       ALA  76  21.857 -15.236   2.007
  590    H    LEU  77           H        LEU  77  22.988 -18.186   4.810
  591    HA   LEU  77           HA       LEU  77  20.807 -18.608   6.433
  592   1HB   LEU  77          2HB       LEU  77  23.590 -19.730   6.706
  593   2HB   LEU  77          1HB       LEU  77  22.170 -20.366   7.505
  594    HG   LEU  77           HG       LEU  77  22.604 -20.278   4.522
  595   1HD1  LEU  77          1HD1      LEU  77  22.613 -22.597   6.451
  596   2HD1  LEU  77          2HD1      LEU  77  24.027 -21.915   5.646
  597   3HD1  LEU  77          3HD1      LEU  77  22.768 -22.707   4.695
  598   1HD2  LEU  77          1HD2      LEU  77  20.357 -21.482   6.136
  599   2HD2  LEU  77          2HD2      LEU  77  20.561 -21.595   4.387
  600   3HD2  LEU  77          3HD2      LEU  77  20.248 -20.031   5.139
  601    H    GLN  78           H        GLN  78  23.939 -17.231   7.337
  602    HA   GLN  78           HA       GLN  78  23.586 -17.198  10.111
  603   1HB   GLN  78          2HB       GLN  78  25.138 -15.252   8.394
  604   2HB   GLN  78          1HB       GLN  78  25.333 -15.469  10.128
  605   1HG   GLN  78          2HG       GLN  78  26.114 -17.731   9.793
  606   2HG   GLN  78          1HG       GLN  78  25.840 -17.593   8.056
  607   1HE2  GLN  78          1HE2      GLN  78  28.280 -18.168   9.530
  608   2HE2  GLN  78          2HE2      GLN  78  29.416 -16.949   9.070
  609    H    ARG  79           H        ARG  79  22.529 -14.973   7.623
  610    HA   ARG  79           HA       ARG  79  21.665 -13.005   9.572
  611   1HB   ARG  79          2HB       ARG  79  21.260 -12.922   6.585
  612   2HB   ARG  79          1HB       ARG  79  21.232 -11.577   7.714
  613   1HG   ARG  79          2HG       ARG  79  23.740 -12.755   8.031
  614   2HG   ARG  79          1HG       ARG  79  23.446 -12.721   6.292
  615   1HD   ARG  79          2HD       ARG  79  24.535 -10.684   6.905
  616   2HD   ARG  79          1HD       ARG  79  22.857 -10.315   6.507
  617    HE   ARG  79           HE       ARG  79  23.222 -10.780   9.306
  618   1HH1  ARG  79          1HH1      ARG  79  23.597  -8.396   6.762
  619   2HH1  ARG  79          2HH1      ARG  79  23.506  -7.040   7.847
  620   1HH2  ARG  79          1HH2      ARG  79  23.076  -8.992  10.727
  621   2HH2  ARG  79          2HH2      ARG  79  23.193  -7.378  10.094
  622    H    ALA  80           H        ALA  80  20.403 -15.533   7.657
  623    HA   ALA  80           HA       ALA  80  17.679 -14.785   7.604
  624   1HB   ALA  80          1HB       ALA  80  18.861 -17.554   7.466
  625   2HB   ALA  80          2HB       ALA  80  18.630 -16.469   6.097
  626   3HB   ALA  80          3HB       ALA  80  17.233 -17.087   6.976
  627    H    ARG  81           H        ARG  81  19.688 -16.029  10.062
  628    HA   ARG  81           HA       ARG  81  17.815 -17.404  11.653
  629   1HB   ARG  81          2HB       ARG  81  20.359 -15.982  12.415
  630   2HB   ARG  81          1HB       ARG  81  19.442 -17.021  13.492
  631   1HG   ARG  81          2HG       ARG  81  19.765 -18.860  11.787
  632   2HG   ARG  81          1HG       ARG  81  20.920 -17.788  10.991
  633   1HD   ARG  81          2HD       ARG  81  21.071 -18.927  13.773
  634   2HD   ARG  81          1HD       ARG  81  22.148 -19.251  12.415
  635    HE   ARG  81           HE       ARG  81  22.228 -16.510  12.936
  636   1HH1  ARG  81          1HH1      ARG  81  23.178 -19.533  14.410
  637   2HH1  ARG  81          2HH1      ARG  81  24.433 -18.821  15.369
  638   1HH2  ARG  81          1HH2      ARG  81  23.878 -15.557  14.219
  639   2HH2  ARG  81          2HH2      ARG  81  24.830 -16.567  15.272
  640    H    THR  82           H        THR  82  18.333 -14.081  11.132
  641    HA   THR  82           HA       THR  82  17.109 -13.079  13.498
  642    HB   THR  82           HB       THR  82  17.211 -11.711  10.802
  643    HG1  THR  82           1HG      THR  82  19.181 -12.119  12.795
  644   1HG2  THR  82          1HG2      THR  82  17.283  -9.658  12.150
  645   2HG2  THR  82          2HG2      THR  82  17.164 -10.619  13.624
  646   3HG2  THR  82          3HG2      THR  82  15.822 -10.586  12.480
  647    H    ARG  83           H        ARG  83  15.928 -14.599  10.705
  648    HA   ARG  83           HA       ARG  83  13.150 -13.914  11.394
  649   1HB   ARG  83          2HB       ARG  83  14.318 -15.000   8.814
  650   2HB   ARG  83          1HB       ARG  83  12.616 -14.694   9.102
  651   1HG   ARG  83          2HG       ARG  83  12.946 -12.354   9.183
  652   2HG   ARG  83          1HG       ARG  83  14.698 -12.539   9.282
  653   1HD   ARG  83          2HD       ARG  83  14.182 -11.861   7.062
  654   2HD   ARG  83          1HD       ARG  83  14.634 -13.562   7.002
  655    HE   ARG  83           HE       ARG  83  11.801 -13.167   7.219
  656   1HH1  ARG  83          1HH1      ARG  83  14.497 -13.297   5.002
  657   2HH1  ARG  83          2HH1      ARG  83  13.522 -13.669   3.616
  658   1HH2  ARG  83          1HH2      ARG  83  10.484 -13.636   5.387
  659   2HH2  ARG  83          2HH2      ARG  83  11.241 -13.859   3.836
  660    H    HIS  84           H        HIS  84  11.817 -16.074  10.413
  661    HA   HIS  84           HA       HIS  84  13.281 -18.483  11.011
  662   1HB   HIS  84          2HB       HIS  84  11.706 -19.381  12.632
  663   2HB   HIS  84          1HB       HIS  84  12.407 -17.887  13.227
  664    HD1  HIS  84           1HD      HIS  84  10.762 -16.456  14.359
  665    HD2  HIS  84           2HD      HIS  84   8.979 -18.793  11.422
  666    HE1  HIS  84           1HE      HIS  84   8.308 -15.941  14.485
  667    HE2  HIS  84           2HE      HIS  84   7.239 -17.536  12.853
  668    HA   PRO  85           HA       PRO  85  10.542 -19.826   7.776
  669   1HB   PRO  85          2HB       PRO  85  11.670 -22.431   7.815
  670   2HB   PRO  85          1HB       PRO  85  12.124 -21.090   6.765
  671   1HG   PRO  85          2HG       PRO  85  13.723 -22.224   8.748
  672   2HG   PRO  85          1HG       PRO  85  13.994 -20.660   7.966
  673   1HD   PRO  85          2HD       PRO  85  12.770 -21.273  10.614
  674   2HD   PRO  85          1HD       PRO  85  13.778 -19.896  10.123
  675    H    ALA  86           H        ALA  86   9.824 -22.526   7.516
  676    HA   ALA  86           HA       ALA  86   8.246 -24.026   8.111
  677   1HB   ALA  86          1HB       ALA  86   9.761 -24.521   9.969
  678   2HB   ALA  86          2HB       ALA  86   8.070 -24.724  10.426
  679   3HB   ALA  86          3HB       ALA  86   8.955 -23.289  10.945
  680    H    GLU  87           H        GLU  87   6.487 -23.046   7.252
  681    HA   GLU  87           HA       GLU  87   5.059 -20.884   8.262
  682   1HB   GLU  87          2HB       GLU  87   3.163 -21.748   6.915
  683   2HB   GLU  87          1HB       GLU  87   4.679 -21.691   6.025
  684   1HG   GLU  87          2HG       GLU  87   4.977 -24.087   6.353
  685   2HG   GLU  87          1HG       GLU  87   3.482 -24.150   7.286
  686    H    SER  88           H        SER  88   5.158 -24.138   9.348
  687    HA   SER  88           HA       SER  88   2.734 -24.578  10.554
  688   1HB   SER  88          2HB       SER  88   5.375 -25.332  11.806
  689   2HB   SER  88          1HB       SER  88   3.851 -26.225  11.850
  690    HG   SER  88           HG       SER  88   4.070 -26.462   9.538
  691    H    CYS  89           H        CYS  89   5.186 -22.324  11.493
  692    HA   CYS  89           HA       CYS  89   4.611 -22.115  14.231
  693   1HB   CYS  89          2HB       CYS  89   5.781 -19.929  14.100
  694   2HB   CYS  89          1HB       CYS  89   6.685 -21.255  13.375
  695    HG   CYS  89           HG       CYS  89   6.535 -20.474  10.842
  696    H    LEU  90           H        LEU  90   2.907 -20.914  11.476
  697    HA   LEU  90           HA       LEU  90   1.708 -18.656  12.674
  698   1HB   LEU  90          2HB       LEU  90   0.072 -18.721  10.872
  699   2HB   LEU  90          1HB       LEU  90   1.702 -18.913  10.270
  700    HG   LEU  90           HG       LEU  90   1.150 -21.454  10.257
  701   1HD1  LEU  90          1HD1      LEU  90  -1.632 -20.298  10.230
  702   2HD1  LEU  90          2HD1      LEU  90  -0.947 -21.326  11.487
  703   3HD1  LEU  90          3HD1      LEU  90  -1.200 -21.969   9.865
  704   1HD2  LEU  90          1HD2      LEU  90   1.548 -20.116   8.268
  705   2HD2  LEU  90          2HD2      LEU  90  -0.122 -19.546   8.299
  706   3HD2  LEU  90          3HD2      LEU  90   0.225 -21.252   8.003
  707    H    GLU  91           H        GLU  91   1.130 -22.007  13.067
  708    HA   GLU  91           HA       GLU  91  -1.491 -22.012  14.054
  709   1HB   GLU  91          2HB       GLU  91  -0.264 -24.076  13.647
  710   2HB   GLU  91          1HB       GLU  91   0.910 -23.657  14.886
  711   1HG   GLU  91          2HG       GLU  91  -0.912 -23.766  16.568
  712   2HG   GLU  91          1HG       GLU  91  -1.992 -24.334  15.295
  713    H    HIS  92           H        HIS  92   1.587 -21.243  15.554
  714    HA   HIS  92           HA       HIS  92   0.155 -20.230  17.917
  715   1HB   HIS  92          2HB       HIS  92   3.084 -20.955  17.640
  716   2HB   HIS  92          1HB       HIS  92   2.324 -20.322  19.094
  717    HD1  HIS  92           1HD      HIS  92   0.814 -21.953  20.457
  718    HD2  HIS  92           2HD      HIS  92   2.682 -23.664  17.151
  719    HE1  HIS  92           1HE      HIS  92   0.565 -24.441  20.740
  720    HE2  HIS  92           2HE      HIS  92   1.636 -25.457  18.697
  721    H    HIS  93           H        HIS  93  -0.272 -18.570  16.093
  722    HA   HIS  93           HA       HIS  93   1.718 -16.795  15.260
  723   1HB   HIS  93          2HB       HIS  93  -0.312 -15.162  15.056
  724   2HB   HIS  93          1HB       HIS  93  -0.217 -16.578  14.020
  725    HD1  HIS  93           1HD      HIS  93  -1.963 -18.432  14.369
  726    HD2  HIS  93           2HD      HIS  93  -2.384 -15.205  16.962
  727    HE1  HIS  93           1HE      HIS  93  -4.211 -18.725  15.463
  728    HE2  HIS  93           2HE      HIS  93  -4.521 -16.670  16.887
  729    H    HIS  94           H        HIS  94   1.986 -14.535  15.868
  730    HA   HIS  94           HA       HIS  94   2.729 -13.000  17.371
  731   1HB   HIS  94          2HB       HIS  94   0.943 -14.528  19.246
  732   2HB   HIS  94          1HB       HIS  94   2.097 -13.359  19.880
  733    HD1  HIS  94           1HD      HIS  94   1.286 -11.034  20.023
  734    HD2  HIS  94           2HD      HIS  94  -0.889 -13.268  17.270
  735    HE1  HIS  94           1HE      HIS  94  -0.560  -9.523  19.229
  736    HE2  HIS  94           2HE      HIS  94  -1.955 -10.944  17.693
  737    H    HIS  95           H        HIS  95   4.052 -13.179  19.707
  738    HA   HIS  95           HA       HIS  95   5.645 -15.609  19.639
  739   1HB   HIS  95          2HB       HIS  95   7.774 -14.396  19.347
  740   2HB   HIS  95          1HB       HIS  95   6.739 -14.274  17.932
  741    HD1  HIS  95           1HD      HIS  95   8.081 -12.207  20.793
  742    HD2  HIS  95           2HD      HIS  95   5.991 -11.701  17.231
  743    HE1  HIS  95           1HE      HIS  95   8.026  -9.730  20.382
  744    HE2  HIS  95           2HE      HIS  95   6.623  -9.437  18.310
  745    H    HIS  96           H        HIS  96   7.170 -15.782  21.366
  746    HA   HIS  96           HA       HIS  96   6.286 -14.947  23.865
  747   1HB   HIS  96          2HB       HIS  96   8.623 -15.586  24.649
  748   2HB   HIS  96          1HB       HIS  96   7.725 -16.830  23.792
  749    HD1  HIS  96           1HD      HIS  96   9.062 -18.044  22.101
  750    HD2  HIS  96           2HD      HIS  96  10.504 -14.188  22.721
  751    HE1  HIS  96           1HE      HIS  96  11.114 -17.844  20.662
  752    HE2  HIS  96           2HE      HIS  96  11.823 -15.434  20.877
  753    H    HIS  97           H        HIS  97   6.666 -13.257  25.161
  754    HA   HIS  97           HA       HIS  97   7.116 -11.124  25.781
  755   1HB   HIS  97          2HB       HIS  97   9.679 -11.576  24.243
  756   2HB   HIS  97          1HB       HIS  97   9.372 -10.217  25.317
  757    HD1  HIS  97           1HD      HIS  97  11.338 -12.980  25.368
  758    HD2  HIS  97           2HD      HIS  97   8.396 -11.655  27.993
  759    HE1  HIS  97           1HE      HIS  97  11.842 -14.091  27.571
  760    HE2  HIS  97           2HE      HIS  97  10.207 -13.069  29.188
  Start of MODEL   17
    1   1H    MET   1          1HT       MET   1   6.334  12.403 -10.507
    2   2H    MET   1          2HT       MET   1   5.483  11.549 -11.696
    3   3H    MET   1          3HT       MET   1   5.419  11.042 -10.084
    4    HA   MET   1           HA       MET   1   4.337  13.576 -11.157
    5   1HB   MET   1          2HB       MET   1   3.035  11.548 -11.764
    6   2HB   MET   1          1HB       MET   1   2.916  11.133 -10.061
    7   1HG   MET   1          2HG       MET   1   1.631  13.141  -9.632
    8   2HG   MET   1          1HG       MET   1   1.797  13.629 -11.317
    9   1HE   MET   1          1HE       MET   1   0.619  12.410 -13.344
   10   2HE   MET   1          2HE       MET   1  -0.319  10.925 -13.184
   11   3HE   MET   1          3HE       MET   1   1.419  10.903 -12.887
   12    HA   PRO   2           HA       PRO   2   5.030  15.045  -7.050
   13   1HB   PRO   2          2HB       PRO   2   3.302  17.161  -7.113
   14   2HB   PRO   2          1HB       PRO   2   4.909  17.176  -7.846
   15   1HG   PRO   2          2HG       PRO   2   2.246  16.708  -9.124
   16   2HG   PRO   2          1HG       PRO   2   3.619  17.665  -9.710
   17   1HD   PRO   2          2HD       PRO   2   3.109  15.192 -10.648
   18   2HD   PRO   2          1HD       PRO   2   4.767  15.797 -10.453
   19    H    THR   3           H        THR   3   1.798  14.447  -8.216
   20    HA   THR   3           HA       THR   3   0.890  14.027  -5.463
   21    HB   THR   3           HB       THR   3  -0.516  15.557  -6.802
   22    HG1  THR   3           1HG      THR   3  -1.772  14.588  -5.327
   23   1HG2  THR   3          1HG2      THR   3  -1.859  14.693  -8.663
   24   2HG2  THR   3          2HG2      THR   3  -1.015  13.147  -8.554
   25   3HG2  THR   3          3HG2      THR   3  -0.133  14.603  -9.017
   26    H    LYS   4           H        LYS   4  -0.856  12.175  -5.461
   27    HA   LYS   4           HA       LYS   4  -1.027   9.944  -5.204
   28   1HB   LYS   4          2HB       LYS   4  -1.638  10.266  -7.630
   29   2HB   LYS   4          1HB       LYS   4   0.008   9.819  -8.042
   30   1HG   LYS   4          2HG       LYS   4  -1.617   7.964  -6.370
   31   2HG   LYS   4          1HG       LYS   4  -1.919   8.058  -8.105
   32   1HD   LYS   4          2HD       LYS   4   0.452   7.603  -8.516
   33   2HD   LYS   4          1HD       LYS   4   0.718   7.458  -6.783
   34   1HE   LYS   4          2HE       LYS   4  -0.827   5.567  -6.696
   35   2HE   LYS   4          1HE       LYS   4  -1.106   5.714  -8.433
   36   1HZ   LYS   4          1HZ       LYS   4   0.595   4.012  -7.636
   37   2HZ   LYS   4          2HZ       LYS   4   1.618   5.338  -7.359
   38   3HZ   LYS   4          3HZ       LYS   4   1.040   5.021  -8.921
   39    H    THR   5           H        THR   5   0.634  10.025  -3.633
   40    HA   THR   5           HA       THR   5   3.361   9.506  -4.408
   41    HB   THR   5           HB       THR   5   3.615   9.569  -1.841
   42    HG1  THR   5           1HG      THR   5   1.555   9.363  -1.118
   43   1HG2  THR   5          1HG2      THR   5   4.287  11.414  -3.285
   44   2HG2  THR   5          2HG2      THR   5   3.522  12.025  -1.817
   45   3HG2  THR   5          3HG2      THR   5   2.621  11.990  -3.332
   46    H    TYR   6           H        TYR   6   4.558   7.893  -2.912
   47    HA   TYR   6           HA       TYR   6   2.949   5.502  -2.398
   48   1HB   TYR   6          2HB       TYR   6   4.749   4.110  -3.372
   49   2HB   TYR   6          1HB       TYR   6   3.956   5.116  -4.571
   50    HD1  TYR   6           1HD      TYR   6   7.066   4.375  -2.834
   51    HD2  TYR   6           2HD      TYR   6   5.153   7.065  -5.521
   52    HE1  TYR   6           1HE      TYR   6   9.260   5.254  -3.509
   53    HE2  TYR   6           2HE      TYR   6   7.342   7.943  -6.209
   54    HH   TYR   6           HH       TYR   6   9.715   8.085  -5.024
   55    H    SER   7           H        SER   7   4.550   3.818  -1.285
   56    HA   SER   7           HA       SER   7   6.474   5.134   0.454
   57   1HB   SER   7          2HB       SER   7   4.140   3.534   1.543
   58   2HB   SER   7          1HB       SER   7   5.464   4.205   2.494
   59    HG   SER   7           HG       SER   7   4.434   6.166   1.031
   60    H    GLU   8           H        GLU   8   7.940   3.651   1.450
   61    HA   GLU   8           HA       GLU   8   8.559   1.422  -0.181
   62   1HB   GLU   8          2HB       GLU   8   9.651   2.099   2.555
   63   2HB   GLU   8          1HB       GLU   8  10.384   1.012   1.383
   64   1HG   GLU   8          2HG       GLU   8  10.019   3.985   1.122
   65   2HG   GLU   8          1HG       GLU   8  11.534   3.112   1.344
   66    H    GLU   9           H        GLU   9   6.921   1.757   2.919
   67    HA   GLU   9           HA       GLU   9   6.873  -0.935   3.656
   68   1HB   GLU   9          2HB       GLU   9   5.004   1.352   4.259
   69   2HB   GLU   9          1HB       GLU   9   4.890  -0.220   5.016
   70   1HG   GLU   9          2HG       GLU   9   7.160   1.725   5.212
   71   2HG   GLU   9          1HG       GLU   9   6.051   1.234   6.496
   72    H    PHE  10           H        PHE  10   4.906   0.938   1.465
   73    HA   PHE  10           HA       PHE  10   2.785  -0.895   1.123
   74   1HB   PHE  10          2HB       PHE  10   2.747   1.489   0.391
   75   2HB   PHE  10          1HB       PHE  10   3.902   1.093  -0.872
   76    HD1  PHE  10           1HD      PHE  10   0.460   0.538   0.316
   77    HD2  PHE  10           2HD      PHE  10   3.206   0.123  -2.907
   78    HE1  PHE  10           1HE      PHE  10  -1.404   0.003  -1.200
   79    HE2  PHE  10           2HE      PHE  10   1.351  -0.419  -4.425
   80    HZ   PHE  10           HZ       PHE  10  -0.959  -0.476  -3.574
   81    H    LYS  11           H        LYS  11   5.885  -0.440  -0.484
   82    HA   LYS  11           HA       LYS  11   5.629  -2.496  -2.413
   83   1HB   LYS  11          2HB       LYS  11   8.154  -1.452  -1.113
   84   2HB   LYS  11          1HB       LYS  11   8.040  -2.287  -2.654
   85   1HG   LYS  11          2HG       LYS  11   6.937  -0.436  -3.668
   86   2HG   LYS  11          1HG       LYS  11   6.741   0.372  -2.109
   87   1HD   LYS  11          2HD       LYS  11   9.133   0.634  -1.904
   88   2HD   LYS  11          1HD       LYS  11   9.391  -0.278  -3.390
   89   1HE   LYS  11          2HE       LYS  11   8.324   1.448  -4.687
   90   2HE   LYS  11          1HE       LYS  11   7.887   2.330  -3.223
   91   1HZ   LYS  11          1HZ       LYS  11  10.125   2.845  -2.789
   92   2HZ   LYS  11          2HZ       LYS  11   9.918   3.139  -4.450
   93   3HZ   LYS  11          3HZ       LYS  11  10.700   1.732  -3.933
   94    H    ARG  12           H        ARG  12   6.946  -2.350   0.850
   95    HA   ARG  12           HA       ARG  12   8.040  -4.915   0.999
   96   1HB   ARG  12          2HB       ARG  12   8.669  -3.228   2.570
   97   2HB   ARG  12          1HB       ARG  12   7.007  -2.980   3.076
   98   1HG   ARG  12          2HG       ARG  12   8.229  -5.658   3.491
   99   2HG   ARG  12          1HG       ARG  12   8.715  -4.328   4.545
  100   1HD   ARG  12          2HD       ARG  12   5.858  -5.142   4.043
  101   2HD   ARG  12          1HD       ARG  12   6.818  -5.694   5.406
  102    HE   ARG  12           HE       ARG  12   7.001  -3.010   5.616
  103   1HH1  ARG  12          1HH1      ARG  12   4.246  -5.134   5.178
  104   2HH1  ARG  12          2HH1      ARG  12   3.171  -4.136   6.101
  105   1HH2  ARG  12          1HH2      ARG  12   5.607  -1.722   6.860
  106   2HH2  ARG  12          2HH2      ARG  12   3.950  -2.221   7.098
  107    H    ASP  13           H        ASP  13   4.802  -3.711   1.759
  108    HA   ASP  13           HA       ASP  13   3.904  -6.198   2.842
  109   1HB   ASP  13          2HB       ASP  13   2.945  -3.866   3.303
  110   2HB   ASP  13          1HB       ASP  13   2.123  -4.024   1.755
  111    H    ALA  14           H        ALA  14   3.836  -4.678  -0.321
  112    HA   ALA  14           HA       ALA  14   2.036  -6.368  -1.631
  113   1HB   ALA  14          1HB       ALA  14   3.101  -5.623  -3.698
  114   2HB   ALA  14          2HB       ALA  14   4.465  -4.988  -2.777
  115   3HB   ALA  14          3HB       ALA  14   2.865  -4.272  -2.589
  116    H    VAL  15           H        VAL  15   5.556  -6.667  -1.220
  117    HA   VAL  15           HA       VAL  15   5.842  -9.031  -2.734
  118    HB   VAL  15           HB       VAL  15   7.582  -8.110  -0.435
  119   1HG1  VAL  15          1HG1      VAL  15   7.991 -10.422  -1.093
  120   2HG1  VAL  15          2HG1      VAL  15   9.343  -9.385  -1.553
  121   3HG1  VAL  15          3HG1      VAL  15   8.183  -9.918  -2.773
  122   1HG2  VAL  15          1HG2      VAL  15   8.959  -7.025  -2.145
  123   2HG2  VAL  15          2HG2      VAL  15   7.332  -6.343  -2.087
  124   3HG2  VAL  15          3HG2      VAL  15   7.770  -7.467  -3.372
  125    H    ALA  16           H        ALA  16   5.237  -8.464   0.705
  126    HA   ALA  16           HA       ALA  16   5.396 -11.178   1.513
  127   1HB   ALA  16          1HB       ALA  16   5.572  -9.301   3.091
  128   2HB   ALA  16          2HB       ALA  16   4.312 -10.444   3.559
  129   3HB   ALA  16          3HB       ALA  16   3.875  -8.914   2.799
  130    H    LEU  17           H        LEU  17   2.791  -9.150   0.324
  131    HA   LEU  17           HA       LEU  17   0.651 -10.917   0.820
  132   1HB   LEU  17          2HB       LEU  17   0.524  -8.471   0.214
  133   2HB   LEU  17          1HB       LEU  17   0.868  -8.930  -1.440
  134    HG   LEU  17           HG       LEU  17  -1.203 -10.312  -1.441
  135   1HD1  LEU  17          1HD1      LEU  17  -1.700  -8.969   1.213
  136   2HD1  LEU  17          2HD1      LEU  17  -1.351 -10.681   0.979
  137   3HD1  LEU  17          3HD1      LEU  17  -2.839  -9.989   0.330
  138   1HD2  LEU  17          1HD2      LEU  17  -2.742  -8.392  -1.553
  139   2HD2  LEU  17          2HD2      LEU  17  -1.218  -8.087  -2.385
  140   3HD2  LEU  17          3HD2      LEU  17  -1.508  -7.385  -0.793
  141    H    TYR  18           H        TYR  18   2.948 -10.619  -1.806
  142    HA   TYR  18           HA       TYR  18   1.676 -12.343  -3.653
  143   1HB   TYR  18          2HB       TYR  18   3.415 -10.799  -4.352
  144   2HB   TYR  18          1HB       TYR  18   4.595 -11.617  -3.337
  145    HD1  TYR  18           1HD      TYR  18   6.026 -13.092  -4.355
  146    HD2  TYR  18           2HD      TYR  18   2.204 -12.423  -6.096
  147    HE1  TYR  18           1HE      TYR  18   6.626 -14.571  -6.221
  148    HE2  TYR  18           2HE      TYR  18   2.794 -13.899  -7.971
  149    HH   TYR  18           HH       TYR  18   5.606 -15.895  -7.891
  150    H    GLU  19           H        GLU  19   3.666 -12.936  -0.870
  151    HA   GLU  19           HA       GLU  19   4.266 -15.658  -1.423
  152   1HB   GLU  19          2HB       GLU  19   4.301 -13.970   1.048
  153   2HB   GLU  19          1HB       GLU  19   4.487 -15.715   1.182
  154   1HG   GLU  19          2HG       GLU  19   6.212 -13.926  -0.516
  155   2HG   GLU  19          1HG       GLU  19   6.636 -14.512   1.093
  156    H    ASN  20           H        ASN  20   1.417 -14.078  -0.531
  157    HA   ASN  20           HA       ASN  20   0.157 -16.527   0.480
  158   1HB   ASN  20          2HB       ASN  20  -0.694 -13.625   0.462
  159   2HB   ASN  20          1HB       ASN  20  -1.772 -14.929   0.940
  160   1HD2  ASN  20          1HD2      ASN  20   1.095 -13.120   1.785
  161   2HD2  ASN  20          2HD2      ASN  20   1.167 -13.637   3.437
  162    H    SER  21           H        SER  21   0.939 -16.234  -2.292
  163    HA   SER  21           HA       SER  21  -1.224 -15.326  -3.893
  164   1HB   SER  21          2HB       SER  21   0.128 -16.541  -5.716
  165   2HB   SER  21          1HB       SER  21   0.870 -15.165  -4.903
  166    HG   SER  21           HG       SER  21   2.382 -16.444  -4.231
  167    H    ASP  22           H        ASP  22  -0.434 -18.414  -2.513
  168    HA   ASP  22           HA       ASP  22  -1.961 -20.024  -4.260
  169   1HB   ASP  22          2HB       ASP  22  -1.028 -20.402  -1.431
  170   2HB   ASP  22          1HB       ASP  22  -2.126 -21.564  -2.169
  171    H    GLY  23           H        GLY  23  -2.889 -17.721  -1.953
  172   1HA   GLY  23          2HA       GLY  23  -5.675 -18.679  -2.129
  173   2HA   GLY  23          1HA       GLY  23  -5.050 -17.700  -0.807
  174    H    ALA  24           H        ALA  24  -3.669 -16.595  -3.633
  175    HA   ALA  24           HA       ALA  24  -5.831 -14.938  -4.552
  176   1HB   ALA  24          1HB       ALA  24  -5.280 -13.728  -2.518
  177   2HB   ALA  24          2HB       ALA  24  -4.809 -12.789  -3.934
  178   3HB   ALA  24          3HB       ALA  24  -3.586 -13.651  -3.001
  179    H    SER  25           H        SER  25  -5.492 -14.783  -6.661
  180    HA   SER  25           HA       SER  25  -3.157 -15.720  -7.894
  181   1HB   SER  25          2HB       SER  25  -5.542 -15.626  -8.822
  182   2HB   SER  25          1HB       SER  25  -5.190 -13.948  -9.238
  183    HG   SER  25           HG       SER  25  -4.106 -16.331 -10.272
  184    H    LEU  26           H        LEU  26  -1.670 -14.608  -9.273
  185    HA   LEU  26           HA       LEU  26  -0.348 -12.506  -8.052
  186   1HB   LEU  26          2HB       LEU  26   0.512 -14.152  -9.791
  187   2HB   LEU  26          1HB       LEU  26  -0.218 -13.123 -11.003
  188    HG   LEU  26           HG       LEU  26   1.851 -12.063  -9.083
  189   1HD1  LEU  26          1HD1      LEU  26   3.516 -12.485 -10.842
  190   2HD1  LEU  26          2HD1      LEU  26   2.301 -13.375 -11.761
  191   3HD1  LEU  26          3HD1      LEU  26   2.838 -13.981 -10.194
  192   1HD2  LEU  26          1HD2      LEU  26   0.520 -10.423 -10.339
  193   2HD2  LEU  26          2HD2      LEU  26   0.992 -11.203 -11.847
  194   3HD2  LEU  26          3HD2      LEU  26   2.210 -10.415 -10.847
  195    H    GLN  27           H        GLN  27  -2.579 -12.416 -10.811
  196    HA   GLN  27           HA       GLN  27  -2.453  -9.682 -11.352
  197   1HB   GLN  27          2HB       GLN  27  -3.637 -11.415 -12.736
  198   2HB   GLN  27          1HB       GLN  27  -4.932 -11.401 -11.547
  199   1HG   GLN  27          2HG       GLN  27  -5.853  -9.867 -12.893
  200   2HG   GLN  27          1HG       GLN  27  -4.731  -8.760 -12.107
  201   1HE2  GLN  27          1HE2      GLN  27  -2.433 -10.114 -13.483
  202   2HE2  GLN  27          2HE2      GLN  27  -2.471  -9.496 -15.096
  203    H    GLN  28           H        GLN  28  -4.452 -11.461  -9.046
  204    HA   GLN  28           HA       GLN  28  -6.105  -9.313  -8.289
  205   1HB   GLN  28          2HB       GLN  28  -5.475 -11.993  -7.141
  206   2HB   GLN  28          1HB       GLN  28  -6.328 -10.833  -6.137
  207   1HG   GLN  28          2HG       GLN  28  -7.217 -11.773  -8.853
  208   2HG   GLN  28          1HG       GLN  28  -7.848 -12.350  -7.309
  209   1HE2  GLN  28          1HE2      GLN  28  -9.158 -10.986  -6.067
  210   2HE2  GLN  28          2HE2      GLN  28  -9.898  -9.573  -6.739
  211    H    ILE  29           H        ILE  29  -2.976 -10.401  -7.104
  212    HA   ILE  29           HA       ILE  29  -2.889  -8.937  -4.722
  213    HB   ILE  29           HB       ILE  29  -0.576  -9.547  -6.584
  214   1HG1  ILE  29          2HG1      ILE  29  -1.802 -11.577  -5.958
  215   2HG1  ILE  29          1HG1      ILE  29  -0.222 -11.543  -5.190
  216   1HG2  ILE  29          1HG2      ILE  29  -0.593  -8.889  -3.641
  217   2HG2  ILE  29          2HG2      ILE  29  -0.005  -7.853  -4.942
  218   3HG2  ILE  29          3HG2      ILE  29   0.825  -9.366  -4.580
  219   1HD1  ILE  29          1HD1      ILE  29  -1.246 -10.816  -3.103
  220   2HD1  ILE  29          2HD1      ILE  29  -1.926 -12.345  -3.664
  221   3HD1  ILE  29          3HD1      ILE  29  -2.831 -10.847  -3.872
  222    H    ALA  30           H        ALA  30  -1.639  -8.050  -7.941
  223    HA   ALA  30           HA       ALA  30  -1.022  -5.373  -7.199
  224   1HB   ALA  30          1HB       ALA  30   0.151  -6.503  -9.010
  225   2HB   ALA  30          2HB       ALA  30  -0.612  -5.020  -9.589
  226   3HB   ALA  30          3HB       ALA  30  -1.342  -6.587  -9.944
  227    H    ASN  31           H        ASN  31  -3.816  -6.960  -8.546
  228    HA   ASN  31           HA       ASN  31  -5.148  -4.665  -9.541
  229   1HB   ASN  31          2HB       ASN  31  -5.670  -6.992 -10.230
  230   2HB   ASN  31          1HB       ASN  31  -6.332  -7.297  -8.629
  231   1HD2  ASN  31          1HD2      ASN  31  -8.326  -7.818  -9.484
  232   2HD2  ASN  31          2HD2      ASN  31  -9.400  -6.615 -10.111
  233    H    ASP  32           H        ASP  32  -5.294  -6.389  -6.464
  234    HA   ASP  32           HA       ASP  32  -7.398  -4.898  -5.323
  235   1HB   ASP  32          2HB       ASP  32  -6.678  -7.059  -4.413
  236   2HB   ASP  32          1HB       ASP  32  -5.122  -6.364  -3.972
  237    H    LEU  33           H        LEU  33  -3.878  -4.550  -5.146
  238    HA   LEU  33           HA       LEU  33  -3.944  -2.363  -3.350
  239   1HB   LEU  33          2HB       LEU  33  -1.779  -3.337  -5.206
  240   2HB   LEU  33          1HB       LEU  33  -1.554  -2.111  -3.980
  241    HG   LEU  33           HG       LEU  33  -2.301  -4.987  -3.464
  242   1HD1  LEU  33          1HD1      LEU  33   0.000  -4.755  -4.192
  243   2HD1  LEU  33          2HD1      LEU  33  -0.064  -5.130  -2.470
  244   3HD1  LEU  33          3HD1      LEU  33   0.268  -3.480  -3.002
  245   1HD2  LEU  33          1HD2      LEU  33  -1.712  -2.731  -1.546
  246   2HD2  LEU  33          2HD2      LEU  33  -1.966  -4.419  -1.102
  247   3HD2  LEU  33          3HD2      LEU  33  -3.284  -3.487  -1.811
  248    H    GLY  34           H        GLY  34  -3.781  -2.637  -6.849
  249   1HA   GLY  34          2HA       GLY  34  -4.677  -0.955  -8.292
  250   2HA   GLY  34          1HA       GLY  34  -4.382   0.232  -7.029
  251    H    ILE  35           H        ILE  35  -2.114  -2.197  -8.179
  252    HA   ILE  35           HA       ILE  35  -0.465  -0.039  -9.315
  253    HB   ILE  35           HB       ILE  35   1.533  -1.365  -8.612
  254   1HG1  ILE  35          2HG1      ILE  35  -0.470  -2.850  -6.893
  255   2HG1  ILE  35          1HG1      ILE  35   0.369  -3.532  -8.281
  256   1HG2  ILE  35          1HG2      ILE  35   0.896   0.600  -7.378
  257   2HG2  ILE  35          2HG2      ILE  35   1.445  -0.638  -6.249
  258   3HG2  ILE  35          3HG2      ILE  35  -0.278  -0.327  -6.443
  259   1HD1  ILE  35          1HD1      ILE  35   1.382  -4.235  -6.201
  260   2HD1  ILE  35          2HD1      ILE  35   1.652  -2.554  -5.746
  261   3HD1  ILE  35          3HD1      ILE  35   2.497  -3.240  -7.133
  262    H    ASN  36           H        ASN  36   0.983  -0.709 -11.028
  263    HA   ASN  36           HA       ASN  36  -0.198  -2.410 -12.914
  264   1HB   ASN  36          2HB       ASN  36   1.391  -0.528 -13.413
  265   2HB   ASN  36          1HB       ASN  36   2.696  -1.559 -12.829
  266   1HD2  ASN  36          1HD2      ASN  36   0.383  -1.016 -15.341
  267   2HD2  ASN  36          2HD2      ASN  36   1.071  -2.107 -16.480
  268    H    ARG  37           H        ARG  37   0.372  -4.464 -13.629
  269    HA   ARG  37           HA       ARG  37   0.951  -6.294 -11.584
  270   1HB   ARG  37          2HB       ARG  37   1.259  -7.025 -14.468
  271   2HB   ARG  37          1HB       ARG  37   0.549  -7.937 -13.161
  272   1HG   ARG  37          2HG       ARG  37  -0.671  -5.581 -14.568
  273   2HG   ARG  37          1HG       ARG  37  -1.160  -7.267 -14.712
  274   1HD   ARG  37          2HD       ARG  37  -1.848  -7.283 -12.373
  275   2HD   ARG  37          1HD       ARG  37  -1.307  -5.613 -12.189
  276    HE   ARG  37           HE       ARG  37  -3.363  -6.223 -14.196
  277   1HH1  ARG  37          1HH1      ARG  37  -2.489  -4.666 -11.168
  278   2HH1  ARG  37          2HH1      ARG  37  -3.971  -3.767 -11.071
  279   1HH2  ARG  37          1HH2      ARG  37  -5.288  -5.011 -14.059
  280   2HH2  ARG  37          2HH2      ARG  37  -5.551  -3.963 -12.693
  281    H    VAL  38           H        VAL  38   2.895  -4.817 -14.090
  282    HA   VAL  38           HA       VAL  38   5.187  -6.496 -13.685
  283    HB   VAL  38           HB       VAL  38   5.025  -3.802 -15.058
  284   1HG1  VAL  38          1HG1      VAL  38   7.303  -4.440 -14.397
  285   2HG1  VAL  38          2HG1      VAL  38   7.103  -4.444 -16.149
  286   3HG1  VAL  38          3HG1      VAL  38   7.117  -5.967 -15.260
  287   1HG2  VAL  38          1HG2      VAL  38   4.909  -5.099 -17.142
  288   2HG2  VAL  38          2HG2      VAL  38   3.530  -5.424 -16.092
  289   3HG2  VAL  38          3HG2      VAL  38   4.848  -6.590 -16.201
  290    H    THR  39           H        THR  39   4.126  -3.314 -12.561
  291    HA   THR  39           HA       THR  39   6.478  -2.536 -11.251
  292    HB   THR  39           HB       THR  39   3.657  -1.900 -10.365
  293    HG1  THR  39           1HG      THR  39   5.297  -0.622 -12.324
  294   1HG2  THR  39          1HG2      THR  39   4.650   0.189  -9.567
  295   2HG2  THR  39          2HG2      THR  39   6.238  -0.350 -10.110
  296   3HG2  THR  39          3HG2      THR  39   5.420  -1.202  -8.801
  297    H    LEU  40           H        LEU  40   3.754  -4.519 -10.186
  298    HA   LEU  40           HA       LEU  40   4.525  -4.943  -7.527
  299   1HB   LEU  40          2HB       LEU  40   2.349  -5.616  -8.363
  300   2HB   LEU  40          1HB       LEU  40   3.091  -6.764  -9.459
  301    HG   LEU  40           HG       LEU  40   3.931  -8.029  -7.468
  302   1HD1  LEU  40          1HD1      LEU  40   3.874  -6.229  -5.834
  303   2HD1  LEU  40          2HD1      LEU  40   2.887  -7.589  -5.299
  304   3HD1  LEU  40          3HD1      LEU  40   2.119  -6.147  -5.962
  305   1HD2  LEU  40          1HD2      LEU  40   0.946  -7.668  -7.685
  306   2HD2  LEU  40          2HD2      LEU  40   1.768  -9.041  -6.941
  307   3HD2  LEU  40          3HD2      LEU  40   1.942  -8.738  -8.671
  308    H    LYS  41           H        LYS  41   5.139  -6.956 -10.382
  309    HA   LYS  41           HA       LYS  41   6.791  -8.883  -9.265
  310   1HB   LYS  41          2HB       LYS  41   5.820  -8.850 -11.574
  311   2HB   LYS  41          1HB       LYS  41   7.041  -7.674 -12.024
  312   1HG   LYS  41          2HG       LYS  41   8.782  -9.351 -11.410
  313   2HG   LYS  41          1HG       LYS  41   7.481 -10.528 -11.196
  314   1HD   LYS  41          2HD       LYS  41   6.769 -10.095 -13.531
  315   2HD   LYS  41          1HD       LYS  41   8.163  -9.033 -13.726
  316   1HE   LYS  41          2HE       LYS  41   9.658 -10.920 -13.264
  317   2HE   LYS  41          1HE       LYS  41   8.258 -11.977 -13.075
  318   1HZ   LYS  41          1HZ       LYS  41   7.675 -11.186 -15.432
  319   2HZ   LYS  41          2HZ       LYS  41   8.901 -12.338 -15.250
  320   3HZ   LYS  41          3HZ       LYS  41   9.302 -10.714 -15.530
  321    H    ASN  42           H        ASN  42   7.582  -5.762 -10.646
  322    HA   ASN  42           HA       ASN  42  10.349  -5.770 -10.595
  323   1HB   ASN  42          2HB       ASN  42   8.637  -4.001 -11.410
  324   2HB   ASN  42          1HB       ASN  42   8.732  -3.370  -9.781
  325   1HD2  ASN  42          1HD2      ASN  42   9.557  -1.435 -10.617
  326   2HD2  ASN  42          2HD2      ASN  42  11.207  -1.297 -11.123
  327    H    TRP  43           H        TRP  43   8.170  -4.491  -8.123
  328    HA   TRP  43           HA       TRP  43  10.108  -3.967  -6.171
  329   1HB   TRP  43          2HB       TRP  43   7.173  -4.615  -5.866
  330   2HB   TRP  43          1HB       TRP  43   8.196  -4.086  -4.536
  331    HD1  TRP  43           HD       TRP  43   9.684  -1.931  -6.749
  332    HE1  TRP  43           1HE      TRP  43   8.462   0.318  -7.064
  333    HE3  TRP  43           3HE      TRP  43   5.097  -3.257  -4.931
  334    HZ2  TRP  43           2HZ      TRP  43   5.897   1.378  -6.591
  335    HZ3  TRP  43           3HZ      TRP  43   3.314  -1.564  -4.883
  336    HH2  TRP  43           HH       TRP  43   3.706   0.709  -5.699
  337    H    ILE  44           H        ILE  44   8.243  -6.909  -6.795
  338    HA   ILE  44           HA       ILE  44   8.984  -8.351  -4.512
  339    HB   ILE  44           HB       ILE  44   8.388  -9.407  -7.280
  340   1HG1  ILE  44          2HG1      ILE  44   6.589  -9.181  -4.859
  341   2HG1  ILE  44          1HG1      ILE  44   6.587  -8.054  -6.212
  342   1HG2  ILE  44          1HG2      ILE  44   9.556 -11.098  -6.011
  343   2HG2  ILE  44          2HG2      ILE  44   7.851 -11.531  -6.144
  344   3HG2  ILE  44          3HG2      ILE  44   8.475 -10.858  -4.638
  345   1HD1  ILE  44          1HD1      ILE  44   5.913  -9.860  -7.711
  346   2HD1  ILE  44          2HD1      ILE  44   4.771  -9.655  -6.385
  347   3HD1  ILE  44          3HD1      ILE  44   5.923 -10.990  -6.355
  348    H    ILE  45           H        ILE  45  10.561  -8.172  -7.694
  349    HA   ILE  45           HA       ILE  45  12.632 -10.007  -7.047
  350    HB   ILE  45           HB       ILE  45  12.561  -7.876  -9.184
  351   1HG1  ILE  45          2HG1      ILE  45  11.940 -10.838  -9.346
  352   2HG1  ILE  45          1HG1      ILE  45  10.736  -9.553  -9.335
  353   1HG2  ILE  45          1HG2      ILE  45  14.379 -10.263  -8.859
  354   2HG2  ILE  45          2HG2      ILE  45  14.835  -8.563  -8.740
  355   3HG2  ILE  45          3HG2      ILE  45  14.303  -9.225 -10.285
  356   1HD1  ILE  45          1HD1      ILE  45  11.124 -10.381 -11.581
  357   2HD1  ILE  45          2HD1      ILE  45  12.839  -9.984 -11.448
  358   3HD1  ILE  45          3HD1      ILE  45  11.631  -8.697 -11.437
  359    H    LYS  46           H        LYS  46  12.454  -6.466  -7.063
  360    HA   LYS  46           HA       LYS  46  15.207  -6.111  -6.405
  361   1HB   LYS  46          2HB       LYS  46  14.035  -4.365  -7.592
  362   2HB   LYS  46          1HB       LYS  46  12.855  -4.215  -6.297
  363   1HG   LYS  46          2HG       LYS  46  14.562  -3.362  -4.803
  364   2HG   LYS  46          1HG       LYS  46  15.788  -3.567  -6.057
  365   1HD   LYS  46          2HD       LYS  46  14.704  -1.926  -7.450
  366   2HD   LYS  46          1HD       LYS  46  13.355  -1.805  -6.317
  367   1HE   LYS  46          2HE       LYS  46  14.946   0.067  -6.118
  368   2HE   LYS  46          1HE       LYS  46  14.794  -0.866  -4.631
  369   1HZ   LYS  46          1HZ       LYS  46  16.886  -1.788  -4.899
  370   2HZ   LYS  46          2HZ       LYS  46  17.116  -0.193  -5.437
  371   3HZ   LYS  46          3HZ       LYS  46  16.947  -1.453  -6.561
  372    H    TYR  47           H        TYR  47  12.215  -5.767  -4.478
  373    HA   TYR  47           HA       TYR  47  13.784  -5.107  -2.150
  374   1HB   TYR  47          2HB       TYR  47  10.813  -5.415  -2.576
  375   2HB   TYR  47          1HB       TYR  47  11.532  -5.030  -1.012
  376    HD1  TYR  47           1HD      TYR  47  11.017  -3.814  -4.452
  377    HD2  TYR  47           2HD      TYR  47  12.393  -2.850  -0.543
  378    HE1  TYR  47           1HE      TYR  47  11.133  -1.442  -5.084
  379    HE2  TYR  47           2HE      TYR  47  12.508  -0.475  -1.166
  380    HH   TYR  47           HH       TYR  47  12.664   0.919  -3.084
  381    H    GLY  48           H        GLY  48  12.234  -7.944  -3.444
  382   1HA   GLY  48          2HA       GLY  48  12.436  -9.541  -1.091
  383   2HA   GLY  48          1HA       GLY  48  12.293 -10.140  -2.739
  384    H    SER  49           H        SER  49  14.776  -8.265  -3.166
  385    HA   SER  49           HA       SER  49  16.741 -10.331  -2.814
  386   1HB   SER  49          2HB       SER  49  16.752  -8.822  -4.790
  387   2HB   SER  49          1HB       SER  49  17.105  -7.460  -3.728
  388    HG   SER  49           HG       SER  49  18.756  -9.758  -3.774
  389    H    ASN  50           H        ASN  50  15.650  -7.601  -1.017
  390    HA   ASN  50           HA       ASN  50  18.015  -7.036   0.410
  391   1HB   ASN  50          2HB       ASN  50  15.133  -6.619   1.143
  392   2HB   ASN  50          1HB       ASN  50  16.458  -6.091   2.161
  393   1HD2  ASN  50          1HD2      ASN  50  14.649  -5.494  -0.703
  394   2HD2  ASN  50          2HD2      ASN  50  15.384  -3.975  -1.100
  395    H    HIS  51           H        HIS  51  19.021  -8.119   1.815
  396    HA   HIS  51           HA       HIS  51  18.180 -10.640   2.805
  397   1HB   HIS  51          2HB       HIS  51  20.534 -10.183   2.400
  398   2HB   HIS  51          1HB       HIS  51  20.515  -8.867   3.567
  399    HD1  HIS  51           1HD      HIS  51  20.643 -12.609   3.327
  400    HD2  HIS  51           2HD      HIS  51  20.679  -9.643   6.252
  401    HE1  HIS  51           1HE      HIS  51  21.324 -13.755   5.456
  402    HE2  HIS  51           2HE      HIS  51  21.285 -11.964   7.225
  403    H    ASN  52           H        ASN  52  18.265  -7.391   4.145
  404    HA   ASN  52           HA       ASN  52  16.311  -7.929   6.093
  405   1HB   ASN  52          2HB       ASN  52  18.310  -9.093   7.116
  406   2HB   ASN  52          1HB       ASN  52  19.086  -7.518   7.228
  407   1HD2  ASN  52          1HD2      ASN  52  18.259  -9.447   9.289
  408   2HD2  ASN  52          2HD2      ASN  52  17.229  -8.570  10.366
  409    H    VAL  53           H        VAL  53  15.317  -6.079   6.257
  410    HA   VAL  53           HA       VAL  53  16.111  -3.698   5.116
  411    HB   VAL  53           HB       VAL  53  14.322  -2.596   6.465
  412   1HG1  VAL  53          1HG1      VAL  53  12.479  -3.849   5.457
  413   2HG1  VAL  53          2HG1      VAL  53  13.570  -5.201   5.148
  414   3HG1  VAL  53          3HG1      VAL  53  13.825  -3.657   4.331
  415   1HG2  VAL  53          1HG2      VAL  53  14.535  -3.918   8.522
  416   2HG2  VAL  53          2HG2      VAL  53  13.970  -5.350   7.661
  417   3HG2  VAL  53          3HG2      VAL  53  12.887  -3.979   7.893
  418    H    GLN  54           H        GLN  54  16.477  -4.736   8.482
  419    HA   GLN  54           HA       GLN  54  17.610  -3.912  10.246
  420   1HB   GLN  54          2HB       GLN  54  19.401  -3.132   7.963
  421   2HB   GLN  54          1HB       GLN  54  19.847  -2.869   9.639
  422   1HG   GLN  54          2HG       GLN  54  19.140  -5.542   8.468
  423   2HG   GLN  54          1HG       GLN  54  20.784  -4.940   8.691
  424   1HE2  GLN  54          1HE2      GLN  54  17.915  -6.115  10.274
  425   2HE2  GLN  54          2HE2      GLN  54  18.646  -6.399  11.815
  426    H    GLY  55           H        GLY  55  16.206  -2.434  11.116
  427   1HA   GLY  55          2HA       GLY  55  17.088   0.005  11.796
  428   2HA   GLY  55          1HA       GLY  55  16.266   0.324  10.273
  429    H    THR  56           H        THR  56  14.480   1.333  10.822
  430    HA   THR  56           HA       THR  56  12.524  -0.044  12.457
  431    HB   THR  56           HB       THR  56  12.036   2.292  13.556
  432    HG1  THR  56           1HG      THR  56  14.420   2.711  12.349
  433   1HG2  THR  56          1HG2      THR  56  12.588   0.237  14.774
  434   2HG2  THR  56          2HG2      THR  56  13.365   1.645  15.497
  435   3HG2  THR  56          3HG2      THR  56  14.304   0.535  14.497
  436    H    THR  57           H        THR  57  11.125  -0.268  10.881
  437    HA   THR  57           HA       THR  57  10.537   1.655   8.898
  438    HB   THR  57           HB       THR  57   8.535   0.160   8.471
  439    HG1  THR  57           1HG      THR  57   8.466  -1.786   9.636
  440   1HG2  THR  57          1HG2      THR  57  10.611  -0.169   7.264
  441   2HG2  THR  57          2HG2      THR  57   9.924  -1.737   7.687
  442   3HG2  THR  57          3HG2      THR  57  11.283  -1.092   8.609
  443    HA   PRO  58           HA       PRO  58   7.921   4.477  10.968
  444   1HB   PRO  58          2HB       PRO  58   6.290   4.618   8.508
  445   2HB   PRO  58          1HB       PRO  58   7.202   5.886   9.329
  446   1HG   PRO  58          2HG       PRO  58   8.052   4.849   7.022
  447   2HG   PRO  58          1HG       PRO  58   9.191   5.306   8.303
  448   1HD   PRO  58          2HD       PRO  58   8.180   2.587   7.548
  449   2HD   PRO  58          1HD       PRO  58   9.823   3.091   7.999
  450    H    SER  59           H        SER  59   6.663   3.662  12.506
  451    HA   SER  59           HA       SER  59   4.558   1.788  12.021
  452   1HB   SER  59          2HB       SER  59   4.038   2.347  14.487
  453   2HB   SER  59          1HB       SER  59   5.586   1.583  14.127
  454    HG   SER  59           HG       SER  59   5.361   3.667  15.518
  455    H    ALA  60           H        ALA  60   4.839   5.184  11.937
  456    HA   ALA  60           HA       ALA  60   2.281   6.029  12.685
  457   1HB   ALA  60          1HB       ALA  60   4.170   7.554  12.393
  458   2HB   ALA  60          2HB       ALA  60   2.774   8.065  11.445
  459   3HB   ALA  60          3HB       ALA  60   4.131   7.268  10.653
  460    H    ALA  61           H        ALA  61   3.279   4.312   9.894
  461    HA   ALA  61           HA       ALA  61   1.279   5.299   8.113
  462   1HB   ALA  61          1HB       ALA  61   1.994   3.518   6.620
  463   2HB   ALA  61          2HB       ALA  61   2.921   2.780   7.929
  464   3HB   ALA  61          3HB       ALA  61   3.388   4.360   7.299
  465    H    VAL  62           H        VAL  62   1.072   3.342  10.761
  466    HA   VAL  62           HA       VAL  62  -0.987   1.565   9.809
  467    HB   VAL  62           HB       VAL  62  -0.123   2.166  12.651
  468   1HG1  VAL  62          1HG1      VAL  62  -1.265   0.086  13.233
  469   2HG1  VAL  62          2HG1      VAL  62  -1.798  -0.097  11.562
  470   3HG1  VAL  62          3HG1      VAL  62  -2.391   1.251  12.533
  471   1HG2  VAL  62          1HG2      VAL  62   1.673   1.209  11.275
  472   2HG2  VAL  62          2HG2      VAL  62   0.615  -0.135  10.839
  473   3HG2  VAL  62          3HG2      VAL  62   1.125   0.079  12.514
  474    H    SER  63           H        SER  63  -0.774   4.665  11.376
  475    HA   SER  63           HA       SER  63  -3.512   4.823  12.170
  476   1HB   SER  63          2HB       SER  63  -1.625   7.136  11.669
  477   2HB   SER  63          1HB       SER  63  -3.041   7.115  12.717
  478    HG   SER  63           HG       SER  63  -0.596   6.649  13.430
  479    H    GLU  64           H        GLU  64  -1.636   5.920   9.398
  480    HA   GLU  64           HA       GLU  64  -3.674   7.548   8.289
  481   1HB   GLU  64          2HB       GLU  64  -0.963   7.181   7.883
  482   2HB   GLU  64          1HB       GLU  64  -1.680   6.569   6.401
  483   1HG   GLU  64          2HG       GLU  64  -1.130   8.895   6.143
  484   2HG   GLU  64          1HG       GLU  64  -2.883   8.695   6.128
  485    H    ALA  65           H        ALA  65  -3.041   4.192   8.188
  486    HA   ALA  65           HA       ALA  65  -4.031   3.459   5.687
  487   1HB   ALA  65          1HB       ALA  65  -4.365   1.240   6.648
  488   2HB   ALA  65          2HB       ALA  65  -4.166   1.908   8.269
  489   3HB   ALA  65          3HB       ALA  65  -2.815   1.925   7.134
  490    H    GLU  66           H        GLU  66  -5.685   4.425   8.570
  491    HA   GLU  66           HA       GLU  66  -8.242   3.380   8.083
  492   1HB   GLU  66          2HB       GLU  66  -7.385   4.472  10.198
  493   2HB   GLU  66          1HB       GLU  66  -7.593   6.022   9.403
  494   1HG   GLU  66          2HG       GLU  66  -9.960   5.691   9.240
  495   2HG   GLU  66          1HG       GLU  66  -9.816   4.047   9.862
  496    H    GLN  67           H        GLN  67  -6.753   6.445   7.172
  497    HA   GLN  67           HA       GLN  67  -9.064   7.396   5.761
  498   1HB   GLN  67          2HB       GLN  67  -6.206   8.393   5.791
  499   2HB   GLN  67          1HB       GLN  67  -7.573   9.249   5.089
  500   1HG   GLN  67          2HG       GLN  67  -8.580   9.556   7.212
  501   2HG   GLN  67          1HG       GLN  67  -7.429   8.470   7.987
  502   1HE2  GLN  67          1HE2      GLN  67  -6.788  10.028   9.449
  503   2HE2  GLN  67          2HE2      GLN  67  -5.790  11.361   9.000
  504    H    ILE  68           H        ILE  68  -6.034   5.818   4.967
  505    HA   ILE  68           HA       ILE  68  -6.070   6.107   2.189
  506    HB   ILE  68           HB       ILE  68  -4.950   3.890   3.902
  507   1HG1  ILE  68          2HG1      ILE  68  -3.615   6.234   2.529
  508   2HG1  ILE  68          1HG1      ILE  68  -3.990   6.133   4.249
  509   1HG2  ILE  68          1HG2      ILE  68  -4.428   4.409   0.970
  510   2HG2  ILE  68          2HG2      ILE  68  -5.343   3.056   1.636
  511   3HG2  ILE  68          3HG2      ILE  68  -3.621   3.205   1.980
  512   1HD1  ILE  68          1HD1      ILE  68  -2.460   4.248   4.471
  513   2HD1  ILE  68          2HD1      ILE  68  -1.645   5.667   3.819
  514   3HD1  ILE  68          3HD1      ILE  68  -2.090   4.336   2.749
  515    H    ARG  69           H        ARG  69  -7.485   3.568   4.238
  516    HA   ARG  69           HA       ARG  69  -8.409   1.949   2.118
  517   1HB   ARG  69          2HB       ARG  69  -8.132   1.261   4.528
  518   2HB   ARG  69          1HB       ARG  69  -9.612   2.141   4.881
  519   1HG   ARG  69          2HG       ARG  69 -10.860   0.680   3.393
  520   2HG   ARG  69          1HG       ARG  69  -9.375  -0.186   2.982
  521   1HD   ARG  69          2HD       ARG  69  -9.128  -0.741   5.408
  522   2HD   ARG  69          1HD       ARG  69 -10.721  -0.037   5.674
  523    HE   ARG  69           HE       ARG  69 -10.460  -2.208   3.718
  524   1HH1  ARG  69          1HH1      ARG  69 -11.615  -1.060   6.833
  525   2HH1  ARG  69          2HH1      ARG  69 -12.577  -2.481   7.136
  526   1HH2  ARG  69          1HH2      ARG  69 -11.754  -4.043   4.095
  527   2HH2  ARG  69          2HH2      ARG  69 -12.693  -4.153   5.558
  528    H    GLN  70           H        GLN  70  -9.864   4.616   3.881
  529    HA   GLN  70           HA       GLN  70 -12.453   4.407   2.735
  530   1HB   GLN  70          2HB       GLN  70 -11.351   5.810   4.786
  531   2HB   GLN  70          1HB       GLN  70 -11.467   7.065   3.563
  532   1HG   GLN  70          2HG       GLN  70 -13.741   5.379   4.580
  533   2HG   GLN  70          1HG       GLN  70 -13.393   7.040   5.034
  534   1HE2  GLN  70          1HE2      GLN  70 -13.771   8.701   3.530
  535   2HE2  GLN  70          2HE2      GLN  70 -14.796   8.462   2.159
  536    H    LEU  71           H        LEU  71  -9.486   6.105   1.894
  537    HA   LEU  71           HA       LEU  71 -10.582   7.781  -0.103
  538   1HB   LEU  71          2HB       LEU  71  -8.442   8.212   1.030
  539   2HB   LEU  71          1HB       LEU  71  -7.743   6.814   0.234
  540    HG   LEU  71           HG       LEU  71  -8.110   7.925  -1.962
  541   1HD1  LEU  71          1HD1      LEU  71  -8.882  10.303  -0.270
  542   2HD1  LEU  71          2HD1      LEU  71  -9.980   9.362  -1.276
  543   3HD1  LEU  71          3HD1      LEU  71  -8.680  10.288  -2.024
  544   1HD2  LEU  71          1HD2      LEU  71  -6.509   9.553   0.012
  545   2HD2  LEU  71          2HD2      LEU  71  -6.287   9.511  -1.739
  546   3HD2  LEU  71          3HD2      LEU  71  -5.961   8.072  -0.771
  547    H    LYS  72           H        LYS  72  -8.895   4.649  -0.286
  548    HA   LYS  72           HA       LYS  72  -9.155   4.551  -3.147
  549   1HB   LYS  72          2HB       LYS  72  -8.200   2.329  -3.014
  550   2HB   LYS  72          1HB       LYS  72  -7.277   3.435  -2.010
  551   1HG   LYS  72          2HG       LYS  72  -8.236   2.539  -0.017
  552   2HG   LYS  72          1HG       LYS  72  -9.390   1.577  -0.943
  553   1HD   LYS  72          2HD       LYS  72  -6.390   1.249  -1.007
  554   2HD   LYS  72          1HD       LYS  72  -7.513   0.224  -0.109
  555   1HE   LYS  72          2HE       LYS  72  -8.564  -0.499  -2.152
  556   2HE   LYS  72          1HE       LYS  72  -7.592   0.630  -3.094
  557   1HZ   LYS  72          1HZ       LYS  72  -5.613  -0.609  -2.389
  558   2HZ   LYS  72          2HZ       LYS  72  -6.685  -1.565  -3.277
  559   3HZ   LYS  72          3HZ       LYS  72  -6.598  -1.734  -1.590
  560    H    LYS  73           H        LYS  73 -11.118   3.737  -0.491
  561    HA   LYS  73           HA       LYS  73 -13.181   2.847  -0.266
  562   1HB   LYS  73          2HB       LYS  73 -13.299   3.301  -3.247
  563   2HB   LYS  73          1HB       LYS  73 -14.680   2.850  -2.256
  564   1HG   LYS  73          2HG       LYS  73 -14.498   4.903  -1.003
  565   2HG   LYS  73          1HG       LYS  73 -13.042   5.347  -1.895
  566   1HD   LYS  73          2HD       LYS  73 -14.311   5.456  -3.959
  567   2HD   LYS  73          1HD       LYS  73 -15.770   4.936  -3.111
  568   1HE   LYS  73          2HE       LYS  73 -15.692   6.946  -1.732
  569   2HE   LYS  73          1HE       LYS  73 -14.219   7.460  -2.554
  570   1HZ   LYS  73          1HZ       LYS  73 -16.796   7.005  -3.960
  571   2HZ   LYS  73          2HZ       LYS  73 -15.398   7.751  -4.572
  572   3HZ   LYS  73          3HZ       LYS  73 -16.308   8.515  -3.362
  573    H    GLU  74           H        GLU  74 -12.402   0.844   0.414
  574    HA   GLU  74           HA       GLU  74 -11.851  -1.284  -1.382
  575   1HB   GLU  74          2HB       GLU  74 -11.124  -1.163   1.027
  576   2HB   GLU  74          1HB       GLU  74 -12.784  -1.521   1.482
  577   1HG   GLU  74          2HG       GLU  74 -12.660  -3.658   0.326
  578   2HG   GLU  74          1HG       GLU  74 -11.013  -3.293  -0.188
  579    H    ASN  75           H        ASN  75 -13.270  -2.203  -2.668
  580    HA   ASN  75           HA       ASN  75 -16.103  -2.195  -1.887
  581   1HB   ASN  75          2HB       ASN  75 -16.607  -2.211  -4.319
  582   2HB   ASN  75          1HB       ASN  75 -15.737  -0.768  -3.805
  583   1HD2  ASN  75          1HD2      ASN  75 -13.652  -0.424  -4.504
  584   2HD2  ASN  75          2HD2      ASN  75 -12.937  -1.354  -5.776
  585    H    ALA  76           H        ALA  76 -17.404  -3.956  -2.717
  586    HA   ALA  76           HA       ALA  76 -16.168  -6.433  -2.095
  587   1HB   ALA  76          1HB       ALA  76 -18.946  -5.896  -3.119
  588   2HB   ALA  76          2HB       ALA  76 -18.459  -5.903  -1.424
  589   3HB   ALA  76          3HB       ALA  76 -18.383  -7.389  -2.372
  590    H    LEU  77           H        LEU  77 -16.802  -4.749  -5.026
  591    HA   LEU  77           HA       LEU  77 -17.063  -6.892  -6.812
  592   1HB   LEU  77          2HB       LEU  77 -15.887  -4.157  -7.311
  593   2HB   LEU  77          1HB       LEU  77 -16.455  -5.272  -8.534
  594    HG   LEU  77           HG       LEU  77 -18.179  -3.937  -6.449
  595   1HD1  LEU  77          1HD1      LEU  77 -17.405  -2.370  -8.132
  596   2HD1  LEU  77          2HD1      LEU  77 -19.123  -2.714  -8.348
  597   3HD1  LEU  77          3HD1      LEU  77 -17.932  -3.462  -9.413
  598   1HD2  LEU  77          1HD2      LEU  77 -18.994  -6.164  -7.057
  599   2HD2  LEU  77          2HD2      LEU  77 -18.942  -5.714  -8.764
  600   3HD2  LEU  77          3HD2      LEU  77 -20.056  -4.895  -7.668
  601    H    GLN  78           H        GLN  78 -14.205  -4.988  -5.883
  602    HA   GLN  78           HA       GLN  78 -12.360  -6.446  -7.441
  603   1HB   GLN  78          2HB       GLN  78 -12.038  -4.698  -5.007
  604   2HB   GLN  78          1HB       GLN  78 -10.665  -5.441  -5.817
  605   1HG   GLN  78          2HG       GLN  78 -12.640  -3.629  -7.187
  606   2HG   GLN  78          1HG       GLN  78 -11.127  -3.078  -6.467
  607   1HE2  GLN  78          1HE2      GLN  78  -9.186  -3.618  -7.434
  608   2HE2  GLN  78          2HE2      GLN  78  -9.089  -4.226  -9.050
  609    H    ARG  79           H        ARG  79 -13.763  -7.077  -4.321
  610    HA   ARG  79           HA       ARG  79 -11.720  -8.956  -3.532
  611   1HB   ARG  79          2HB       ARG  79 -13.031  -7.551  -1.910
  612   2HB   ARG  79          1HB       ARG  79 -14.443  -8.521  -2.295
  613   1HG   ARG  79          2HG       ARG  79 -13.546  -9.357  -0.272
  614   2HG   ARG  79          1HG       ARG  79 -13.155 -10.530  -1.534
  615   1HD   ARG  79          2HD       ARG  79 -11.207 -10.245  -0.188
  616   2HD   ARG  79          1HD       ARG  79 -10.910  -9.446  -1.732
  617    HE   ARG  79           HE       ARG  79 -11.673  -7.985   0.718
  618   1HH1  ARG  79          1HH1      ARG  79  -9.782  -8.303  -2.204
  619   2HH1  ARG  79          2HH1      ARG  79  -8.915  -6.806  -1.964
  620   1HH2  ARG  79          1HH2      ARG  79 -10.523  -6.015   1.043
  621   2HH2  ARG  79          2HH2      ARG  79  -9.323  -5.537  -0.117
  622    H    ALA  80           H        ALA  80 -14.764  -9.014  -5.139
  623    HA   ALA  80           HA       ALA  80 -15.199 -11.847  -4.850
  624   1HB   ALA  80          1HB       ALA  80 -17.097 -10.322  -5.006
  625   2HB   ALA  80          2HB       ALA  80 -17.118 -11.500  -6.322
  626   3HB   ALA  80          3HB       ALA  80 -16.586  -9.845  -6.626
  627    H    ARG  81           H        ARG  81 -13.449  -9.829  -6.963
  628    HA   ARG  81           HA       ARG  81 -13.656 -11.319  -9.359
  629   1HB   ARG  81          2HB       ARG  81 -11.708  -9.268  -8.363
  630   2HB   ARG  81          1HB       ARG  81 -11.486 -10.064  -9.909
  631   1HG   ARG  81          2HG       ARG  81 -13.720  -9.255 -10.602
  632   2HG   ARG  81          1HG       ARG  81 -13.841  -8.389  -9.069
  633   1HD   ARG  81          2HD       ARG  81 -13.117  -6.899 -10.852
  634   2HD   ARG  81          1HD       ARG  81 -11.850  -7.094  -9.642
  635    HE   ARG  81           HE       ARG  81 -11.133  -8.936 -11.420
  636   1HH1  ARG  81          1HH1      ARG  81 -12.139  -5.619 -11.874
  637   2HH1  ARG  81          2HH1      ARG  81 -11.225  -5.397 -13.337
  638   1HH2  ARG  81          1HH2      ARG  81  -9.914  -8.654 -13.335
  639   2HH2  ARG  81          2HH2      ARG  81  -9.934  -7.125 -14.158
  640    H    THR  82           H        THR  82 -12.022 -11.994  -6.522
  641    HA   THR  82           HA       THR  82  -9.696 -13.264  -7.316
  642    HB   THR  82           HB       THR  82 -11.440 -14.156  -5.022
  643    HG1  THR  82           1HG      THR  82 -11.092 -12.219  -4.240
  644   1HG2  THR  82          1HG2      THR  82  -9.301 -14.739  -3.980
  645   2HG2  THR  82          2HG2      THR  82  -8.445 -14.193  -5.422
  646   3HG2  THR  82          3HG2      THR  82  -9.509 -15.596  -5.510
  647    H    ARG  83           H        ARG  83 -12.309 -15.268  -6.092
  648    HA   ARG  83           HA       ARG  83 -12.093 -16.937  -8.489
  649   1HB   ARG  83          2HB       ARG  83 -12.154 -17.740  -5.602
  650   2HB   ARG  83          1HB       ARG  83 -12.775 -18.823  -6.835
  651   1HG   ARG  83          2HG       ARG  83 -10.548 -18.639  -7.980
  652   2HG   ARG  83          1HG       ARG  83  -9.974 -17.775  -6.553
  653   1HD   ARG  83          2HD       ARG  83 -11.103 -20.573  -6.592
  654   2HD   ARG  83          1HD       ARG  83  -9.398 -20.147  -6.450
  655    HE   ARG  83           HE       ARG  83 -11.335 -19.231  -4.433
  656   1HH1  ARG  83          1HH1      ARG  83  -8.590 -21.222  -5.303
  657   2HH1  ARG  83          2HH1      ARG  83  -8.043 -21.407  -3.663
  658   1HH2  ARG  83          1HH2      ARG  83 -10.636 -19.505  -2.267
  659   2HH2  ARG  83          2HH2      ARG  83  -9.207 -20.451  -1.941
  660    H    HIS  84           H        HIS  84 -13.987 -18.000  -9.139
  661    HA   HIS  84           HA       HIS  84 -16.457 -16.931  -7.945
  662   1HB   HIS  84          2HB       HIS  84 -17.418 -16.545 -10.112
  663   2HB   HIS  84          1HB       HIS  84 -15.848 -15.752 -10.089
  664    HD1  HIS  84           1HD      HIS  84 -17.863 -18.038 -12.047
  665    HD2  HIS  84           2HD      HIS  84 -13.799 -17.347 -11.515
  666    HE1  HIS  84           1HE      HIS  84 -16.732 -19.133 -14.002
  667    HE2  HIS  84           2HE      HIS  84 -14.270 -18.924 -13.516
  668    HA   PRO  85           HA       PRO  85 -17.840 -21.142  -7.976
  669   1HB   PRO  85          2HB       PRO  85 -20.512 -20.822  -8.415
  670   2HB   PRO  85          1HB       PRO  85 -19.743 -20.509  -6.856
  671   1HG   PRO  85          2HG       PRO  85 -20.546 -18.586  -8.996
  672   2HG   PRO  85          1HG       PRO  85 -20.709 -18.434  -7.237
  673   1HD   PRO  85          2HD       PRO  85 -18.742 -17.206  -8.631
  674   2HD   PRO  85          1HD       PRO  85 -18.511 -17.780  -6.969
  675    H    ALA  86           H        ALA  86 -19.240 -22.656  -9.385
  676    HA   ALA  86           HA       ALA  86 -18.523 -22.086 -12.169
  677   1HB   ALA  86          1HB       ALA  86 -17.522 -24.095 -11.199
  678   2HB   ALA  86          2HB       ALA  86 -18.630 -24.512 -12.509
  679   3HB   ALA  86          3HB       ALA  86 -19.129 -24.722 -10.830
  680    H    GLU  87           H        GLU  87 -20.138 -21.305 -13.353
  681    HA   GLU  87           HA       GLU  87 -22.893 -21.799 -12.818
  682   1HB   GLU  87          2HB       GLU  87 -21.637 -20.870 -15.412
  683   2HB   GLU  87          1HB       GLU  87 -23.327 -20.712 -14.959
  684   1HG   GLU  87          2HG       GLU  87 -22.640 -18.621 -14.473
  685   2HG   GLU  87          1HG       GLU  87 -22.264 -19.381 -12.928
  686    H    SER  88           H        SER  88 -20.425 -23.455 -14.483
  687    HA   SER  88           HA       SER  88 -21.712 -24.913 -16.426
  688   1HB   SER  88          2HB       SER  88 -19.515 -25.985 -14.656
  689   2HB   SER  88          1HB       SER  88 -19.827 -26.370 -16.352
  690    HG   SER  88           HG       SER  88 -18.166 -24.867 -16.274
  691    H    CYS  89           H        CYS  89 -22.003 -25.248 -13.004
  692    HA   CYS  89           HA       CYS  89 -22.582 -27.969 -12.764
  693   1HB   CYS  89          2HB       CYS  89 -23.674 -27.334 -10.622
  694   2HB   CYS  89          1HB       CYS  89 -22.065 -26.645 -10.816
  695    HG   CYS  89           HG       CYS  89 -22.744 -24.116 -10.913
  696    H    LEU  90           H        LEU  90 -24.514 -25.397 -14.007
  697    HA   LEU  90           HA       LEU  90 -27.049 -26.548 -13.383
  698   1HB   LEU  90          2HB       LEU  90 -28.001 -24.845 -14.850
  699   2HB   LEU  90          1HB       LEU  90 -26.871 -24.167 -13.700
  700    HG   LEU  90           HG       LEU  90 -25.173 -24.327 -15.680
  701   1HD1  LEU  90          1HD1      LEU  90 -26.611 -25.574 -17.196
  702   2HD1  LEU  90          2HD1      LEU  90 -26.218 -23.989 -17.863
  703   3HD1  LEU  90          3HD1      LEU  90 -27.805 -24.278 -17.148
  704   1HD2  LEU  90          1HD2      LEU  90 -25.816 -22.077 -16.372
  705   2HD2  LEU  90          2HD2      LEU  90 -25.918 -22.269 -14.621
  706   3HD2  LEU  90          3HD2      LEU  90 -27.387 -22.287 -15.597
  707    H    GLU  91           H        GLU  91 -24.743 -27.181 -15.836
  708    HA   GLU  91           HA       GLU  91 -26.412 -28.242 -17.841
  709   1HB   GLU  91          2HB       GLU  91 -23.585 -28.377 -17.147
  710   2HB   GLU  91          1HB       GLU  91 -24.176 -29.888 -17.817
  711   1HG   GLU  91          2HG       GLU  91 -23.331 -28.621 -19.616
  712   2HG   GLU  91          1HG       GLU  91 -25.088 -28.575 -19.741
  713    H    HIS  92           H        HIS  92 -24.752 -29.825 -15.142
  714    HA   HIS  92           HA       HIS  92 -25.274 -31.576 -13.819
  715   1HB   HIS  92          2HB       HIS  92 -27.544 -30.486 -13.788
  716   2HB   HIS  92          1HB       HIS  92 -28.015 -31.576 -15.086
  717    HD1  HIS  92           1HD      HIS  92 -27.009 -31.579 -11.457
  718    HD2  HIS  92           2HD      HIS  92 -28.716 -34.120 -14.275
  719    HE1  HIS  92           1HE      HIS  92 -27.798 -33.590 -10.168
  720    HE2  HIS  92           2HE      HIS  92 -28.598 -35.207 -11.928
  721    H    HIS  93           H        HIS  93 -24.632 -33.605 -13.998
  722    HA   HIS  93           HA       HIS  93 -24.225 -34.789 -16.533
  723   1HB   HIS  93          2HB       HIS  93 -23.295 -36.656 -15.389
  724   2HB   HIS  93          1HB       HIS  93 -22.877 -35.247 -14.427
  725    HD1  HIS  93           1HD      HIS  93 -24.328 -34.932 -12.173
  726    HD2  HIS  93           2HD      HIS  93 -24.629 -38.624 -14.061
  727    HE1  HIS  93           1HE      HIS  93 -25.326 -36.488 -10.469
  728    HE2  HIS  93           2HE      HIS  93 -25.272 -38.762 -11.561
  729    H    HIS  94           H        HIS  94 -25.445 -36.119 -17.737
  730    HA   HIS  94           HA       HIS  94 -27.923 -37.147 -16.526
  731   1HB   HIS  94          2HB       HIS  94 -29.147 -36.730 -18.547
  732   2HB   HIS  94          1HB       HIS  94 -28.347 -35.235 -18.089
  733    HD1  HIS  94           1HD      HIS  94 -28.986 -37.297 -20.921
  734    HD2  HIS  94           2HD      HIS  94 -25.795 -34.926 -19.685
  735    HE1  HIS  94           1HE      HIS  94 -27.627 -36.845 -22.993
  736    HE2  HIS  94           2HE      HIS  94 -25.637 -35.513 -22.203
  737    H    HIS  95           H        HIS  95 -28.715 -39.139 -17.405
  738    HA   HIS  95           HA       HIS  95 -26.563 -40.736 -18.622
  739   1HB   HIS  95          2HB       HIS  95 -26.990 -41.465 -16.352
  740   2HB   HIS  95          1HB       HIS  95 -28.718 -41.564 -16.667
  741    HD1  HIS  95           1HD      HIS  95 -25.479 -43.270 -17.681
  742    HD2  HIS  95           2HD      HIS  95 -29.575 -43.978 -17.606
  743    HE1  HIS  95           1HE      HIS  95 -25.768 -45.670 -18.358
  744    HE2  HIS  95           2HE      HIS  95 -28.258 -45.970 -18.591
  745    H    HIS  96           H        HIS  96 -26.995 -41.940 -20.400
  746    HA   HIS  96           HA       HIS  96 -29.764 -41.842 -21.417
  747   1HB   HIS  96          2HB       HIS  96 -27.846 -40.708 -22.729
  748   2HB   HIS  96          1HB       HIS  96 -27.321 -42.343 -23.114
  749    HD1  HIS  96           1HD      HIS  96 -27.966 -42.744 -25.472
  750    HD2  HIS  96           2HD      HIS  96 -30.964 -40.788 -23.342
  751    HE1  HIS  96           1HE      HIS  96 -29.905 -42.517 -27.070
  752    HE2  HIS  96           2HE      HIS  96 -31.755 -41.460 -25.716
  753    H    HIS  97           H        HIS  97 -30.736 -43.736 -22.051
  754    HA   HIS  97           HA       HIS  97 -31.218 -45.956 -22.081
  755   1HB   HIS  97          2HB       HIS  97 -28.219 -46.189 -22.224
  756   2HB   HIS  97          1HB       HIS  97 -29.226 -47.618 -22.023
  757    HD1  HIS  97           1HD      HIS  97 -30.292 -48.576 -24.073
  758    HD2  HIS  97           2HD      HIS  97 -28.662 -44.800 -24.726
  759    HE1  HIS  97           1HE      HIS  97 -30.433 -48.195 -26.554
  760    HE2  HIS  97           2HE      HIS  97 -29.374 -45.939 -26.944
  Start of MODEL   18
    1   1H    MET   1          1HT       MET   1   1.030  19.896   0.009
    2   2H    MET   1          2HT       MET   1   2.279  20.919  -0.517
    3   3H    MET   1          3HT       MET   1   2.134  20.532   1.126
    4    HA   MET   1           HA       MET   1   3.932  19.326  -0.010
    5   1HB   MET   1          2HB       MET   1   1.640  17.686   1.090
    6   2HB   MET   1          1HB       MET   1   3.267  17.072   0.831
    7   1HG   MET   1          2HG       MET   1   4.132  18.712   2.431
    8   2HG   MET   1          1HG       MET   1   2.491  19.300   2.701
    9   1HE   MET   1          1HE       MET   1   0.824  16.584   2.614
   10   2HE   MET   1          2HE       MET   1   0.563  17.844   3.821
   11   3HE   MET   1          3HE       MET   1   0.777  16.167   4.328
   12    HA   PRO   2           HA       PRO   2   2.340  18.005  -4.046
   13   1HB   PRO   2          2HB       PRO   2   4.480  18.681  -5.486
   14   2HB   PRO   2          1HB       PRO   2   3.358  19.913  -4.893
   15   1HG   PRO   2          2HG       PRO   2   6.036  19.122  -3.829
   16   2HG   PRO   2          1HG       PRO   2   5.326  20.738  -3.984
   17   1HD   PRO   2          2HD       PRO   2   5.386  19.227  -1.653
   18   2HD   PRO   2          1HD       PRO   2   4.281  20.579  -1.963
   19    H    THR   3           H        THR   3   4.890  17.006  -2.070
   20    HA   THR   3           HA       THR   3   5.718  14.851  -3.844
   21    HB   THR   3           HB       THR   3   7.320  14.521  -1.727
   22    HG1  THR   3           1HG      THR   3   7.844  16.831  -1.112
   23   1HG2  THR   3          1HG2      THR   3   8.975  15.921  -2.881
   24   2HG2  THR   3          2HG2      THR   3   7.686  16.652  -3.838
   25   3HG2  THR   3          3HG2      THR   3   8.057  14.939  -4.021
   26    H    LYS   4           H        LYS   4   5.226  12.813  -3.508
   27    HA   LYS   4           HA       LYS   4   4.122  11.979  -0.939
   28   1HB   LYS   4          2HB       LYS   4   2.189  12.337  -2.377
   29   2HB   LYS   4          1HB       LYS   4   2.922  11.367  -3.649
   30   1HG   LYS   4          2HG       LYS   4   2.834   9.401  -2.165
   31   2HG   LYS   4          1HG       LYS   4   2.033  10.388  -0.940
   32   1HD   LYS   4          2HD       LYS   4   0.194  10.810  -2.482
   33   2HD   LYS   4          1HD       LYS   4   0.993   9.835  -3.714
   34   1HE   LYS   4          2HE       LYS   4  -0.737   8.539  -2.604
   35   2HE   LYS   4          1HE       LYS   4   0.856   7.879  -2.236
   36   1HZ   LYS   4          1HZ       LYS   4  -0.721   9.666  -0.456
   37   2HZ   LYS   4          2HZ       LYS   4   0.800   8.998  -0.100
   38   3HZ   LYS   4          3HZ       LYS   4  -0.550   7.987  -0.268
   39    H    THR   5           H        THR   5   5.268  10.380  -0.240
   40    HA   THR   5           HA       THR   5   6.679   8.653  -2.168
   41    HB   THR   5           HB       THR   5   7.547   8.895   0.684
   42    HG1  THR   5           1HG      THR   5   8.060  10.741  -1.435
   43   1HG2  THR   5          1HG2      THR   5   9.031   8.419  -1.900
   44   2HG2  THR   5          2HG2      THR   5   8.565   7.182  -0.737
   45   3HG2  THR   5          3HG2      THR   5   9.746   8.410  -0.285
   46    H    TYR   6           H        TYR   6   6.874   6.419  -1.604
   47    HA   TYR   6           HA       TYR   6   4.742   5.507   0.201
   48   1HB   TYR   6          2HB       TYR   6   5.127   4.929  -2.535
   49   2HB   TYR   6          1HB       TYR   6   5.560   3.463  -1.659
   50    HD1  TYR   6           1HD      TYR   6   3.894   2.327  -0.244
   51    HD2  TYR   6           2HD      TYR   6   2.849   5.701  -2.615
   52    HE1  TYR   6           1HE      TYR   6   1.516   1.785   0.047
   53    HE2  TYR   6           2HE      TYR   6   0.461   5.164  -2.335
   54    HH   TYR   6           HH       TYR   6  -0.633   2.806  -0.054
   55    H    SER   7           H        SER   7   5.385   4.487   1.921
   56    HA   SER   7           HA       SER   7   8.109   4.269   2.552
   57   1HB   SER   7          2HB       SER   7   5.747   2.999   3.956
   58   2HB   SER   7          1HB       SER   7   7.339   3.302   4.654
   59    HG   SER   7           HG       SER   7   5.483   5.253   3.722
   60    H    GLU   8           H        GLU   8   9.309   2.418   3.187
   61    HA   GLU   8           HA       GLU   8   9.517   0.359   1.345
   62   1HB   GLU   8          2HB       GLU   8  10.386   0.534   4.233
   63   2HB   GLU   8          1HB       GLU   8  10.834  -0.800   3.181
   64   1HG   GLU   8          2HG       GLU   8  11.461   2.066   2.554
   65   2HG   GLU   8          1HG       GLU   8  12.543   1.011   3.464
   66    H    GLU   9           H        GLU   9   7.697   0.585   4.303
   67    HA   GLU   9           HA       GLU   9   7.212  -2.048   4.916
   68   1HB   GLU   9          2HB       GLU   9   6.697   0.057   6.216
   69   2HB   GLU   9          1HB       GLU   9   5.243   0.211   5.246
   70   1HG   GLU   9          2HG       GLU   9   4.305  -1.740   6.166
   71   2HG   GLU   9          1HG       GLU   9   5.841  -2.226   6.889
   72    H    PHE  10           H        PHE  10   5.044   0.051   2.945
   73    HA   PHE  10           HA       PHE  10   3.212  -2.031   2.414
   74   1HB   PHE  10          2HB       PHE  10   2.635   0.357   2.159
   75   2HB   PHE  10          1HB       PHE  10   3.709   0.456   0.767
   76    HD1  PHE  10           1HD      PHE  10   3.048  -0.403  -1.369
   77    HD2  PHE  10           2HD      PHE  10   0.551  -0.924   2.035
   78    HE1  PHE  10           1HE      PHE  10   1.196  -1.089  -2.838
   79    HE2  PHE  10           2HE      PHE  10  -1.305  -1.616   0.574
   80    HZ   PHE  10           HZ       PHE  10  -0.983  -1.699  -1.866
   81    H    LYS  11           H        LYS  11   5.931  -0.762   0.544
   82    HA   LYS  11           HA       LYS  11   5.622  -2.333  -1.739
   83   1HB   LYS  11          2HB       LYS  11   8.209  -1.350  -0.514
   84   2HB   LYS  11          1HB       LYS  11   7.964  -1.830  -2.189
   85   1HG   LYS  11          2HG       LYS  11   6.340   0.011  -2.447
   86   2HG   LYS  11          1HG       LYS  11   6.698   0.522  -0.798
   87   1HD   LYS  11          2HD       LYS  11   8.717   0.343  -3.033
   88   2HD   LYS  11          1HD       LYS  11   7.928   1.829  -2.499
   89   1HE   LYS  11          2HE       LYS  11   8.883   1.533  -0.282
   90   2HE   LYS  11          1HE       LYS  11   9.663   0.049  -0.806
   91   1HZ   LYS  11          1HZ       LYS  11  10.218   2.784  -1.825
   92   2HZ   LYS  11          2HZ       LYS  11  10.929   1.367  -2.422
   93   3HZ   LYS  11          3HZ       LYS  11  11.227   1.854  -0.822
   94    H    ARG  12           H        ARG  12   7.205  -2.990   1.327
   95    HA   ARG  12           HA       ARG  12   8.221  -5.553   0.551
   96   1HB   ARG  12          2HB       ARG  12   7.866  -4.215   3.232
   97   2HB   ARG  12          1HB       ARG  12   8.611  -5.791   3.039
   98   1HG   ARG  12          2HG       ARG  12  10.346  -4.821   1.640
   99   2HG   ARG  12          1HG       ARG  12   9.585  -3.237   1.777
  100   1HD   ARG  12          2HD       ARG  12   9.882  -3.491   4.292
  101   2HD   ARG  12          1HD       ARG  12  10.942  -4.851   3.922
  102    HE   ARG  12           HE       ARG  12  11.680  -2.512   2.466
  103   1HH1  ARG  12          1HH1      ARG  12  11.950  -4.090   5.582
  104   2HH1  ARG  12          2HH1      ARG  12  13.349  -3.176   6.059
  105   1HH2  ARG  12          1HH2      ARG  12  13.508  -1.318   3.073
  106   2HH2  ARG  12          2HH2      ARG  12  14.250  -1.602   4.622
  107    H    ASP  13           H        ASP  13   5.368  -4.392   2.264
  108    HA   ASP  13           HA       ASP  13   4.293  -6.884   3.010
  109   1HB   ASP  13          2HB       ASP  13   3.530  -4.706   3.905
  110   2HB   ASP  13          1HB       ASP  13   2.849  -4.307   2.333
  111    H    ALA  14           H        ALA  14   4.039  -4.970   0.065
  112    HA   ALA  14           HA       ALA  14   2.176  -6.556  -1.315
  113   1HB   ALA  14          1HB       ALA  14   4.451  -4.931  -2.463
  114   2HB   ALA  14          2HB       ALA  14   2.859  -4.304  -2.038
  115   3HB   ALA  14          3HB       ALA  14   3.025  -5.487  -3.334
  116    H    VAL  15           H        VAL  15   5.687  -6.817  -0.985
  117    HA   VAL  15           HA       VAL  15   5.995  -8.995  -2.778
  118    HB   VAL  15           HB       VAL  15   7.745  -8.257  -0.418
  119   1HG1  VAL  15          1HG1      VAL  15   9.503  -9.494  -1.585
  120   2HG1  VAL  15          2HG1      VAL  15   8.351  -9.952  -2.841
  121   3HG1  VAL  15          3HG1      VAL  15   8.136 -10.538  -1.192
  122   1HG2  VAL  15          1HG2      VAL  15   7.929  -7.451  -3.315
  123   2HG2  VAL  15          2HG2      VAL  15   9.134  -7.101  -2.074
  124   3HG2  VAL  15          3HG2      VAL  15   7.518  -6.404  -1.956
  125    H    ALA  16           H        ALA  16   5.237  -8.722   0.651
  126    HA   ALA  16           HA       ALA  16   5.324 -11.497   1.249
  127   1HB   ALA  16          1HB       ALA  16   5.341  -9.790   3.017
  128   2HB   ALA  16          2HB       ALA  16   4.017 -10.936   3.230
  129   3HB   ALA  16          3HB       ALA  16   3.693  -9.330   2.582
  130    H    LEU  17           H        LEU  17   2.764  -9.341   0.104
  131    HA   LEU  17           HA       LEU  17   0.619 -11.117   0.061
  132   1HB   LEU  17          2HB       LEU  17   1.356  -8.817  -1.747
  133   2HB   LEU  17          1HB       LEU  17  -0.143  -9.703  -1.928
  134    HG   LEU  17           HG       LEU  17   0.649  -8.265   0.605
  135   1HD1  LEU  17          1HD1      LEU  17   0.382  -6.676  -1.232
  136   2HD1  LEU  17          2HD1      LEU  17  -0.943  -6.543  -0.076
  137   3HD1  LEU  17          3HD1      LEU  17  -1.192  -7.374  -1.611
  138   1HD2  LEU  17          1HD2      LEU  17  -1.997  -9.374  -0.334
  139   2HD2  LEU  17          2HD2      LEU  17  -1.699  -8.540   1.191
  140   3HD2  LEU  17          3HD2      LEU  17  -0.955 -10.110   0.886
  141    H    TYR  18           H        TYR  18   3.277 -10.703  -2.209
  142    HA   TYR  18           HA       TYR  18   2.326 -12.399  -4.245
  143   1HB   TYR  18          2HB       TYR  18   4.144 -10.906  -4.708
  144   2HB   TYR  18          1HB       TYR  18   5.125 -11.615  -3.429
  145    HD1  TYR  18           1HD      TYR  18   6.700 -13.223  -3.984
  146    HD2  TYR  18           2HD      TYR  18   3.450 -12.535  -6.642
  147    HE1  TYR  18           1HE      TYR  18   7.716 -14.762  -5.614
  148    HE2  TYR  18           2HE      TYR  18   4.452 -14.072  -8.277
  149    HH   TYR  18           HH       TYR  18   7.012 -16.170  -7.520
  150    H    GLU  19           H        GLU  19   4.301 -13.058  -1.380
  151    HA   GLU  19           HA       GLU  19   4.630 -15.833  -1.975
  152   1HB   GLU  19          2HB       GLU  19   5.011 -14.267   0.580
  153   2HB   GLU  19          1HB       GLU  19   5.372 -15.981   0.426
  154   1HG   GLU  19          2HG       GLU  19   6.654 -13.755  -1.145
  155   2HG   GLU  19          1HG       GLU  19   7.382 -14.630   0.202
  156    H    ASN  20           H        ASN  20   2.159 -13.940  -0.539
  157    HA   ASN  20           HA       ASN  20   0.797 -16.299   0.545
  158   1HB   ASN  20          2HB       ASN  20   0.380 -13.334   0.891
  159   2HB   ASN  20          1HB       ASN  20  -0.863 -14.490   1.348
  160   1HD2  ASN  20          1HD2      ASN  20   2.306 -13.258   2.048
  161   2HD2  ASN  20          2HD2      ASN  20   2.460 -13.989   3.609
  162    H    SER  21           H        SER  21   1.135 -15.696  -2.331
  163    HA   SER  21           HA       SER  21  -1.248 -14.743  -3.472
  164   1HB   SER  21          2HB       SER  21  -0.423 -16.018  -5.515
  165   2HB   SER  21          1HB       SER  21   0.665 -14.801  -4.852
  166    HG   SER  21           HG       SER  21   2.056 -16.295  -4.358
  167    H    ASP  22           H        ASP  22  -0.557 -17.658  -1.909
  168    HA   ASP  22           HA       ASP  22  -2.320 -19.475  -3.028
  169   1HB   ASP  22          2HB       ASP  22  -0.819 -20.096  -1.218
  170   2HB   ASP  22          1HB       ASP  22  -1.657 -19.016  -0.110
  171    H    GLY  23           H        GLY  23  -2.946 -16.661  -1.078
  172   1HA   GLY  23          2HA       GLY  23  -5.769 -17.292  -0.788
  173   2HA   GLY  23          1HA       GLY  23  -4.955 -15.850  -0.193
  174    H    ALA  24           H        ALA  24  -3.735 -15.308  -2.846
  175    HA   ALA  24           HA       ALA  24  -5.980 -14.715  -4.566
  176   1HB   ALA  24          1HB       ALA  24  -4.460 -12.471  -3.232
  177   2HB   ALA  24          2HB       ALA  24  -6.149 -12.894  -2.943
  178   3HB   ALA  24          3HB       ALA  24  -5.650 -12.286  -4.521
  179    H    SER  25           H        SER  25  -5.325 -14.702  -6.608
  180    HA   SER  25           HA       SER  25  -2.705 -15.444  -7.284
  181   1HB   SER  25          2HB       SER  25  -4.836 -14.328  -9.119
  182   2HB   SER  25          1HB       SER  25  -3.465 -15.333  -9.588
  183    HG   SER  25           HG       SER  25  -4.562 -16.778  -7.809
  184    H    LEU  26           H        LEU  26  -1.292 -14.316  -8.840
  185    HA   LEU  26           HA       LEU  26  -0.300 -11.979  -7.725
  186   1HB   LEU  26          2HB       LEU  26   0.869 -13.683  -9.217
  187   2HB   LEU  26          1HB       LEU  26   0.165 -12.838 -10.579
  188    HG   LEU  26           HG       LEU  26   1.942 -11.431  -8.591
  189   1HD1  LEU  26          1HD1      LEU  26   3.794 -11.818 -10.134
  190   2HD1  LEU  26          2HD1      LEU  26   2.754 -12.833 -11.133
  191   3HD1  LEU  26          3HD1      LEU  26   3.169 -13.338  -9.495
  192   1HD2  LEU  26          1HD2      LEU  26   0.595 -10.008 -10.058
  193   2HD2  LEU  26          2HD2      LEU  26   1.227 -10.858 -11.468
  194   3HD2  LEU  26          3HD2      LEU  26   2.309  -9.896 -10.459
  195    H    GLN  27           H        GLN  27  -2.161 -12.345 -10.756
  196    HA   GLN  27           HA       GLN  27  -2.261  -9.608 -11.374
  197   1HB   GLN  27          2HB       GLN  27  -2.831 -11.352 -12.997
  198   2HB   GLN  27          1HB       GLN  27  -4.251 -11.779 -12.057
  199   1HG   GLN  27          2HG       GLN  27  -4.883 -10.447 -13.958
  200   2HG   GLN  27          1HG       GLN  27  -5.188  -9.558 -12.469
  201   1HE2  GLN  27          1HE2      GLN  27  -5.136  -7.565 -13.432
  202   2HE2  GLN  27          2HE2      GLN  27  -3.690  -6.856 -14.058
  203    H    GLN  28           H        GLN  28  -4.267 -11.600  -9.295
  204    HA   GLN  28           HA       GLN  28  -6.377  -9.735  -8.963
  205   1HB   GLN  28          2HB       GLN  28  -6.441 -12.216  -8.431
  206   2HB   GLN  28          1HB       GLN  28  -5.548 -11.835  -6.964
  207   1HG   GLN  28          2HG       GLN  28  -7.919 -12.026  -6.510
  208   2HG   GLN  28          1HG       GLN  28  -7.362 -10.376  -6.232
  209   1HE2  GLN  28          1HE2      GLN  28  -9.417  -9.499  -6.490
  210   2HE2  GLN  28          2HE2      GLN  28 -10.197  -9.421  -8.036
  211    H    ILE  29           H        ILE  29  -3.367 -10.355  -7.236
  212    HA   ILE  29           HA       ILE  29  -3.705  -8.545  -5.115
  213    HB   ILE  29           HB       ILE  29  -1.160  -9.318  -6.558
  214   1HG1  ILE  29          2HG1      ILE  29  -2.363 -11.222  -5.564
  215   2HG1  ILE  29          1HG1      ILE  29  -0.847 -10.915  -4.732
  216   1HG2  ILE  29          1HG2      ILE  29  -1.512  -7.999  -3.867
  217   2HG2  ILE  29          2HG2      ILE  29  -0.831  -7.256  -5.313
  218   3HG2  ILE  29          3HG2      ILE  29   0.016  -8.589  -4.529
  219   1HD1  ILE  29          1HD1      ILE  29  -2.058  -9.780  -2.942
  220   2HD1  ILE  29          2HD1      ILE  29  -2.606 -11.443  -3.161
  221   3HD1  ILE  29          3HD1      ILE  29  -3.577 -10.106  -3.775
  222    H    ALA  30           H        ALA  30  -2.289  -8.115  -8.337
  223    HA   ALA  30           HA       ALA  30  -1.675  -5.381  -8.119
  224   1HB   ALA  30          1HB       ALA  30  -0.776  -6.805  -9.893
  225   2HB   ALA  30          2HB       ALA  30  -1.570  -5.378 -10.560
  226   3HB   ALA  30          3HB       ALA  30  -2.383  -6.944 -10.605
  227    H    ASN  31           H        ASN  31  -4.606  -7.053  -9.164
  228    HA   ASN  31           HA       ASN  31  -6.044  -4.821 -10.053
  229   1HB   ASN  31          2HB       ASN  31  -6.888  -7.510  -8.989
  230   2HB   ASN  31          1HB       ASN  31  -8.052  -6.312  -9.508
  231   1HD2  ASN  31          1HD2      ASN  31  -7.571  -8.947 -10.567
  232   2HD2  ASN  31          2HD2      ASN  31  -7.168  -8.736 -12.232
  233    H    ASP  32           H        ASP  32  -5.785  -6.316  -6.856
  234    HA   ASP  32           HA       ASP  32  -7.797  -4.675  -5.663
  235   1HB   ASP  32          2HB       ASP  32  -7.128  -6.928  -4.794
  236   2HB   ASP  32          1HB       ASP  32  -5.596  -6.232  -4.284
  237    H    LEU  33           H        LEU  33  -4.257  -4.615  -5.723
  238    HA   LEU  33           HA       LEU  33  -4.035  -2.372  -3.983
  239   1HB   LEU  33          2HB       LEU  33  -2.179  -3.904  -5.730
  240   2HB   LEU  33          1HB       LEU  33  -1.677  -2.312  -5.202
  241    HG   LEU  33           HG       LEU  33  -1.899  -3.005  -2.859
  242   1HD1  LEU  33          1HD1      LEU  33  -3.679  -4.654  -3.121
  243   2HD1  LEU  33          2HD1      LEU  33  -2.287  -5.335  -2.276
  244   3HD1  LEU  33          3HD1      LEU  33  -2.570  -5.724  -3.974
  245   1HD2  LEU  33          1HD2      LEU  33   0.247  -3.259  -3.962
  246   2HD2  LEU  33          2HD2      LEU  33  -0.213  -4.863  -4.530
  247   3HD2  LEU  33          3HD2      LEU  33  -0.012  -4.566  -2.805
  248    H    GLY  34           H        GLY  34  -4.342  -2.761  -7.440
  249   1HA   GLY  34          2HA       GLY  34  -5.200  -1.101  -8.878
  250   2HA   GLY  34          1HA       GLY  34  -4.814   0.114  -7.670
  251    H    ILE  35           H        ILE  35  -2.592  -2.336  -8.801
  252    HA   ILE  35           HA       ILE  35  -1.036  -0.259 -10.183
  253    HB   ILE  35           HB       ILE  35   1.032  -1.358  -9.360
  254   1HG1  ILE  35          2HG1      ILE  35  -0.827  -2.807  -7.459
  255   2HG1  ILE  35          1HG1      ILE  35   0.009  -3.556  -8.817
  256   1HG2  ILE  35          1HG2      ILE  35  -0.788  -0.276  -7.216
  257   2HG2  ILE  35          2HG2      ILE  35   0.226   0.672  -8.303
  258   3HG2  ILE  35          3HG2      ILE  35   0.970  -0.390  -7.108
  259   1HD1  ILE  35          1HD1      ILE  35   1.305  -2.284  -6.417
  260   2HD1  ILE  35          2HD1      ILE  35   2.152  -3.026  -7.775
  261   3HD1  ILE  35          3HD1      ILE  35   1.137  -4.013  -6.724
  262    H    ASN  36           H        ASN  36   0.755  -1.359 -11.537
  263    HA   ASN  36           HA       ASN  36  -0.455  -3.383 -13.176
  264   1HB   ASN  36          2HB       ASN  36   0.882  -1.448 -14.058
  265   2HB   ASN  36          1HB       ASN  36   2.315  -2.193 -13.358
  266   1HD2  ASN  36          1HD2      ASN  36  -0.133  -2.412 -15.784
  267   2HD2  ASN  36          2HD2      ASN  36   0.673  -3.577 -16.770
  268    H    ARG  37           H        ARG  37   0.358  -5.472 -13.514
  269    HA   ARG  37           HA       ARG  37   1.339  -6.766 -11.224
  270   1HB   ARG  37          2HB       ARG  37   1.447  -8.754 -12.673
  271   2HB   ARG  37          1HB       ARG  37  -0.085  -7.921 -12.779
  272   1HG   ARG  37          2HG       ARG  37   0.541  -6.958 -14.902
  273   2HG   ARG  37          1HG       ARG  37   2.142  -7.693 -14.788
  274   1HD   ARG  37          2HD       ARG  37   1.216  -9.892 -14.926
  275   2HD   ARG  37          1HD       ARG  37  -0.428  -9.265 -14.791
  276    HE   ARG  37           HE       ARG  37   0.382  -8.037 -17.004
  277   1HH1  ARG  37          1HH1      ARG  37   0.754 -11.378 -16.025
  278   2HH1  ARG  37          2HH1      ARG  37   0.708 -12.006 -17.643
  279   1HH2  ARG  37          1HH2      ARG  37   0.292  -8.852 -19.144
  280   2HH2  ARG  37          2HH2      ARG  37   0.442 -10.563 -19.422
  281    H    VAL  38           H        VAL  38   2.899  -5.480 -14.065
  282    HA   VAL  38           HA       VAL  38   5.432  -6.721 -13.561
  283    HB   VAL  38           HB       VAL  38   4.833  -4.258 -15.215
  284   1HG1  VAL  38          1HG1      VAL  38   7.188  -4.421 -14.638
  285   2HG1  VAL  38          2HG1      VAL  38   6.940  -4.760 -16.351
  286   3HG1  VAL  38          3HG1      VAL  38   7.232  -6.084 -15.223
  287   1HG2  VAL  38          1HG2      VAL  38   5.050  -7.147 -16.054
  288   2HG2  VAL  38          2HG2      VAL  38   4.836  -5.769 -17.135
  289   3HG2  VAL  38          3HG2      VAL  38   3.568  -6.195 -15.983
  290    H    THR  39           H        THR  39   3.914  -3.654 -12.700
  291    HA   THR  39           HA       THR  39   6.151  -2.436 -11.504
  292    HB   THR  39           HB       THR  39   3.258  -2.139 -10.655
  293    HG1  THR  39           1HG      THR  39   4.743  -1.010 -12.807
  294   1HG2  THR  39          1HG2      THR  39   3.954   0.126  -9.993
  295   2HG2  THR  39          2HG2      THR  39   5.613  -0.254 -10.451
  296   3HG2  THR  39          3HG2      THR  39   4.851  -1.110  -9.111
  297    H    LEU  40           H        LEU  40   3.668  -4.619 -10.233
  298    HA   LEU  40           HA       LEU  40   4.609  -4.771  -7.582
  299   1HB   LEU  40          2HB       LEU  40   2.406  -5.598  -8.291
  300   2HB   LEU  40          1HB       LEU  40   3.174  -6.855  -9.240
  301    HG   LEU  40           HG       LEU  40   4.103  -7.818  -7.146
  302   1HD1  LEU  40          1HD1      LEU  40   2.327  -5.789  -5.801
  303   2HD1  LEU  40          2HD1      LEU  40   4.091  -5.782  -5.793
  304   3HD1  LEU  40          3HD1      LEU  40   3.208  -7.089  -5.003
  305   1HD2  LEU  40          1HD2      LEU  40   2.062  -8.717  -8.107
  306   2HD2  LEU  40          2HD2      LEU  40   1.105  -7.512  -7.244
  307   3HD2  LEU  40          3HD2      LEU  40   1.980  -8.752  -6.345
  308    H    LYS  41           H        LYS  41   5.319  -6.662 -10.473
  309    HA   LYS  41           HA       LYS  41   7.051  -8.569  -9.442
  310   1HB   LYS  41          2HB       LYS  41   6.131  -8.365 -11.803
  311   2HB   LYS  41          1HB       LYS  41   7.390  -7.182 -12.103
  312   1HG   LYS  41          2HG       LYS  41   9.067  -8.934 -11.500
  313   2HG   LYS  41          1HG       LYS  41   7.737 -10.094 -11.455
  314   1HD   LYS  41          2HD       LYS  41   7.196  -9.503 -13.800
  315   2HD   LYS  41          1HD       LYS  41   8.604  -8.440 -13.826
  316   1HE   LYS  41          2HE       LYS  41   9.292 -10.461 -14.831
  317   2HE   LYS  41          1HE       LYS  41   9.987 -10.455 -13.212
  318   1HZ   LYS  41          1HZ       LYS  41   9.087 -12.607 -13.671
  319   2HZ   LYS  41          2HZ       LYS  41   7.588 -11.955 -14.112
  320   3HZ   LYS  41          3HZ       LYS  41   8.105 -11.873 -12.498
  321    H    ASN  42           H        ASN  42   7.729  -5.300 -10.594
  322    HA   ASN  42           HA       ASN  42  10.485  -5.240 -10.326
  323   1HB   ASN  42          2HB       ASN  42   8.351  -3.156 -10.211
  324   2HB   ASN  42          1HB       ASN  42   9.979  -2.705  -9.722
  325   1HD2  ASN  42          1HD2      ASN  42  10.243  -1.319 -11.423
  326   2HD2  ASN  42          2HD2      ASN  42  10.463  -1.857 -13.051
  327    H    TRP  43           H        TRP  43   8.052  -4.365  -7.866
  328    HA   TRP  43           HA       TRP  43   9.889  -3.768  -5.818
  329   1HB   TRP  43          2HB       TRP  43   6.980  -4.503  -5.849
  330   2HB   TRP  43          1HB       TRP  43   7.838  -4.429  -4.315
  331    HD1  TRP  43           HD       TRP  43   9.533  -1.823  -5.957
  332    HE1  TRP  43           1HE      TRP  43   8.450   0.486  -5.584
  333    HE3  TRP  43           3HE      TRP  43   4.915  -3.333  -4.342
  334    HZ2  TRP  43           2HZ      TRP  43   5.977   1.512  -4.759
  335    HZ3  TRP  43           3HZ      TRP  43   3.244  -1.615  -3.799
  336    HH2  TRP  43           HH       TRP  43   3.765   0.760  -4.002
  337    H    ILE  44           H        ILE  44   8.299  -6.774  -6.742
  338    HA   ILE  44           HA       ILE  44   9.097  -8.356  -4.567
  339    HB   ILE  44           HB       ILE  44   8.602  -9.219  -7.426
  340   1HG1  ILE  44          2HG1      ILE  44   6.722  -9.259  -5.055
  341   2HG1  ILE  44          1HG1      ILE  44   6.729  -7.997  -6.283
  342   1HG2  ILE  44          1HG2      ILE  44   9.813 -10.929  -6.203
  343   2HG2  ILE  44          2HG2      ILE  44   8.143 -11.437  -6.448
  344   3HG2  ILE  44          3HG2      ILE  44   8.656 -10.832  -4.874
  345   1HD1  ILE  44          1HD1      ILE  44   6.176  -9.642  -7.986
  346   2HD1  ILE  44          2HD1      ILE  44   4.981  -9.631  -6.688
  347   3HD1  ILE  44          3HD1      ILE  44   6.187 -10.915  -6.765
  348    H    ILE  45           H        ILE  45  10.639  -7.912  -7.741
  349    HA   ILE  45           HA       ILE  45  12.801  -9.673  -7.169
  350    HB   ILE  45           HB       ILE  45  12.620  -7.507  -9.271
  351   1HG1  ILE  45          2HG1      ILE  45  12.021 -10.468  -9.477
  352   2HG1  ILE  45          1HG1      ILE  45  10.802  -9.197  -9.394
  353   1HG2  ILE  45          1HG2      ILE  45  14.440  -9.910  -9.087
  354   2HG2  ILE  45          2HG2      ILE  45  14.918  -8.226  -8.873
  355   3HG2  ILE  45          3HG2      ILE  45  14.346  -8.788 -10.443
  356   1HD1  ILE  45          1HD1      ILE  45  11.641  -8.279 -11.500
  357   2HD1  ILE  45          2HD1      ILE  45  11.119  -9.953 -11.668
  358   3HD1  ILE  45          3HD1      ILE  45  12.839  -9.572 -11.582
  359    H    LYS  46           H        LYS  46  12.335  -6.201  -6.862
  360    HA   LYS  46           HA       LYS  46  15.132  -5.659  -6.504
  361   1HB   LYS  46          2HB       LYS  46  13.568  -4.067  -7.572
  362   2HB   LYS  46          1HB       LYS  46  12.750  -3.864  -6.030
  363   1HG   LYS  46          2HG       LYS  46  14.656  -2.820  -5.068
  364   2HG   LYS  46          1HG       LYS  46  15.660  -3.243  -6.459
  365   1HD   LYS  46          2HD       LYS  46  14.216  -1.834  -7.884
  366   2HD   LYS  46          1HD       LYS  46  13.307  -1.357  -6.450
  367   1HE   LYS  46          2HE       LYS  46  15.182  -0.240  -5.525
  368   2HE   LYS  46          1HE       LYS  46  16.274  -0.940  -6.721
  369   1HZ   LYS  46          1HZ       LYS  46  15.186   0.325  -8.440
  370   2HZ   LYS  46          2HZ       LYS  46  15.721   1.375  -7.219
  371   3HZ   LYS  46          3HZ       LYS  46  14.073   0.964  -7.331
  372    H    TYR  47           H        TYR  47  12.282  -5.627  -4.361
  373    HA   TYR  47           HA       TYR  47  14.015  -5.025  -2.104
  374   1HB   TYR  47          2HB       TYR  47  11.013  -5.270  -2.317
  375   2HB   TYR  47          1HB       TYR  47  11.876  -4.870  -0.832
  376    HD1  TYR  47           1HD      TYR  47  13.237  -2.771  -0.737
  377    HD2  TYR  47           2HD      TYR  47  10.608  -3.621  -3.972
  378    HE1  TYR  47           1HE      TYR  47  13.304  -0.407  -1.407
  379    HE2  TYR  47           2HE      TYR  47  10.666  -1.257  -4.646
  380    HH   TYR  47           HH       TYR  47  12.951   0.929  -3.487
  381    H    GLY  48           H        GLY  48  12.362  -7.740  -3.494
  382   1HA   GLY  48          2HA       GLY  48  12.806  -9.460  -1.222
  383   2HA   GLY  48          1HA       GLY  48  12.346  -9.968  -2.844
  384    H    SER  49           H        SER  49  15.107  -8.358  -1.304
  385    HA   SER  49           HA       SER  49  17.016  -9.303  -3.158
  386   1HB   SER  49          2HB       SER  49  17.493  -8.288  -0.348
  387   2HB   SER  49          1HB       SER  49  18.656  -8.313  -1.674
  388    HG   SER  49           HG       SER  49  16.761  -6.992  -2.710
  389    H    ASN  50           H        ASN  50  15.658 -10.671  -0.295
  390    HA   ASN  50           HA       ASN  50  17.718 -12.519   0.296
  391   1HB   ASN  50          2HB       ASN  50  14.760 -12.713   0.837
  392   2HB   ASN  50          1HB       ASN  50  15.975 -13.770   1.526
  393   1HD2  ASN  50          1HD2      ASN  50  17.271 -13.047   3.160
  394   2HD2  ASN  50          2HD2      ASN  50  16.985 -11.563   4.003
  395    H    HIS  51           H        HIS  51  18.345 -14.165  -0.824
  396    HA   HIS  51           HA       HIS  51  16.876 -15.111  -3.116
  397   1HB   HIS  51          2HB       HIS  51  19.451 -16.090  -1.859
  398   2HB   HIS  51          1HB       HIS  51  18.765 -16.733  -3.348
  399    HD1  HIS  51           1HD      HIS  51  19.144 -15.417  -5.485
  400    HD2  HIS  51           2HD      HIS  51  20.456 -13.431  -2.072
  401    HE1  HIS  51           1HE      HIS  51  20.460 -13.435  -6.309
  402    HE2  HIS  51           2HE      HIS  51  21.028 -12.127  -4.227
  403    H    ASN  52           H        ASN  52  17.554 -16.121   0.139
  404    HA   ASN  52           HA       ASN  52  15.669 -18.338  -0.164
  405   1HB   ASN  52          2HB       ASN  52  18.062 -17.933   1.563
  406   2HB   ASN  52          1HB       ASN  52  16.711 -18.829   2.237
  407   1HD2  ASN  52          1HD2      ASN  52  17.799 -20.740   2.326
  408   2HD2  ASN  52          2HD2      ASN  52  18.225 -21.657   0.914
  409    H    VAL  53           H        VAL  53  13.883 -16.968  -0.031
  410    HA   VAL  53           HA       VAL  53  13.413 -15.126   2.041
  411    HB   VAL  53           HB       VAL  53  11.366 -16.670   0.430
  412   1HG1  VAL  53          1HG1      VAL  53  11.115 -14.087   1.962
  413   2HG1  VAL  53          2HG1      VAL  53  10.410 -15.638   2.415
  414   3HG1  VAL  53          3HG1      VAL  53   9.863 -14.815   0.955
  415   1HG2  VAL  53          1HG2      VAL  53  12.589 -13.961  -0.092
  416   2HG2  VAL  53          2HG2      VAL  53  11.336 -14.744  -1.057
  417   3HG2  VAL  53          3HG2      VAL  53  12.954 -15.440  -0.977
  418    H    GLN  54           H        GLN  54  12.261 -18.462   1.622
  419    HA   GLN  54           HA       GLN  54  11.575 -20.053   3.072
  420   1HB   GLN  54          2HB       GLN  54  13.070 -18.564   5.230
  421   2HB   GLN  54          1HB       GLN  54  12.742 -20.287   5.126
  422   1HG   GLN  54          2HG       GLN  54  14.643 -18.692   3.432
  423   2HG   GLN  54          1HG       GLN  54  15.048 -19.915   4.633
  424   1HE2  GLN  54          1HE2      GLN  54  14.862 -22.071   4.112
  425   2HE2  GLN  54          2HE2      GLN  54  14.605 -22.619   2.488
  426    H    GLY  55           H        GLY  55  11.239 -19.350   6.039
  427   1HA   GLY  55          2HA       GLY  55   8.470 -18.733   5.836
  428   2HA   GLY  55          1HA       GLY  55   9.371 -18.944   7.325
  429    H    THR  56           H        THR  56  11.285 -16.878   6.690
  430    HA   THR  56           HA       THR  56  11.632 -14.788   7.486
  431    HB   THR  56           HB       THR  56  10.121 -13.058   6.190
  432    HG1  THR  56           1HG      THR  56   8.908 -15.100   5.399
  433   1HG2  THR  56          1HG2      THR  56  12.244 -14.744   4.869
  434   2HG2  THR  56          2HG2      THR  56  12.522 -13.337   5.896
  435   3HG2  THR  56          3HG2      THR  56  11.719 -13.145   4.339
  436    H    THR  57           H        THR  57  11.018 -14.768   9.612
  437    HA   THR  57           HA       THR  57   8.270 -14.119  10.274
  438    HB   THR  57           HB       THR  57   9.193 -14.183  12.663
  439    HG1  THR  57           1HG      THR  57  11.228 -14.768  12.954
  440   1HG2  THR  57          1HG2      THR  57   9.162 -16.625  12.725
  441   2HG2  THR  57          2HG2      THR  57   9.368 -16.681  10.974
  442   3HG2  THR  57          3HG2      THR  57   7.892 -16.008  11.668
  443    HA   PRO  58           HA       PRO  58   9.519  -9.795  10.361
  444   1HB   PRO  58          2HB       PRO  58   6.735  -9.112  10.286
  445   2HB   PRO  58          1HB       PRO  58   7.913  -9.002   8.979
  446   1HG   PRO  58          2HG       PRO  58   5.776 -10.743   9.015
  447   2HG   PRO  58          1HG       PRO  58   7.250 -10.982   8.060
  448   1HD   PRO  58          2HD       PRO  58   6.476 -12.186  10.694
  449   2HD   PRO  58          1HD       PRO  58   7.305 -12.935   9.309
  450    H    SER  59           H        SER  59   9.967  -8.764  12.187
  451    HA   SER  59           HA       SER  59   9.002  -9.503  14.698
  452   1HB   SER  59          2HB       SER  59  10.292  -6.875  13.936
  453   2HB   SER  59          1HB       SER  59  10.248  -7.605  15.546
  454    HG   SER  59           HG       SER  59  12.235  -7.953  14.317
  455    H    ALA  60           H        ALA  60   7.684  -7.295  12.395
  456    HA   ALA  60           HA       ALA  60   6.092  -5.843  14.334
  457   1HB   ALA  60          1HB       ALA  60   6.030  -5.727  11.321
  458   2HB   ALA  60          2HB       ALA  60   7.023  -4.707  12.360
  459   3HB   ALA  60          3HB       ALA  60   5.265  -4.586  12.430
  460    H    ALA  61           H        ALA  61   5.805  -8.717  12.518
  461    HA   ALA  61           HA       ALA  61   2.928  -8.499  12.160
  462   1HB   ALA  61          1HB       ALA  61   4.781 -10.737  11.362
  463   2HB   ALA  61          2HB       ALA  61   4.286  -9.397  10.329
  464   3HB   ALA  61          3HB       ALA  61   3.089 -10.562  10.896
  465    H    VAL  62           H        VAL  62   4.555  -9.092  14.804
  466    HA   VAL  62           HA       VAL  62   3.794 -11.626  15.715
  467    HB   VAL  62           HB       VAL  62   4.207  -9.114  17.347
  468   1HG1  VAL  62          1HG1      VAL  62   3.026 -10.814  18.625
  469   2HG1  VAL  62          2HG1      VAL  62   4.681 -10.637  19.206
  470   3HG1  VAL  62          3HG1      VAL  62   4.248 -12.008  18.188
  471   1HG2  VAL  62          1HG2      VAL  62   6.477  -9.972  17.693
  472   2HG2  VAL  62          2HG2      VAL  62   6.153  -9.660  15.988
  473   3HG2  VAL  62          3HG2      VAL  62   6.133 -11.313  16.602
  474    H    SER  63           H        SER  63   2.204  -8.507  16.126
  475    HA   SER  63           HA       SER  63  -0.137  -9.727  17.303
  476   1HB   SER  63          2HB       SER  63   0.414  -6.866  16.476
  477   2HB   SER  63          1HB       SER  63  -0.997  -7.412  17.380
  478    HG   SER  63           HG       SER  63   0.438  -8.128  19.028
  479    H    GLU  64           H        GLU  64   0.905  -8.618  14.187
  480    HA   GLU  64           HA       GLU  64  -1.656  -8.340  12.989
  481   1HB   GLU  64          2HB       GLU  64   0.763  -7.525  12.256
  482   2HB   GLU  64          1HB       GLU  64   0.744  -9.040  11.366
  483   1HG   GLU  64          2HG       GLU  64  -0.010  -7.402   9.872
  484   2HG   GLU  64          1HG       GLU  64  -1.444  -8.296  10.377
  485    H    ALA  65           H        ALA  65   0.377 -10.982  13.700
  486    HA   ALA  65           HA       ALA  65  -0.294 -12.861  11.779
  487   1HB   ALA  65          1HB       ALA  65   0.476 -14.534  13.353
  488   2HB   ALA  65          2HB       ALA  65   0.352 -13.377  14.677
  489   3HB   ALA  65          3HB       ALA  65   1.535 -13.124  13.394
  490    H    GLU  66           H        GLU  66  -2.241 -11.642  14.373
  491    HA   GLU  66           HA       GLU  66  -3.803 -13.924  14.868
  492   1HB   GLU  66          2HB       GLU  66  -3.683 -11.676  16.169
  493   2HB   GLU  66          1HB       GLU  66  -4.944 -11.164  15.061
  494   1HG   GLU  66          2HG       GLU  66  -6.382 -12.946  15.762
  495   2HG   GLU  66          1HG       GLU  66  -5.111 -13.625  16.774
  496    H    GLN  67           H        GLN  67  -4.458 -11.145  12.714
  497    HA   GLN  67           HA       GLN  67  -6.814 -12.340  11.635
  498   1HB   GLN  67          2HB       GLN  67  -6.783 -10.547  10.003
  499   2HB   GLN  67          1HB       GLN  67  -6.449  -9.904  11.604
  500   1HG   GLN  67          2HG       GLN  67  -3.993 -10.052  10.982
  501   2HG   GLN  67          1HG       GLN  67  -4.546 -10.319   9.329
  502   1HE2  GLN  67          1HE2      GLN  67  -4.387  -8.084  11.966
  503   2HE2  GLN  67          2HE2      GLN  67  -4.745  -6.664  11.053
  504    H    ILE  68           H        ILE  68  -3.431 -12.523  10.945
  505    HA   ILE  68           HA       ILE  68  -3.568 -13.688   8.366
  506    HB   ILE  68           HB       ILE  68  -1.473 -13.965  10.533
  507   1HG1  ILE  68          2HG1      ILE  68  -1.748 -11.681   9.733
  508   2HG1  ILE  68          1HG1      ILE  68  -0.218 -12.341   9.169
  509   1HG2  ILE  68          1HG2      ILE  68  -1.284 -14.738   7.625
  510   2HG2  ILE  68          2HG2      ILE  68  -1.348 -15.853   8.990
  511   3HG2  ILE  68          3HG2      ILE  68   0.034 -14.774   8.796
  512   1HD1  ILE  68          1HD1      ILE  68  -1.278 -11.060   7.427
  513   2HD1  ILE  68          2HD1      ILE  68  -2.735 -12.045   7.553
  514   3HD1  ILE  68          3HD1      ILE  68  -1.231 -12.765   6.975
  515    H    ARG  69           H        ARG  69  -3.571 -15.023  11.634
  516    HA   ARG  69           HA       ARG  69  -3.689 -17.746  11.050
  517   1HB   ARG  69          2HB       ARG  69  -3.373 -16.992  13.311
  518   2HB   ARG  69          1HB       ARG  69  -4.903 -16.133  13.298
  519   1HG   ARG  69          2HG       ARG  69  -6.070 -18.311  13.126
  520   2HG   ARG  69          1HG       ARG  69  -4.507 -19.118  13.284
  521   1HD   ARG  69          2HD       ARG  69  -4.172 -18.128  15.458
  522   2HD   ARG  69          1HD       ARG  69  -5.651 -17.185  15.293
  523    HE   ARG  69           HE       ARG  69  -6.119 -20.002  15.079
  524   1HH1  ARG  69          1HH1      ARG  69  -5.659 -17.381  17.368
  525   2HH1  ARG  69          2HH1      ARG  69  -6.521 -18.185  18.645
  526   1HH2  ARG  69          1HH2      ARG  69  -7.247 -21.049  16.752
  527   2HH2  ARG  69          2HH2      ARG  69  -7.426 -20.253  18.295
  528    H    GLN  70           H        GLN  70  -6.245 -15.323  11.178
  529    HA   GLN  70           HA       GLN  70  -8.392 -17.128  10.731
  530   1HB   GLN  70          2HB       GLN  70  -8.021 -14.390  11.331
  531   2HB   GLN  70          1HB       GLN  70  -8.936 -14.453   9.843
  532   1HG   GLN  70          2HG       GLN  70  -9.703 -15.912  12.359
  533   2HG   GLN  70          1HG       GLN  70 -10.303 -14.318  11.921
  534   1HE2  GLN  70          1HE2      GLN  70 -12.423 -14.979  11.847
  535   2HE2  GLN  70          2HE2      GLN  70 -13.048 -16.001  10.593
  536    H    LEU  71           H        LEU  71  -6.427 -15.014   8.686
  537    HA   LEU  71           HA       LEU  71  -7.787 -15.389   6.262
  538   1HB   LEU  71          2HB       LEU  71  -6.124 -13.627   6.623
  539   2HB   LEU  71          1HB       LEU  71  -4.857 -14.830   6.747
  540    HG   LEU  71           HG       LEU  71  -5.301 -15.472   4.380
  541   1HD1  LEU  71          1HD1      LEU  71  -7.085 -13.042   4.412
  542   2HD1  LEU  71          2HD1      LEU  71  -7.614 -14.716   4.234
  543   3HD1  LEU  71          3HD1      LEU  71  -6.619 -13.967   2.986
  544   1HD2  LEU  71          1HD2      LEU  71  -3.491 -13.956   4.933
  545   2HD2  LEU  71          2HD2      LEU  71  -4.600 -12.585   4.889
  546   3HD2  LEU  71          3HD2      LEU  71  -4.244 -13.480   3.411
  547    H    LYS  72           H        LYS  72  -5.018 -17.122   7.647
  548    HA   LYS  72           HA       LYS  72  -4.700 -18.938   5.500
  549   1HB   LYS  72          2HB       LYS  72  -2.858 -18.653   6.970
  550   2HB   LYS  72          1HB       LYS  72  -3.838 -19.004   8.388
  551   1HG   LYS  72          2HG       LYS  72  -4.103 -21.333   7.541
  552   2HG   LYS  72          1HG       LYS  72  -2.961 -20.938   6.256
  553   1HD   LYS  72          2HD       LYS  72  -1.197 -20.611   7.795
  554   2HD   LYS  72          1HD       LYS  72  -2.305 -20.597   9.170
  555   1HE   LYS  72          2HE       LYS  72  -1.832 -22.979   7.383
  556   2HE   LYS  72          1HE       LYS  72  -1.030 -22.717   8.932
  557   1HZ   LYS  72          1HZ       LYS  72  -3.035 -24.193   9.000
  558   2HZ   LYS  72          2HZ       LYS  72  -3.983 -22.830   8.647
  559   3HZ   LYS  72          3HZ       LYS  72  -3.071 -22.882  10.076
  560    H    LYS  73           H        LYS  73  -6.711 -18.910   8.325
  561    HA   LYS  73           HA       LYS  73  -8.424 -20.195   9.040
  562   1HB   LYS  73          2HB       LYS  73  -8.027 -21.742   6.472
  563   2HB   LYS  73          1HB       LYS  73  -9.331 -22.023   7.619
  564   1HG   LYS  73          2HG       LYS  73  -8.846 -19.462   6.112
  565   2HG   LYS  73          1HG       LYS  73 -10.057 -20.681   5.711
  566   1HD   LYS  73          2HD       LYS  73 -11.173 -20.298   7.840
  567   2HD   LYS  73          1HD       LYS  73  -9.931 -19.131   8.299
  568   1HE   LYS  73          2HE       LYS  73 -10.573 -17.728   6.386
  569   2HE   LYS  73          1HE       LYS  73 -11.839 -18.884   5.977
  570   1HZ   LYS  73          1HZ       LYS  73 -11.656 -17.329   8.500
  571   2HZ   LYS  73          2HZ       LYS  73 -12.866 -18.458   8.128
  572   3HZ   LYS  73          3HZ       LYS  73 -12.729 -17.029   7.220
  573    H    GLU  74           H        GLU  74  -8.266 -21.509  10.683
  574    HA   GLU  74           HA       GLU  74  -6.048 -23.413  10.792
  575   1HB   GLU  74          2HB       GLU  74  -6.444 -23.438  13.195
  576   2HB   GLU  74          1HB       GLU  74  -6.300 -21.781  12.623
  577   1HG   GLU  74          2HG       GLU  74  -8.803 -21.692  12.558
  578   2HG   GLU  74          1HG       GLU  74  -8.806 -23.249  13.385
  579    H    ASN  75           H        ASN  75  -9.367 -23.328  10.216
  580    HA   ASN  75           HA       ASN  75  -9.935 -25.946  11.341
  581   1HB   ASN  75          2HB       ASN  75 -11.507 -23.854  11.288
  582   2HB   ASN  75          1HB       ASN  75 -11.852 -24.368   9.643
  583   1HD2  ASN  75          1HD2      ASN  75 -13.612 -24.206  11.951
  584   2HD2  ASN  75          2HD2      ASN  75 -14.262 -25.792  12.173
  585    H    ALA  76           H        ALA  76 -11.322 -27.383   9.771
  586    HA   ALA  76           HA       ALA  76  -9.425 -28.285   7.873
  587   1HB   ALA  76          1HB       ALA  76 -12.209 -29.308   8.348
  588   2HB   ALA  76          2HB       ALA  76 -10.787 -29.775   9.278
  589   3HB   ALA  76          3HB       ALA  76 -10.882 -30.165   7.560
  590    H    LEU  77           H        LEU  77 -11.926 -26.040   7.551
  591    HA   LEU  77           HA       LEU  77 -13.142 -26.734   5.152
  592   1HB   LEU  77          2HB       LEU  77 -14.027 -24.565   5.089
  593   2HB   LEU  77          1HB       LEU  77 -13.870 -24.960   6.782
  594    HG   LEU  77           HG       LEU  77 -11.814 -23.308   5.331
  595   1HD1  LEU  77          1HD1      LEU  77 -12.935 -21.328   6.243
  596   2HD1  LEU  77          2HD1      LEU  77 -14.249 -22.345   6.836
  597   3HD1  LEU  77          3HD1      LEU  77 -13.966 -22.189   5.101
  598   1HD2  LEU  77          1HD2      LEU  77 -11.241 -22.547   7.562
  599   2HD2  LEU  77          2HD2      LEU  77 -11.147 -24.306   7.472
  600   3HD2  LEU  77          3HD2      LEU  77 -12.529 -23.535   8.251
  601    H    GLN  78           H        GLN  78 -10.016 -25.348   5.703
  602    HA   GLN  78           HA       GLN  78  -9.549 -24.013   3.302
  603   1HB   GLN  78          2HB       GLN  78  -8.060 -23.935   5.269
  604   2HB   GLN  78          1HB       GLN  78  -7.582 -25.599   4.965
  605   1HG   GLN  78          2HG       GLN  78  -6.796 -24.786   2.688
  606   2HG   GLN  78          1HG       GLN  78  -6.977 -23.157   3.338
  607   1HE2  GLN  78          1HE2      GLN  78  -5.614 -22.476   5.014
  608   2HE2  GLN  78          2HE2      GLN  78  -4.128 -23.295   5.342
  609    H    ARG  79           H        ARG  79  -9.691 -27.405   3.981
  610    HA   ARG  79           HA       ARG  79  -8.068 -28.299   1.815
  611   1HB   ARG  79          2HB       ARG  79 -10.135 -29.777   3.441
  612   2HB   ARG  79          1HB       ARG  79  -8.968 -30.517   2.356
  613   1HG   ARG  79          2HG       ARG  79  -7.138 -29.756   3.735
  614   2HG   ARG  79          1HG       ARG  79  -8.260 -28.896   4.793
  615   1HD   ARG  79          2HD       ARG  79  -8.071 -31.870   4.359
  616   2HD   ARG  79          1HD       ARG  79  -7.656 -30.978   5.823
  617    HE   ARG  79           HE       ARG  79 -10.255 -30.346   5.459
  618   1HH1  ARG  79          1HH1      ARG  79  -8.529 -33.389   5.558
  619   2HH1  ARG  79          2HH1      ARG  79  -9.889 -34.298   6.152
  620   1HH2  ARG  79          1HH2      ARG  79 -12.054 -31.529   6.254
  621   2HH2  ARG  79          2HH2      ARG  79 -11.889 -33.236   6.562
  622    H    ALA  80           H        ALA  80 -11.244 -27.154   1.967
  623    HA   ALA  80           HA       ALA  80 -12.493 -28.679  -0.043
  624   1HB   ALA  80          1HB       ALA  80 -13.731 -27.230   1.493
  625   2HB   ALA  80          2HB       ALA  80 -14.120 -26.883  -0.191
  626   3HB   ALA  80          3HB       ALA  80 -13.043 -25.810   0.705
  627    H    ARG  81           H        ARG  81 -10.071 -26.286  -0.223
  628    HA   ARG  81           HA       ARG  81 -10.620 -25.314  -2.849
  629   1HB   ARG  81          2HB       ARG  81  -8.055 -25.268  -1.268
  630   2HB   ARG  81          1HB       ARG  81  -8.381 -24.333  -2.714
  631   1HG   ARG  81          2HG       ARG  81 -10.157 -23.133  -1.532
  632   2HG   ARG  81          1HG       ARG  81  -9.813 -24.075  -0.078
  633   1HD   ARG  81          2HD       ARG  81  -8.028 -22.093  -1.469
  634   2HD   ARG  81          1HD       ARG  81  -8.691 -21.996   0.161
  635    HE   ARG  81           HE       ARG  81  -7.178 -24.303   0.102
  636   1HH1  ARG  81          1HH1      ARG  81  -6.617 -20.879  -0.377
  637   2HH1  ARG  81          2HH1      ARG  81  -4.949 -20.962   0.133
  638   1HH2  ARG  81          1HH2      ARG  81  -4.981 -24.399   0.756
  639   2HH2  ARG  81          2HH2      ARG  81  -4.038 -22.939   0.778
  640    H    THR  82           H        THR  82  -8.952 -27.998  -1.546
  641    HA   THR  82           HA       THR  82  -7.277 -28.722  -3.652
  642    HB   THR  82           HB       THR  82  -8.714 -30.566  -1.732
  643    HG1  THR  82           1HG      THR  82  -6.120 -30.139  -1.160
  644   1HG2  THR  82          1HG2      THR  82  -6.179 -30.972  -3.330
  645   2HG2  THR  82          2HG2      THR  82  -7.733 -31.735  -3.663
  646   3HG2  THR  82          3HG2      THR  82  -6.868 -32.110  -2.174
  647    H    ARG  83           H        ARG  83 -10.125 -30.611  -2.904
  648    HA   ARG  83           HA       ARG  83 -10.646 -31.630  -5.410
  649   1HB   ARG  83          2HB       ARG  83 -11.763 -32.522  -3.495
  650   2HB   ARG  83          1HB       ARG  83 -12.488 -30.969  -3.125
  651   1HG   ARG  83          2HG       ARG  83 -13.907 -31.123  -5.076
  652   2HG   ARG  83          1HG       ARG  83 -13.144 -32.649  -5.533
  653   1HD   ARG  83          2HD       ARG  83 -14.092 -33.800  -3.748
  654   2HD   ARG  83          1HD       ARG  83 -14.398 -32.323  -2.834
  655    HE   ARG  83           HE       ARG  83 -16.007 -31.969  -4.932
  656   1HH1  ARG  83          1HH1      ARG  83 -15.494 -34.793  -2.914
  657   2HH1  ARG  83          2HH1      ARG  83 -17.137 -35.342  -3.044
  658   1HH2  ARG  83          1HH2      ARG  83 -18.184 -32.674  -5.065
  659   2HH2  ARG  83          2HH2      ARG  83 -18.662 -34.138  -4.260
  660    H    HIS  84           H        HIS  84 -11.423 -30.844  -7.241
  661    HA   HIS  84           HA       HIS  84 -12.563 -28.127  -7.253
  662   1HB   HIS  84          2HB       HIS  84 -10.527 -29.422  -9.007
  663   2HB   HIS  84          1HB       HIS  84 -11.633 -28.271  -9.743
  664    HD1  HIS  84           1HD      HIS  84  -8.953 -28.461  -7.077
  665    HD2  HIS  84           2HD      HIS  84 -11.059 -25.632  -9.278
  666    HE1  HIS  84           1HE      HIS  84  -7.796 -26.270  -6.651
  667    HE2  HIS  84           2HE      HIS  84  -8.994 -24.597  -8.109
  668    HA   PRO  85           HA       PRO  85 -16.024 -29.790  -9.525
  669   1HB   PRO  85          2HB       PRO  85 -16.234 -27.327 -11.074
  670   2HB   PRO  85          1HB       PRO  85 -17.304 -27.940  -9.812
  671   1HG   PRO  85          2HG       PRO  85 -15.748 -25.757  -9.461
  672   2HG   PRO  85          1HG       PRO  85 -16.165 -26.857  -8.135
  673   1HD   PRO  85          2HD       PRO  85 -13.640 -26.710  -9.748
  674   2HD   PRO  85          1HD       PRO  85 -13.847 -26.912  -7.993
  675    H    ALA  86           H        ALA  86 -16.847 -29.128 -12.087
  676    HA   ALA  86           HA       ALA  86 -15.161 -30.805 -13.653
  677   1HB   ALA  86          1HB       ALA  86 -17.505 -29.102 -14.485
  678   2HB   ALA  86          2HB       ALA  86 -17.579 -30.776 -13.939
  679   3HB   ALA  86          3HB       ALA  86 -16.765 -30.379 -15.453
  680    H    GLU  87           H        GLU  87 -14.684 -30.056 -16.015
  681    HA   GLU  87           HA       GLU  87 -12.596 -28.133 -15.715
  682   1HB   GLU  87          2HB       GLU  87 -12.073 -28.608 -18.068
  683   2HB   GLU  87          1HB       GLU  87 -12.259 -30.082 -17.133
  684   1HG   GLU  87          2HG       GLU  87 -14.481 -28.946 -18.803
  685   2HG   GLU  87          1HG       GLU  87 -13.266 -30.041 -19.459
  686    H    SER  88           H        SER  88 -15.850 -28.002 -16.878
  687    HA   SER  88           HA       SER  88 -15.657 -25.693 -18.478
  688   1HB   SER  88          2HB       SER  88 -18.034 -26.632 -16.855
  689   2HB   SER  88          1HB       SER  88 -18.075 -25.535 -18.235
  690    HG   SER  88           HG       SER  88 -17.789 -27.161 -19.581
  691    H    CYS  89           H        CYS  89 -15.721 -26.143 -15.027
  692    HA   CYS  89           HA       CYS  89 -16.548 -23.533 -14.307
  693   1HB   CYS  89          2HB       CYS  89 -16.616 -25.414 -12.733
  694   2HB   CYS  89          1HB       CYS  89 -14.863 -25.523 -12.776
  695    HG   CYS  89           HG       CYS  89 -16.301 -22.611 -11.764
  696    H    LEU  90           H        LEU  90 -13.500 -24.951 -15.154
  697    HA   LEU  90           HA       LEU  90 -11.888 -22.754 -14.237
  698   1HB   LEU  90          2HB       LEU  90 -11.023 -24.835 -16.224
  699   2HB   LEU  90          1HB       LEU  90 -10.041 -23.960 -15.062
  700    HG   LEU  90           HG       LEU  90 -12.087 -26.062 -14.368
  701   1HD1  LEU  90          1HD1      LEU  90 -10.172 -27.017 -15.525
  702   2HD1  LEU  90          2HD1      LEU  90 -10.150 -27.458 -13.819
  703   3HD1  LEU  90          3HD1      LEU  90  -9.074 -26.196 -14.417
  704   1HD2  LEU  90          1HD2      LEU  90 -11.132 -25.942 -12.122
  705   2HD2  LEU  90          2HD2      LEU  90 -11.791 -24.380 -12.611
  706   3HD2  LEU  90          3HD2      LEU  90 -10.048 -24.652 -12.642
  707    H    GLU  91           H        GLU  91 -13.622 -23.575 -17.060
  708    HA   GLU  91           HA       GLU  91 -12.189 -22.116 -19.007
  709   1HB   GLU  91          2HB       GLU  91 -13.824 -23.802 -19.624
  710   2HB   GLU  91          1HB       GLU  91 -15.113 -22.867 -18.878
  711   1HG   GLU  91          2HG       GLU  91 -14.577 -21.039 -20.527
  712   2HG   GLU  91          1HG       GLU  91 -13.539 -22.204 -21.346
  713    H    HIS  92           H        HIS  92 -14.559 -21.158 -16.632
  714    HA   HIS  92           HA       HIS  92 -15.469 -18.832 -17.956
  715   1HB   HIS  92          2HB       HIS  92 -15.610 -19.640 -15.051
  716   2HB   HIS  92          1HB       HIS  92 -16.359 -18.178 -15.686
  717    HD1  HIS  92           1HD      HIS  92 -18.367 -18.517 -17.365
  718    HD2  HIS  92           2HD      HIS  92 -16.962 -21.983 -15.556
  719    HE1  HIS  92           1HE      HIS  92 -20.118 -20.261 -17.795
  720    HE2  HIS  92           2HE      HIS  92 -19.067 -22.400 -16.992
  721    H    HIS  93           H        HIS  93 -14.201 -17.280 -18.518
  722    HA   HIS  93           HA       HIS  93 -12.288 -16.206 -16.562
  723   1HB   HIS  93          2HB       HIS  93 -10.922 -15.421 -18.470
  724   2HB   HIS  93          1HB       HIS  93 -11.073 -17.168 -18.436
  725    HD1  HIS  93           1HD      HIS  93 -10.602 -14.977 -20.909
  726    HD2  HIS  93           2HD      HIS  93 -13.830 -17.494 -20.174
  727    HE1  HIS  93           1HE      HIS  93 -11.737 -15.295 -23.130
  728    HE2  HIS  93           2HE      HIS  93 -13.538 -17.008 -22.697
  729    H    HIS  94           H        HIS  94 -12.392 -14.088 -16.082
  730    HA   HIS  94           HA       HIS  94 -14.818 -12.751 -16.657
  731   1HB   HIS  94          2HB       HIS  94 -12.305 -11.947 -15.227
  732   2HB   HIS  94          1HB       HIS  94 -13.579 -10.771 -15.535
  733    HD1  HIS  94           1HD      HIS  94 -12.483 -12.900 -12.949
  734    HD2  HIS  94           2HD      HIS  94 -16.214 -11.996 -14.555
  735    HE1  HIS  94           1HE      HIS  94 -14.154 -13.517 -11.176
  736    HE2  HIS  94           2HE      HIS  94 -16.413 -13.087 -12.217
  737    H    HIS  95           H        HIS  95 -15.372 -11.292 -18.109
  738    HA   HIS  95           HA       HIS  95 -13.442 -10.544 -20.165
  739   1HB   HIS  95          2HB       HIS  95 -15.646 -11.392 -20.863
  740   2HB   HIS  95          1HB       HIS  95 -16.438 -10.114 -19.952
  741    HD1  HIS  95           1HD      HIS  95 -16.971  -8.032 -21.197
  742    HD2  HIS  95           2HD      HIS  95 -14.102 -10.338 -23.143
  743    HE1  HIS  95           1HE      HIS  95 -16.617  -6.935 -23.429
  744    HE2  HIS  95           2HE      HIS  95 -14.729  -8.219 -24.493
  745    H    HIS  96           H        HIS  96 -14.279  -9.449 -17.233
  746    HA   HIS  96           HA       HIS  96 -14.392  -7.487 -16.109
  747   1HB   HIS  96          2HB       HIS  96 -12.125  -7.223 -17.266
  748   2HB   HIS  96          1HB       HIS  96 -12.954  -6.219 -18.450
  749    HD1  HIS  96           1HD      HIS  96 -12.815  -3.805 -17.956
  750    HD2  HIS  96           2HD      HIS  96 -12.615  -6.110 -14.497
  751    HE1  HIS  96           1HE      HIS  96 -12.450  -2.177 -16.070
  752    HE2  HIS  96           2HE      HIS  96 -12.156  -3.609 -14.014
  753    H    HIS  97           H        HIS  97 -16.644  -7.658 -16.490
  754    HA   HIS  97           HA       HIS  97 -18.702  -7.143 -17.243
  755   1HB   HIS  97          2HB       HIS  97 -18.217  -4.786 -16.960
  756   2HB   HIS  97          1HB       HIS  97 -17.324  -4.737 -18.476
  757    HD1  HIS  97           1HD      HIS  97 -20.873  -5.143 -17.179
  758    HD2  HIS  97           2HD      HIS  97 -18.849  -4.197 -20.693
  759    HE1  HIS  97           1HE      HIS  97 -22.647  -4.444 -18.826
  760    HE2  HIS  97           2HE      HIS  97 -21.407  -3.926 -20.962
  Start of MODEL   19
    1   1H    MET   1          1HT       MET   1  -7.884  12.841  -6.624
    2   2H    MET   1          2HT       MET   1  -7.211  13.800  -5.404
    3   3H    MET   1          3HT       MET   1  -8.024  12.362  -5.005
    4    HA   MET   1           HA       MET   1  -5.674  12.009  -4.839
    5   1HB   MET   1          2HB       MET   1  -6.851  10.735  -7.321
    6   2HB   MET   1          1HB       MET   1  -5.428  10.155  -6.468
    7   1HG   MET   1          2HG       MET   1  -6.770   9.662  -4.515
    8   2HG   MET   1          1HG       MET   1  -8.200  10.324  -5.306
    9   1HE   MET   1          1HE       MET   1  -9.042   6.518  -5.244
   10   2HE   MET   1          2HE       MET   1  -9.565   8.145  -4.807
   11   3HE   MET   1          3HE       MET   1  -8.176   7.416  -3.997
   12    HA   PRO   2           HA       PRO   2  -3.582  14.809  -7.756
   13   1HB   PRO   2          2HB       PRO   2  -1.381  14.516  -5.848
   14   2HB   PRO   2          1HB       PRO   2  -2.203  15.985  -6.383
   15   1HG   PRO   2          2HG       PRO   2  -2.503  14.994  -3.896
   16   2HG   PRO   2          1HG       PRO   2  -3.809  15.842  -4.743
   17   1HD   PRO   2          2HD       PRO   2  -3.407  12.902  -4.336
   18   2HD   PRO   2          1HD       PRO   2  -4.904  13.857  -4.268
   19    H    THR   3           H        THR   3  -1.840  12.351  -5.952
   20    HA   THR   3           HA       THR   3  -1.075  11.011  -8.430
   21    HB   THR   3           HB       THR   3   1.228  10.683  -7.197
   22    HG1  THR   3           1HG      THR   3   0.944  13.326  -6.374
   23   1HG2  THR   3          1HG2      THR   3   2.155  12.583  -8.441
   24   2HG2  THR   3          2HG2      THR   3   0.530  13.237  -8.650
   25   3HG2  THR   3          3HG2      THR   3   0.967  11.704  -9.403
   26    H    LYS   4           H        LYS   4  -0.579   8.764  -8.126
   27    HA   LYS   4           HA       LYS   4  -1.829   7.581  -5.857
   28   1HB   LYS   4          2HB       LYS   4  -2.044   6.638  -8.130
   29   2HB   LYS   4          1HB       LYS   4  -0.310   6.341  -8.152
   30   1HG   LYS   4          2HG       LYS   4  -0.766   5.005  -5.994
   31   2HG   LYS   4          1HG       LYS   4  -2.436   4.995  -6.567
   32   1HD   LYS   4          2HD       LYS   4  -0.034   4.036  -8.099
   33   2HD   LYS   4          1HD       LYS   4  -1.222   3.041  -7.285
   34   1HE   LYS   4          2HE       LYS   4  -2.971   3.874  -8.756
   35   2HE   LYS   4          1HE       LYS   4  -1.799   4.918  -9.561
   36   1HZ   LYS   4          1HZ       LYS   4  -2.112   2.970 -10.872
   37   2HZ   LYS   4          2HZ       LYS   4  -1.846   1.955  -9.546
   38   3HZ   LYS   4          3HZ       LYS   4  -0.569   2.874 -10.179
   39    H    THR   5           H        THR   5  -0.735   7.665  -4.084
   40    HA   THR   5           HA       THR   5   2.188   7.618  -4.123
   41    HB   THR   5           HB       THR   5   0.649   8.073  -1.615
   42    HG1  THR   5           1HG      THR   5   0.419   9.573  -3.923
   43   1HG2  THR   5          1HG2      THR   5   3.095   8.090  -1.574
   44   2HG2  THR   5          2HG2      THR   5   2.454   9.694  -1.213
   45   3HG2  THR   5          3HG2      THR   5   3.117   9.346  -2.812
   46    H    TYR   6           H        TYR   6   3.362   6.290  -2.746
   47    HA   TYR   6           HA       TYR   6   2.106   4.192  -1.251
   48   1HB   TYR   6          2HB       TYR   6   3.292   2.411  -2.476
   49   2HB   TYR   6          1HB       TYR   6   2.084   3.198  -3.474
   50    HD1  TYR   6           1HD      TYR   6   5.711   2.886  -2.837
   51    HD2  TYR   6           2HD      TYR   6   2.709   4.307  -5.496
   52    HE1  TYR   6           1HE      TYR   6   7.422   3.275  -4.552
   53    HE2  TYR   6           2HE      TYR   6   4.420   4.696  -7.221
   54    HH   TYR   6           HH       TYR   6   6.789   5.031  -7.434
   55    H    SER   7           H        SER   7   3.801   2.906  -0.099
   56    HA   SER   7           HA       SER   7   6.223   4.532   0.306
   57   1HB   SER   7          2HB       SER   7   4.986   2.698   2.361
   58   2HB   SER   7          1HB       SER   7   6.169   3.980   2.616
   59    HG   SER   7           HG       SER   7   3.402   4.146   2.210
   60    H    GLU   8           H        GLU   8   8.172   3.293   0.953
   61    HA   GLU   8           HA       GLU   8   8.573   0.903  -0.493
   62   1HB   GLU   8          2HB       GLU   8  10.153   1.813   1.919
   63   2HB   GLU   8          1HB       GLU   8  10.697   0.734   0.640
   64   1HG   GLU   8          2HG       GLU   8  10.348   2.662  -0.953
   65   2HG   GLU   8          1HG       GLU   8  10.159   3.680   0.472
   66    H    GLU   9           H        GLU   9   7.444   1.593   2.703
   67    HA   GLU   9           HA       GLU   9   7.373  -0.963   3.827
   68   1HB   GLU   9          2HB       GLU   9   6.856   1.041   5.098
   69   2HB   GLU   9          1HB       GLU   9   5.469   1.370   4.071
   70   1HG   GLU   9          2HG       GLU   9   4.354  -0.613   4.902
   71   2HG   GLU   9          1HG       GLU   9   5.757  -0.996   5.904
   72    H    PHE  10           H        PHE  10   5.050   0.741   1.761
   73    HA   PHE  10           HA       PHE  10   3.135  -1.308   1.574
   74   1HB   PHE  10          2HB       PHE  10   2.746   1.074   0.960
   75   2HB   PHE  10          1HB       PHE  10   3.773   0.848  -0.450
   76    HD1  PHE  10           1HD      PHE  10   0.634  -0.294   1.141
   77    HD2  PHE  10           2HD      PHE  10   2.898   0.028  -2.443
   78    HE1  PHE  10           1HE      PHE  10  -1.332  -0.999  -0.158
   79    HE2  PHE  10           2HE      PHE  10   0.941  -0.681  -3.753
   80    HZ   PHE  10           HZ       PHE  10  -1.181  -1.194  -2.609
   81    H    LYS  11           H        LYS  11   6.020  -0.552  -0.305
   82    HA   LYS  11           HA       LYS  11   5.768  -2.504  -2.302
   83   1HB   LYS  11          2HB       LYS  11   8.226  -1.332  -0.996
   84   2HB   LYS  11          1HB       LYS  11   8.280  -2.381  -2.403
   85   1HG   LYS  11          2HG       LYS  11   7.046  -0.751  -3.704
   86   2HG   LYS  11          1HG       LYS  11   6.885   0.290  -2.285
   87   1HD   LYS  11          2HD       LYS  11   9.237   0.670  -2.209
   88   2HD   LYS  11          1HD       LYS  11   9.538  -0.575  -3.416
   89   1HE   LYS  11          2HE       LYS  11   8.397   0.760  -5.096
   90   2HE   LYS  11          1HE       LYS  11   8.037   1.993  -3.889
   91   1HZ   LYS  11          1HZ       LYS  11  10.275   2.593  -3.725
   92   2HZ   LYS  11          2HZ       LYS  11  10.042   2.371  -5.387
   93   3HZ   LYS  11          3HZ       LYS  11  10.819   1.177  -4.475
   94    H    ARG  12           H        ARG  12   7.328  -2.635   0.890
   95    HA   ARG  12           HA       ARG  12   8.176  -5.309   0.732
   96   1HB   ARG  12          2HB       ARG  12   9.126  -3.835   2.376
   97   2HB   ARG  12          1HB       ARG  12   7.557  -3.553   3.113
   98   1HG   ARG  12          2HG       ARG  12   8.520  -6.350   3.031
   99   2HG   ARG  12          1HG       ARG  12   9.350  -5.233   4.118
  100   1HD   ARG  12          2HD       ARG  12   7.348  -4.741   5.286
  101   2HD   ARG  12          1HD       ARG  12   6.357  -5.539   4.066
  102    HE   ARG  12           HE       ARG  12   8.060  -7.480   5.070
  103   1HH1  ARG  12          1HH1      ARG  12   5.634  -5.326   6.387
  104   2HH1  ARG  12          2HH1      ARG  12   5.057  -6.478   7.553
  105   1HH2  ARG  12          1HH2      ARG  12   7.332  -8.983   6.625
  106   2HH2  ARG  12          2HH2      ARG  12   6.037  -8.558   7.705
  107    H    ASP  13           H        ASP  13   5.165  -3.873   1.917
  108    HA   ASP  13           HA       ASP  13   4.002  -6.223   2.932
  109   1HB   ASP  13          2HB       ASP  13   3.160  -3.852   3.256
  110   2HB   ASP  13          1HB       ASP  13   2.501  -3.940   1.629
  111    H    ALA  14           H        ALA  14   3.978  -4.785  -0.283
  112    HA   ALA  14           HA       ALA  14   2.245  -6.588  -1.542
  113   1HB   ALA  14          1HB       ALA  14   2.920  -4.455  -2.527
  114   2HB   ALA  14          2HB       ALA  14   3.218  -5.798  -3.630
  115   3HB   ALA  14          3HB       ALA  14   4.558  -5.070  -2.745
  116    H    VAL  15           H        VAL  15   5.721  -6.751  -0.928
  117    HA   VAL  15           HA       VAL  15   6.242  -9.062  -2.476
  118    HB   VAL  15           HB       VAL  15   7.668  -8.216   0.059
  119   1HG1  VAL  15          1HG1      VAL  15   8.571  -9.943  -2.246
  120   2HG1  VAL  15          2HG1      VAL  15   8.203 -10.489  -0.609
  121   3HG1  VAL  15          3HG1      VAL  15   9.582  -9.427  -0.896
  122   1HG2  VAL  15          1HG2      VAL  15   7.666  -6.364  -1.482
  123   2HG2  VAL  15          2HG2      VAL  15   8.174  -7.415  -2.800
  124   3HG2  VAL  15          3HG2      VAL  15   9.270  -7.097  -1.458
  125    H    ALA  16           H        ALA  16   5.283  -8.587   0.898
  126    HA   ALA  16           HA       ALA  16   5.314 -11.325   1.626
  127   1HB   ALA  16          1HB       ALA  16   3.998 -10.622   3.568
  128   2HB   ALA  16          2HB       ALA  16   3.744  -9.044   2.823
  129   3HB   ALA  16          3HB       ALA  16   5.369  -9.550   3.288
  130    H    LEU  17           H        LEU  17   2.964  -9.295   0.043
  131    HA   LEU  17           HA       LEU  17   0.722 -10.984   0.304
  132   1HB   LEU  17          2HB       LEU  17   1.475  -8.907  -1.741
  133   2HB   LEU  17          1HB       LEU  17  -0.032  -9.794  -1.828
  134    HG   LEU  17           HG       LEU  17   0.784  -8.070   0.512
  135   1HD1  LEU  17          1HD1      LEU  17  -0.844  -6.465  -0.335
  136   2HD1  LEU  17          2HD1      LEU  17  -1.124  -7.481  -1.745
  137   3HD1  LEU  17          3HD1      LEU  17   0.450  -6.726  -1.505
  138   1HD2  LEU  17          1HD2      LEU  17  -1.828  -9.382  -0.228
  139   2HD2  LEU  17          2HD2      LEU  17  -1.575  -8.296   1.140
  140   3HD2  LEU  17          3HD2      LEU  17  -0.761  -9.860   1.092
  141    H    TYR  18           H        TYR  18   3.433 -10.959  -1.951
  142    HA   TYR  18           HA       TYR  18   2.291 -12.902  -3.708
  143   1HB   TYR  18          2HB       TYR  18   4.094 -11.324  -4.410
  144   2HB   TYR  18          1HB       TYR  18   5.218 -12.207  -3.379
  145    HD1  TYR  18           1HD      TYR  18   2.822 -12.759  -6.186
  146    HD2  TYR  18           2HD      TYR  18   6.437 -13.971  -4.296
  147    HE1  TYR  18           1HE      TYR  18   3.249 -14.331  -8.026
  148    HE2  TYR  18           2HE      TYR  18   6.876 -15.541  -6.138
  149    HH   TYR  18           HH       TYR  18   5.095 -15.502  -9.070
  150    H    GLU  19           H        GLU  19   4.207 -13.042  -0.779
  151    HA   GLU  19           HA       GLU  19   4.806 -15.821  -0.951
  152   1HB   GLU  19          2HB       GLU  19   4.578 -14.039   1.486
  153   2HB   GLU  19          1HB       GLU  19   5.234 -15.670   1.491
  154   1HG   GLU  19          2HG       GLU  19   6.984 -14.910  -0.095
  155   2HG   GLU  19          1HG       GLU  19   6.364 -13.268   0.077
  156    H    ASN  20           H        ASN  20   2.002 -14.013  -0.215
  157    HA   ASN  20           HA       ASN  20   0.614 -16.413   0.773
  158   1HB   ASN  20          2HB       ASN  20   0.030 -13.472   1.181
  159   2HB   ASN  20          1HB       ASN  20  -1.099 -14.747   1.609
  160   1HD2  ASN  20          1HD2      ASN  20   1.880 -13.171   2.404
  161   2HD2  ASN  20          2HD2      ASN  20   2.083 -13.908   3.957
  162    H    SER  21           H        SER  21   1.191 -15.963  -1.968
  163    HA   SER  21           HA       SER  21  -1.122 -14.866  -3.273
  164   1HB   SER  21          2HB       SER  21   0.041 -15.703  -5.341
  165   2HB   SER  21          1HB       SER  21   0.991 -14.600  -4.347
  166    HG   SER  21           HG       SER  21   2.389 -16.119  -3.991
  167    H    ASP  22           H        ASP  22  -0.441 -17.774  -1.833
  168    HA   ASP  22           HA       ASP  22  -1.289 -19.779  -3.479
  169   1HB   ASP  22          2HB       ASP  22  -0.402 -20.035  -1.143
  170   2HB   ASP  22          1HB       ASP  22  -2.013 -19.634  -0.555
  171    H    GLY  23           H        GLY  23  -3.357 -17.575  -1.659
  172   1HA   GLY  23          2HA       GLY  23  -5.705 -18.867  -2.888
  173   2HA   GLY  23          1HA       GLY  23  -5.742 -17.894  -1.427
  174    H    ALA  24           H        ALA  24  -3.718 -16.391  -3.579
  175    HA   ALA  24           HA       ALA  24  -5.849 -14.861  -4.863
  176   1HB   ALA  24          1HB       ALA  24  -5.441 -13.755  -2.701
  177   2HB   ALA  24          2HB       ALA  24  -5.001 -12.739  -4.071
  178   3HB   ALA  24          3HB       ALA  24  -3.744 -13.556  -3.146
  179    H    SER  25           H        SER  25  -5.336 -14.820  -6.939
  180    HA   SER  25           HA       SER  25  -2.787 -15.470  -7.944
  181   1HB   SER  25          2HB       SER  25  -5.074 -14.090  -9.366
  182   2HB   SER  25          1HB       SER  25  -3.732 -14.940 -10.136
  183    HG   SER  25           HG       SER  25  -4.679 -16.678  -8.489
  184    H    LEU  26           H        LEU  26  -1.442 -14.116  -9.364
  185    HA   LEU  26           HA       LEU  26  -0.480 -11.870  -8.009
  186   1HB   LEU  26          2HB       LEU  26   0.819 -13.325  -9.554
  187   2HB   LEU  26          1HB       LEU  26  -0.026 -12.595 -10.902
  188    HG   LEU  26           HG       LEU  26   0.936 -10.395 -10.276
  189   1HD1  LEU  26          1HD1      LEU  26   2.503 -12.015  -8.272
  190   2HD1  LEU  26          2HD1      LEU  26   1.271 -10.808  -7.902
  191   3HD1  LEU  26          3HD1      LEU  26   2.778 -10.318  -8.675
  192   1HD2  LEU  26          1HD2      LEU  26   2.949 -12.598 -10.716
  193   2HD2  LEU  26          2HD2      LEU  26   3.201 -10.882 -11.039
  194   3HD2  LEU  26          3HD2      LEU  26   2.006 -11.787 -11.965
  195    H    GLN  27           H        GLN  27  -2.550 -12.137 -10.867
  196    HA   GLN  27           HA       GLN  27  -2.697  -9.386 -11.453
  197   1HB   GLN  27          2HB       GLN  27  -3.467 -11.240 -12.966
  198   2HB   GLN  27          1HB       GLN  27  -4.876 -11.430 -11.931
  199   1HG   GLN  27          2HG       GLN  27  -5.527 -10.116 -13.805
  200   2HG   GLN  27          1HG       GLN  27  -5.454  -9.052 -12.405
  201   1HE2  GLN  27          1HE2      GLN  27  -5.206  -7.231 -13.683
  202   2HE2  GLN  27          2HE2      GLN  27  -3.731  -6.871 -14.504
  203    H    GLN  28           H        GLN  28  -4.391 -11.383  -9.132
  204    HA   GLN  28           HA       GLN  28  -6.441  -9.498  -8.517
  205   1HB   GLN  28          2HB       GLN  28  -6.535 -11.980  -8.072
  206   2HB   GLN  28          1HB       GLN  28  -5.389 -11.739  -6.766
  207   1HG   GLN  28          2HG       GLN  28  -8.017 -10.299  -6.850
  208   2HG   GLN  28          1HG       GLN  28  -7.864 -11.921  -6.187
  209   1HE2  GLN  28          1HE2      GLN  28  -8.629  -9.437  -4.873
  210   2HE2  GLN  28          2HE2      GLN  28  -7.508  -9.217  -3.575
  211    H    ILE  29           H        ILE  29  -3.301 -10.306  -7.099
  212    HA   ILE  29           HA       ILE  29  -3.318  -8.556  -4.932
  213    HB   ILE  29           HB       ILE  29  -0.925  -9.259  -6.648
  214   1HG1  ILE  29          2HG1      ILE  29  -2.098 -11.274  -5.863
  215   2HG1  ILE  29          1HG1      ILE  29  -0.535 -11.095  -5.066
  216   1HG2  ILE  29          1HG2      ILE  29   0.374  -8.834  -4.612
  217   2HG2  ILE  29          2HG2      ILE  29  -1.100  -8.315  -3.795
  218   3HG2  ILE  29          3HG2      ILE  29  -0.483  -7.395  -5.167
  219   1HD1  ILE  29          1HD1      ILE  29  -1.668 -10.213  -3.082
  220   2HD1  ILE  29          2HD1      ILE  29  -2.251 -11.822  -3.506
  221   3HD1  ILE  29          3HD1      ILE  29  -3.225 -10.402  -3.889
  222    H    ALA  30           H        ALA  30  -2.162  -8.003  -8.246
  223    HA   ALA  30           HA       ALA  30  -1.513  -5.280  -7.863
  224   1HB   ALA  30          1HB       ALA  30  -0.586  -6.620  -9.683
  225   2HB   ALA  30          2HB       ALA  30  -1.388  -5.169 -10.294
  226   3HB   ALA  30          3HB       ALA  30  -2.189  -6.735 -10.411
  227    H    ASN  31           H        ASN  31  -4.461  -6.930  -8.710
  228    HA   ASN  31           HA       ASN  31  -5.884  -4.677  -9.709
  229   1HB   ASN  31          2HB       ASN  31  -6.354  -7.268  -9.923
  230   2HB   ASN  31          1HB       ASN  31  -7.273  -7.013  -8.442
  231   1HD2  ASN  31          1HD2      ASN  31  -7.144  -6.589 -11.823
  232   2HD2  ASN  31          2HD2      ASN  31  -8.701  -5.885 -12.031
  233    H    ASP  32           H        ASP  32  -5.820  -6.357  -6.598
  234    HA   ASP  32           HA       ASP  32  -7.811  -4.782  -5.346
  235   1HB   ASP  32          2HB       ASP  32  -7.099  -7.058  -4.602
  236   2HB   ASP  32          1HB       ASP  32  -5.586  -6.363  -4.037
  237    H    LEU  33           H        LEU  33  -4.286  -4.616  -5.376
  238    HA   LEU  33           HA       LEU  33  -4.140  -2.385  -3.599
  239   1HB   LEU  33          2HB       LEU  33  -2.210  -3.836  -5.356
  240   2HB   LEU  33          1HB       LEU  33  -1.758  -2.266  -4.727
  241    HG   LEU  33           HG       LEU  33  -1.996  -3.086  -2.437
  242   1HD1  LEU  33          1HD1      LEU  33  -3.768  -4.711  -2.747
  243   2HD1  LEU  33          2HD1      LEU  33  -2.363  -5.463  -1.990
  244   3HD1  LEU  33          3HD1      LEU  33  -2.690  -5.729  -3.703
  245   1HD2  LEU  33          1HD2      LEU  33  -0.109  -4.638  -2.430
  246   2HD2  LEU  33          2HD2      LEU  33   0.156  -3.300  -3.546
  247   3HD2  LEU  33          3HD2      LEU  33  -0.304  -4.885  -4.167
  248    H    GLY  34           H        GLY  34  -4.275  -2.792  -7.075
  249   1HA   GLY  34          2HA       GLY  34  -5.101  -1.180  -8.575
  250   2HA   GLY  34          1HA       GLY  34  -4.865   0.049  -7.342
  251    H    ILE  35           H        ILE  35  -2.536  -2.323  -8.536
  252    HA   ILE  35           HA       ILE  35  -0.929  -0.105  -9.616
  253    HB   ILE  35           HB       ILE  35   1.103  -1.320  -8.833
  254   1HG1  ILE  35          2HG1      ILE  35  -0.882  -2.897  -7.183
  255   2HG1  ILE  35          1HG1      ILE  35   0.060  -3.531  -8.528
  256   1HG2  ILE  35          1HG2      ILE  35   0.934  -0.564  -6.495
  257   2HG2  ILE  35          2HG2      ILE  35  -0.807  -0.367  -6.708
  258   3HG2  ILE  35          3HG2      ILE  35   0.315   0.623  -7.643
  259   1HD1  ILE  35          1HD1      ILE  35   1.202  -2.445  -5.966
  260   2HD1  ILE  35          2HD1      ILE  35   2.109  -3.159  -7.298
  261   3HD1  ILE  35          3HD1      ILE  35   0.995  -4.151  -6.357
  262    H    ASN  36           H        ASN  36   0.887  -0.999 -11.045
  263    HA   ASN  36           HA       ASN  36  -0.252  -2.774 -12.979
  264   1HB   ASN  36          2HB       ASN  36   1.194  -0.824 -13.556
  265   2HB   ASN  36          1HB       ASN  36   2.552  -1.658 -12.820
  266   1HD2  ASN  36          1HD2      ASN  36   0.272  -1.671 -15.449
  267   2HD2  ASN  36          2HD2      ASN  36   1.166  -2.747 -16.455
  268    H    ARG  37           H        ARG  37   0.399  -4.821 -13.526
  269    HA   ARG  37           HA       ARG  37   1.215  -6.530 -11.450
  270   1HB   ARG  37          2HB       ARG  37  -0.176  -7.301 -13.278
  271   2HB   ARG  37          1HB       ARG  37   1.098  -6.962 -14.437
  272   1HG   ARG  37          2HG       ARG  37   2.484  -8.710 -13.413
  273   2HG   ARG  37          1HG       ARG  37   1.178  -9.063 -12.278
  274   1HD   ARG  37          2HD       ARG  37  -0.284  -9.687 -14.093
  275   2HD   ARG  37          1HD       ARG  37   0.931  -9.214 -15.278
  276    HE   ARG  37           HE       ARG  37   1.614 -11.335 -13.386
  277   1HH1  ARG  37          1HH1      ARG  37   0.754 -10.350 -16.626
  278   2HH1  ARG  37          2HH1      ARG  37   1.211 -11.859 -17.356
  279   1HH2  ARG  37          1HH2      ARG  37   2.215 -13.355 -14.342
  280   2HH2  ARG  37          2HH2      ARG  37   2.044 -13.559 -16.061
  281    H    VAL  38           H        VAL  38   2.986  -5.031 -14.101
  282    HA   VAL  38           HA       VAL  38   5.386  -6.547 -13.670
  283    HB   VAL  38           HB       VAL  38   5.018  -3.960 -15.190
  284   1HG1  VAL  38          1HG1      VAL  38   7.234  -6.004 -15.301
  285   2HG1  VAL  38          2HG1      VAL  38   7.345  -4.390 -14.600
  286   3HG1  VAL  38          3HG1      VAL  38   7.085  -4.580 -16.333
  287   1HG2  VAL  38          1HG2      VAL  38   4.969  -6.814 -16.168
  288   2HG2  VAL  38          2HG2      VAL  38   4.900  -5.374 -17.184
  289   3HG2  VAL  38          3HG2      VAL  38   3.586  -5.724 -16.063
  290    H    THR  39           H        THR  39   4.238  -3.303 -12.797
  291    HA   THR  39           HA       THR  39   6.553  -2.405 -11.493
  292    HB   THR  39           HB       THR  39   3.689  -1.783 -10.749
  293    HG1  THR  39           1HG      THR  39   5.329  -1.019 -12.890
  294   1HG2  THR  39          1HG2      THR  39   6.238  -0.211 -10.362
  295   2HG2  THR  39          2HG2      THR  39   5.298  -0.996  -9.092
  296   3HG2  THR  39          3HG2      THR  39   4.614   0.362  -9.987
  297    H    LEU  40           H        LEU  40   3.777  -4.238 -10.295
  298    HA   LEU  40           HA       LEU  40   4.556  -4.524  -7.626
  299   1HB   LEU  40          2HB       LEU  40   2.344  -5.123  -8.384
  300   2HB   LEU  40          1HB       LEU  40   2.991  -6.354  -9.449
  301    HG   LEU  40           HG       LEU  40   3.731  -7.643  -7.470
  302   1HD1  LEU  40          1HD1      LEU  40   4.001  -5.814  -5.898
  303   2HD1  LEU  40          2HD1      LEU  40   2.886  -7.023  -5.260
  304   3HD1  LEU  40          3HD1      LEU  40   2.263  -5.514  -5.924
  305   1HD2  LEU  40          1HD2      LEU  40   1.477  -8.335  -6.758
  306   2HD2  LEU  40          2HD2      LEU  40   1.613  -8.164  -8.508
  307   3HD2  LEU  40          3HD2      LEU  40   0.807  -6.914  -7.561
  308    H    LYS  41           H        LYS  41   5.210  -6.576 -10.437
  309    HA   LYS  41           HA       LYS  41   6.665  -8.590  -9.169
  310   1HB   LYS  41          2HB       LYS  41   5.786  -8.565 -11.534
  311   2HB   LYS  41          1HB       LYS  41   7.150  -7.546 -11.962
  312   1HG   LYS  41          2HG       LYS  41   8.689  -9.319 -11.269
  313   2HG   LYS  41          1HG       LYS  41   7.309 -10.348 -10.870
  314   1HD   LYS  41          2HD       LYS  41   6.554 -10.177 -13.219
  315   2HD   LYS  41          1HD       LYS  41   8.006  -9.246 -13.591
  316   1HE   LYS  41          2HE       LYS  41   9.397 -11.144 -12.929
  317   2HE   LYS  41          1HE       LYS  41   7.953 -12.075 -12.534
  318   1HZ   LYS  41          1HZ       LYS  41   8.755 -12.690 -14.699
  319   2HZ   LYS  41          2HZ       LYS  41   8.735 -11.079 -15.222
  320   3HZ   LYS  41          3HZ       LYS  41   7.280 -11.874 -14.876
  321    H    ASN  42           H        ASN  42   7.742  -5.573 -10.647
  322    HA   ASN  42           HA       ASN  42  10.494  -5.882 -10.335
  323   1HB   ASN  42          2HB       ASN  42   8.723  -3.464 -10.492
  324   2HB   ASN  42          1HB       ASN  42  10.451  -3.285 -10.205
  325   1HD2  ASN  42          1HD2      ASN  42   8.875  -2.416 -12.473
  326   2HD2  ASN  42          2HD2      ASN  42   9.552  -3.190 -13.864
  327    H    TRP  43           H        TRP  43   8.085  -4.735  -8.023
  328    HA   TRP  43           HA       TRP  43   9.985  -3.919  -6.055
  329   1HB   TRP  43          2HB       TRP  43   7.069  -4.677  -5.775
  330   2HB   TRP  43          1HB       TRP  43   8.041  -3.967  -4.493
  331    HD1  TRP  43           HD       TRP  43   9.344  -1.983  -7.050
  332    HE1  TRP  43           1HE      TRP  43   7.986   0.154  -7.513
  333    HE3  TRP  43           3HE      TRP  43   4.967  -3.287  -4.750
  334    HZ2  TRP  43           2HZ      TRP  43   5.412   1.164  -6.952
  335    HZ3  TRP  43           3HZ      TRP  43   3.112  -1.674  -4.751
  336    HH2  TRP  43           HH       TRP  43   3.330   0.506  -5.832
  337    H    ILE  44           H        ILE  44   8.091  -6.857  -6.615
  338    HA   ILE  44           HA       ILE  44   8.793  -8.232  -4.276
  339    HB   ILE  44           HB       ILE  44   8.140  -9.389  -6.987
  340   1HG1  ILE  44          2HG1      ILE  44   6.343  -8.849  -4.608
  341   2HG1  ILE  44          1HG1      ILE  44   6.424  -7.847  -6.055
  342   1HG2  ILE  44          1HG2      ILE  44   8.060 -10.660  -4.252
  343   2HG2  ILE  44          2HG2      ILE  44   9.185 -11.052  -5.553
  344   3HG2  ILE  44          3HG2      ILE  44   7.464 -11.401  -5.735
  345   1HD1  ILE  44          1HD1      ILE  44   4.497  -9.348  -6.090
  346   2HD1  ILE  44          2HD1      ILE  44   5.575 -10.741  -5.976
  347   3HD1  ILE  44          3HD1      ILE  44   5.620  -9.706  -7.405
  348    H    ILE  45           H        ILE  45  10.328  -8.219  -7.472
  349    HA   ILE  45           HA       ILE  45  12.313 -10.143  -6.813
  350    HB   ILE  45           HB       ILE  45  12.336  -8.058  -9.009
  351   1HG1  ILE  45          2HG1      ILE  45  11.523 -10.976  -9.074
  352   2HG1  ILE  45          1HG1      ILE  45  10.411  -9.611  -9.111
  353   1HG2  ILE  45          1HG2      ILE  45  14.571  -8.873  -8.598
  354   2HG2  ILE  45          2HG2      ILE  45  13.961  -9.573 -10.098
  355   3HG2  ILE  45          3HG2      ILE  45  14.004 -10.541  -8.625
  356   1HD1  ILE  45          1HD1      ILE  45  11.328  -8.898 -11.233
  357   2HD1  ILE  45          2HD1      ILE  45  10.777 -10.571 -11.325
  358   3HD1  ILE  45          3HD1      ILE  45  12.498 -10.213 -11.188
  359    H    LYS  46           H        LYS  46  12.256  -6.611  -6.761
  360    HA   LYS  46           HA       LYS  46  15.062  -6.353  -6.301
  361   1HB   LYS  46          2HB       LYS  46  13.562  -4.626  -7.364
  362   2HB   LYS  46          1HB       LYS  46  12.930  -4.285  -5.760
  363   1HG   LYS  46          2HG       LYS  46  15.246  -3.714  -5.042
  364   2HG   LYS  46          1HG       LYS  46  15.760  -3.906  -6.720
  365   1HD   LYS  46          2HD       LYS  46  14.027  -2.191  -7.337
  366   2HD   LYS  46          1HD       LYS  46  13.798  -1.905  -5.611
  367   1HE   LYS  46          2HE       LYS  46  15.308  -0.248  -6.397
  368   2HE   LYS  46          1HE       LYS  46  16.253  -1.408  -5.466
  369   1HZ   LYS  46          1HZ       LYS  46  17.354  -0.775  -7.534
  370   2HZ   LYS  46          2HZ       LYS  46  16.037  -1.361  -8.428
  371   3HZ   LYS  46          3HZ       LYS  46  16.985  -2.429  -7.522
  372    H    TYR  47           H        TYR  47  12.213  -5.934  -4.192
  373    HA   TYR  47           HA       TYR  47  13.942  -5.412  -1.929
  374   1HB   TYR  47          2HB       TYR  47  10.934  -5.542  -2.186
  375   2HB   TYR  47          1HB       TYR  47  11.779  -5.156  -0.690
  376    HD1  TYR  47           1HD      TYR  47  12.741  -3.002  -0.333
  377    HD2  TYR  47           2HD      TYR  47  11.055  -3.987  -4.107
  378    HE1  TYR  47           1HE      TYR  47  12.849  -0.636  -0.993
  379    HE2  TYR  47           2HE      TYR  47  11.163  -1.629  -4.780
  380    HH   TYR  47           HH       TYR  47  12.907   0.726  -3.014
  381    H    GLY  48           H        GLY  48  12.125  -8.079  -3.228
  382   1HA   GLY  48          2HA       GLY  48  12.058  -9.663  -0.860
  383   2HA   GLY  48          1HA       GLY  48  11.832 -10.241  -2.504
  384    H    SER  49           H        SER  49  14.595  -8.795  -2.920
  385    HA   SER  49           HA       SER  49  16.159 -11.185  -2.572
  386   1HB   SER  49          2HB       SER  49  16.418  -9.729  -4.568
  387   2HB   SER  49          1HB       SER  49  17.023  -8.439  -3.529
  388    HG   SER  49           HG       SER  49  18.243 -10.984  -3.505
  389    H    ASN  50           H        ASN  50  15.624  -8.251  -0.854
  390    HA   ASN  50           HA       ASN  50  16.389  -7.388   1.085
  391   1HB   ASN  50          2HB       ASN  50  15.934  -9.553   2.068
  392   2HB   ASN  50          1HB       ASN  50  17.467 -10.185   1.483
  393   1HD2  ASN  50          1HD2      ASN  50  18.040 -10.769   3.584
  394   2HD2  ASN  50          2HD2      ASN  50  18.594  -9.589   4.729
  395    H    HIS  51           H        HIS  51  19.177  -9.532   0.814
  396    HA   HIS  51           HA       HIS  51  20.806  -7.471  -0.398
  397   1HB   HIS  51          2HB       HIS  51  21.112  -8.278   2.456
  398   2HB   HIS  51          1HB       HIS  51  22.556  -7.922   1.528
  399    HD1  HIS  51           1HD      HIS  51  20.964  -6.272   3.963
  400    HD2  HIS  51           2HD      HIS  51  21.540  -5.248  -0.028
  401    HE1  HIS  51           1HE      HIS  51  20.749  -3.767   3.863
  402    HE2  HIS  51           2HE      HIS  51  21.313  -3.164   1.483
  403    H    ASN  52           H        ASN  52  21.051  -8.910  -2.034
  404    HA   ASN  52           HA       ASN  52  22.516 -11.398  -1.428
  405   1HB   ASN  52          2HB       ASN  52  20.221 -11.367  -2.675
  406   2HB   ASN  52          1HB       ASN  52  21.166 -10.812  -4.051
  407   1HD2  ASN  52          1HD2      ASN  52  19.638 -13.286  -3.535
  408   2HD2  ASN  52          2HD2      ASN  52  20.752 -14.574  -3.834
  409    H    VAL  53           H        VAL  53  23.722  -8.849  -1.461
  410    HA   VAL  53           HA       VAL  53  25.111  -8.501  -3.971
  411    HB   VAL  53           HB       VAL  53  25.602  -7.196  -1.285
  412   1HG1  VAL  53          1HG1      VAL  53  27.554  -7.028  -2.699
  413   2HG1  VAL  53          2HG1      VAL  53  26.763  -5.457  -2.580
  414   3HG1  VAL  53          3HG1      VAL  53  26.567  -6.434  -4.035
  415   1HG2  VAL  53          1HG2      VAL  53  24.345  -5.306  -2.158
  416   2HG2  VAL  53          2HG2      VAL  53  23.354  -6.767  -2.129
  417   3HG2  VAL  53          3HG2      VAL  53  24.035  -6.192  -3.652
  418    H    GLN  54           H        GLN  54  25.580 -10.076  -0.944
  419    HA   GLN  54           HA       GLN  54  28.337 -10.793  -1.681
  420   1HB   GLN  54          2HB       GLN  54  28.936 -10.809   0.638
  421   2HB   GLN  54          1HB       GLN  54  28.117  -9.285   0.327
  422   1HG   GLN  54          2HG       GLN  54  26.866 -11.715   1.605
  423   2HG   GLN  54          1HG       GLN  54  27.468 -10.302   2.464
  424   1HE2  GLN  54          1HE2      GLN  54  24.767 -11.541   2.227
  425   2HE2  GLN  54          2HE2      GLN  54  23.721 -10.256   1.725
  426    H    GLY  55           H        GLY  55  28.945 -12.944  -1.460
  427   1HA   GLY  55          2HA       GLY  55  28.252 -14.942   0.042
  428   2HA   GLY  55          1HA       GLY  55  26.758 -14.812  -0.858
  429    H    THR  56           H        THR  56  30.181 -15.360  -1.133
  430    HA   THR  56           HA       THR  56  31.463 -16.640  -2.504
  431    HB   THR  56           HB       THR  56  29.215 -18.536  -2.698
  432    HG1  THR  56           1HG      THR  56  29.986 -17.351  -0.424
  433   1HG2  THR  56          1HG2      THR  56  31.377 -19.153  -3.644
  434   2HG2  THR  56          2HG2      THR  56  30.980 -20.173  -2.261
  435   3HG2  THR  56          3HG2      THR  56  32.141 -18.860  -2.080
  436    H    THR  57           H        THR  57  31.745 -15.606  -4.385
  437    HA   THR  57           HA       THR  57  29.864 -16.164  -6.579
  438    HB   THR  57           HB       THR  57  31.997 -14.016  -6.441
  439    HG1  THR  57           1HG      THR  57  29.675 -14.062  -5.252
  440   1HG2  THR  57          1HG2      THR  57  29.797 -14.501  -8.455
  441   2HG2  THR  57          2HG2      THR  57  31.521 -14.734  -8.730
  442   3HG2  THR  57          3HG2      THR  57  30.886 -13.115  -8.441
  443    HA   PRO  58           HA       PRO  58  33.098 -19.057  -7.774
  444   1HB   PRO  58          2HB       PRO  58  31.278 -19.662 -10.000
  445   2HB   PRO  58          1HB       PRO  58  31.881 -20.725  -8.725
  446   1HG   PRO  58          2HG       PRO  58  29.320 -19.900  -8.802
  447   2HG   PRO  58          1HG       PRO  58  30.180 -20.168  -7.274
  448   1HD   PRO  58          2HD       PRO  58  29.583 -17.592  -8.688
  449   2HD   PRO  58          1HD       PRO  58  29.507 -17.968  -6.953
  450    H    SER  59           H        SER  59  31.639 -16.583  -9.681
  451    HA   SER  59           HA       SER  59  33.118 -16.839 -12.051
  452   1HB   SER  59          2HB       SER  59  32.065 -14.249 -10.905
  453   2HB   SER  59          1HB       SER  59  32.281 -14.669 -12.604
  454    HG   SER  59           HG       SER  59  30.101 -14.880 -12.024
  455    H    ALA  60           H        ALA  60  33.936 -15.557  -8.943
  456    HA   ALA  60           HA       ALA  60  36.130 -13.940  -9.860
  457   1HB   ALA  60          1HB       ALA  60  34.870 -13.374  -7.830
  458   2HB   ALA  60          2HB       ALA  60  36.591 -13.576  -7.505
  459   3HB   ALA  60          3HB       ALA  60  35.455 -14.851  -7.067
  460    H    ALA  61           H        ALA  61  35.651 -17.236  -9.093
  461    HA   ALA  61           HA       ALA  61  38.310 -17.802  -8.196
  462   1HB   ALA  61          1HB       ALA  61  36.411 -19.161  -7.467
  463   2HB   ALA  61          2HB       ALA  61  37.637 -20.138  -8.274
  464   3HB   ALA  61          3HB       ALA  61  36.163 -19.693  -9.131
  465    H    VAL  62           H        VAL  62  37.088 -17.079 -11.161
  466    HA   VAL  62           HA       VAL  62  38.668 -18.862 -12.766
  467    HB   VAL  62           HB       VAL  62  37.333 -16.271 -13.569
  468   1HG1  VAL  62          1HG1      VAL  62  38.332 -18.560 -15.268
  469   2HG1  VAL  62          2HG1      VAL  62  39.081 -16.967 -15.135
  470   3HG1  VAL  62          3HG1      VAL  62  37.475 -17.131 -15.846
  471   1HG2  VAL  62          1HG2      VAL  62  36.327 -19.106 -13.836
  472   2HG2  VAL  62          2HG2      VAL  62  35.503 -17.643 -14.379
  473   3HG2  VAL  62          3HG2      VAL  62  35.752 -17.926 -12.657
  474    H    SER  63           H        SER  63  38.892 -15.504 -11.752
  475    HA   SER  63           HA       SER  63  41.480 -15.119 -12.941
  476   1HB   SER  63          2HB       SER  63  40.093 -13.430 -10.845
  477   2HB   SER  63          1HB       SER  63  41.424 -12.934 -11.894
  478    HG   SER  63           HG       SER  63  39.903 -13.432 -13.681
  479    H    GLU  64           H        GLU  64  40.169 -15.828  -9.756
  480    HA   GLU  64           HA       GLU  64  42.483 -15.551  -8.210
  481   1HB   GLU  64          2HB       GLU  64  40.043 -15.881  -7.487
  482   2HB   GLU  64          1HB       GLU  64  40.325 -17.598  -7.718
  483   1HG   GLU  64          2HG       GLU  64  40.620 -17.228  -5.435
  484   2HG   GLU  64          1HG       GLU  64  42.250 -17.356  -6.091
  485    H    ALA  65           H        ALA  65  41.495 -18.033 -10.381
  486    HA   ALA  65           HA       ALA  65  42.934 -20.229  -9.415
  487   1HB   ALA  65          1HB       ALA  65  41.191 -20.424 -11.100
  488   2HB   ALA  65          2HB       ALA  65  42.694 -21.159 -11.656
  489   3HB   ALA  65          3HB       ALA  65  42.209 -19.575 -12.262
  490    H    GLU  66           H        GLU  66  43.997 -17.397 -11.094
  491    HA   GLU  66           HA       GLU  66  46.405 -18.472 -12.168
  492   1HB   GLU  66          2HB       GLU  66  45.312 -16.399 -12.998
  493   2HB   GLU  66          1HB       GLU  66  45.743 -15.601 -11.493
  494   1HG   GLU  66          2HG       GLU  66  48.109 -15.909 -12.002
  495   2HG   GLU  66          1HG       GLU  66  47.678 -16.721 -13.506
  496    H    GLN  67           H        GLN  67  45.626 -16.606  -9.259
  497    HA   GLN  67           HA       GLN  67  48.280 -16.568  -8.259
  498   1HB   GLN  67          2HB       GLN  67  45.608 -16.157  -6.908
  499   2HB   GLN  67          1HB       GLN  67  47.146 -15.960  -6.081
  500   1HG   GLN  67          2HG       GLN  67  46.386 -13.812  -6.710
  501   2HG   GLN  67          1HG       GLN  67  47.742 -14.219  -7.759
  502   1HE2  GLN  67          1HE2      GLN  67  47.126 -12.801  -9.372
  503   2HE2  GLN  67          2HE2      GLN  67  45.744 -13.068 -10.372
  504    H    ILE  68           H        ILE  68  45.518 -18.701  -7.813
  505    HA   ILE  68           HA       ILE  68  46.665 -20.362  -5.834
  506    HB   ILE  68           HB       ILE  68  44.359 -20.583  -7.701
  507   1HG1  ILE  68          2HG1      ILE  68  43.173 -21.146  -5.616
  508   2HG1  ILE  68          1HG1      ILE  68  44.701 -21.131  -4.746
  509   1HG2  ILE  68          1HG2      ILE  68  45.375 -22.742  -8.063
  510   2HG2  ILE  68          2HG2      ILE  68  43.929 -22.920  -7.068
  511   3HG2  ILE  68          3HG2      ILE  68  45.525 -22.995  -6.323
  512   1HD1  ILE  68          1HD1      ILE  68  43.424 -18.784  -6.114
  513   2HD1  ILE  68          2HD1      ILE  68  44.965 -18.762  -5.255
  514   3HD1  ILE  68          3HD1      ILE  68  43.469 -19.087  -4.377
  515    H    ARG  69           H        ARG  69  46.832 -20.366  -9.353
  516    HA   ARG  69           HA       ARG  69  48.109 -22.817  -9.746
  517   1HB   ARG  69          2HB       ARG  69  47.270 -21.514 -11.623
  518   2HB   ARG  69          1HB       ARG  69  48.426 -20.232 -11.284
  519   1HG   ARG  69          2HG       ARG  69  50.266 -21.722 -11.835
  520   2HG   ARG  69          1HG       ARG  69  49.128 -23.035 -12.135
  521   1HD   ARG  69          2HD       ARG  69  49.204 -20.419 -13.634
  522   2HD   ARG  69          1HD       ARG  69  49.884 -21.941 -14.210
  523    HE   ARG  69           HE       ARG  69  47.069 -22.015 -13.516
  524   1HH1  ARG  69          1HH1      ARG  69  49.442 -21.511 -16.044
  525   2HH1  ARG  69          2HH1      ARG  69  48.361 -21.957 -17.330
  526   1HH2  ARG  69          1HH2      ARG  69  45.622 -22.532 -15.206
  527   2HH2  ARG  69          2HH2      ARG  69  46.174 -22.488 -16.852
  528    H    GLN  70           H        GLN  70  49.460 -19.630  -9.043
  529    HA   GLN  70           HA       GLN  70  52.177 -20.369  -9.166
  530   1HB   GLN  70          2HB       GLN  70  50.976 -18.030  -9.050
  531   2HB   GLN  70          1HB       GLN  70  51.208 -18.227  -7.323
  532   1HG   GLN  70          2HG       GLN  70  53.563 -18.681  -9.047
  533   2HG   GLN  70          1HG       GLN  70  52.978 -17.027  -8.901
  534   1HE2  GLN  70          1HE2      GLN  70  54.346 -19.749  -7.203
  535   2HE2  GLN  70          2HE2      GLN  70  54.842 -18.867  -5.800
  536    H    LEU  71           H        LEU  71  49.832 -20.259  -6.550
  537    HA   LEU  71           HA       LEU  71  51.539 -20.947  -4.429
  538   1HB   LEU  71          2HB       LEU  71  49.142 -20.084  -4.347
  539   2HB   LEU  71          1HB       LEU  71  48.636 -21.729  -4.665
  540    HG   LEU  71           HG       LEU  71  50.350 -21.057  -2.285
  541   1HD1  LEU  71          1HD1      LEU  71  48.287 -20.901  -0.966
  542   2HD1  LEU  71          2HD1      LEU  71  47.338 -21.007  -2.450
  543   3HD1  LEU  71          3HD1      LEU  71  48.388 -19.618  -2.174
  544   1HD2  LEU  71          1HD2      LEU  71  50.154 -23.418  -2.872
  545   2HD2  LEU  71          2HD2      LEU  71  48.397 -23.286  -2.865
  546   3HD2  LEU  71          3HD2      LEU  71  49.303 -23.078  -1.368
  547    H    LYS  72           H        LYS  72  49.687 -22.941  -6.694
  548    HA   LYS  72           HA       LYS  72  50.402 -25.428  -5.496
  549   1HB   LYS  72          2HB       LYS  72  49.465 -24.839  -8.307
  550   2HB   LYS  72          1HB       LYS  72  49.563 -26.438  -7.584
  551   1HG   LYS  72          2HG       LYS  72  47.808 -24.197  -6.602
  552   2HG   LYS  72          1HG       LYS  72  47.279 -25.543  -7.613
  553   1HD   LYS  72          2HD       LYS  72  47.903 -27.115  -5.842
  554   2HD   LYS  72          1HD       LYS  72  48.439 -25.766  -4.835
  555   1HE   LYS  72          2HE       LYS  72  46.231 -26.428  -4.150
  556   2HE   LYS  72          1HE       LYS  72  46.151 -24.844  -4.915
  557   1HZ   LYS  72          1HZ       LYS  72  44.363 -26.036  -5.786
  558   2HZ   LYS  72          2HZ       LYS  72  45.272 -27.454  -5.995
  559   3HZ   LYS  72          3HZ       LYS  72  45.534 -26.126  -7.010
  560    H    LYS  73           H        LYS  73  51.588 -23.671  -8.335
  561    HA   LYS  73           HA       LYS  73  53.609 -25.687  -8.842
  562   1HB   LYS  73          2HB       LYS  73  52.420 -24.643 -10.721
  563   2HB   LYS  73          1HB       LYS  73  53.046 -23.069 -10.249
  564   1HG   LYS  73          2HG       LYS  73  55.369 -24.148 -10.553
  565   2HG   LYS  73          1HG       LYS  73  54.497 -25.384 -11.462
  566   1HD   LYS  73          2HD       LYS  73  53.628 -23.711 -12.973
  567   2HD   LYS  73          1HD       LYS  73  54.379 -22.425 -12.024
  568   1HE   LYS  73          2HE       LYS  73  56.592 -23.582 -12.495
  569   2HE   LYS  73          1HE       LYS  73  55.717 -24.537 -13.692
  570   1HZ   LYS  73          1HZ       LYS  73  56.719 -22.664 -14.762
  571   2HZ   LYS  73          2HZ       LYS  73  56.022 -21.584 -13.653
  572   3HZ   LYS  73          3HZ       LYS  73  55.038 -22.427 -14.750
  573    H    GLU  74           H        GLU  74  54.927 -25.500  -7.001
  574    HA   GLU  74           HA       GLU  74  56.394 -23.022  -6.628
  575   1HB   GLU  74          2HB       GLU  74  56.548 -25.696  -5.248
  576   2HB   GLU  74          1HB       GLU  74  57.646 -24.373  -4.900
  577   1HG   GLU  74          2HG       GLU  74  55.660 -22.989  -4.298
  578   2HG   GLU  74          1HG       GLU  74  54.679 -24.450  -4.453
  579    H    ASN  75           H        ASN  75  57.465 -26.385  -6.933
  580    HA   ASN  75           HA       ASN  75  59.618 -25.533  -8.733
  581   1HB   ASN  75          2HB       ASN  75  61.186 -26.988  -7.372
  582   2HB   ASN  75          1HB       ASN  75  60.689 -25.487  -6.601
  583   1HD2  ASN  75          1HD2      ASN  75  59.535 -25.551  -4.719
  584   2HD2  ASN  75          2HD2      ASN  75  59.128 -27.022  -3.900
  585    H    ALA  76           H        ALA  76  60.805 -27.464  -9.630
  586    HA   ALA  76           HA       ALA  76  58.922 -29.202 -10.822
  587   1HB   ALA  76          1HB       ALA  76  61.931 -29.326 -10.878
  588   2HB   ALA  76          2HB       ALA  76  60.913 -28.414 -11.995
  589   3HB   ALA  76          3HB       ALA  76  60.834 -30.176 -11.969
  590    H    LEU  77           H        LEU  77  60.926 -29.453  -8.021
  591    HA   LEU  77           HA       LEU  77  61.141 -32.234  -7.802
  592   1HB   LEU  77          2HB       LEU  77  60.961 -30.165  -5.617
  593   2HB   LEU  77          1HB       LEU  77  61.511 -31.812  -5.408
  594    HG   LEU  77           HG       LEU  77  62.872 -29.734  -7.117
  595   1HD1  LEU  77          1HD1      LEU  77  63.043 -29.225  -4.738
  596   2HD1  LEU  77          2HD1      LEU  77  64.597 -29.742  -5.393
  597   3HD1  LEU  77          3HD1      LEU  77  63.635 -30.857  -4.423
  598   1HD2  LEU  77          1HD2      LEU  77  64.683 -31.357  -7.275
  599   2HD2  LEU  77          2HD2      LEU  77  63.191 -32.009  -7.950
  600   3HD2  LEU  77          3HD2      LEU  77  63.734 -32.522  -6.353
  601    H    GLN  78           H        GLN  78  58.543 -30.031  -6.954
  602    HA   GLN  78           HA       GLN  78  56.948 -31.802  -5.464
  603   1HB   GLN  78          2HB       GLN  78  56.547 -29.365  -5.608
  604   2HB   GLN  78          1HB       GLN  78  56.053 -29.557  -7.285
  605   1HG   GLN  78          2HG       GLN  78  54.276 -31.156  -6.399
  606   2HG   GLN  78          1HG       GLN  78  54.659 -30.502  -4.807
  607   1HE2  GLN  78          1HE2      GLN  78  54.135 -28.369  -4.333
  608   2HE2  GLN  78          2HE2      GLN  78  53.054 -27.442  -5.325
  609    H    ARG  79           H        ARG  79  57.339 -31.303  -8.912
  610    HA   ARG  79           HA       ARG  79  55.169 -33.108  -9.559
  611   1HB   ARG  79          2HB       ARG  79  57.112 -31.553 -11.261
  612   2HB   ARG  79          1HB       ARG  79  55.896 -32.637 -11.927
  613   1HG   ARG  79          2HG       ARG  79  55.292 -30.263 -10.174
  614   2HG   ARG  79          1HG       ARG  79  55.219 -30.258 -11.938
  615   1HD   ARG  79          2HD       ARG  79  53.705 -32.367 -10.496
  616   2HD   ARG  79          1HD       ARG  79  53.081 -30.721 -10.430
  617    HE   ARG  79           HE       ARG  79  52.665 -30.783 -12.722
  618   1HH1  ARG  79          1HH1      ARG  79  54.096 -33.791 -11.617
  619   2HH1  ARG  79          2HH1      ARG  79  53.723 -34.654 -13.077
  620   1HH2  ARG  79          1HH2      ARG  79  52.136 -31.934 -14.624
  621   2HH2  ARG  79          2HH2      ARG  79  52.592 -33.607 -14.774
  622    H    ALA  80           H        ALA  80  58.496 -33.285  -8.955
  623    HA   ALA  80           HA       ALA  80  59.050 -35.679 -10.406
  624   1HB   ALA  80          1HB       ALA  80  60.832 -34.165  -9.638
  625   2HB   ALA  80          2HB       ALA  80  61.066 -35.813  -9.055
  626   3HB   ALA  80          3HB       ALA  80  60.441 -34.573  -7.967
  627    H    ARG  81           H        ARG  81  57.451 -34.924  -7.474
  628    HA   ARG  81           HA       ARG  81  57.563 -37.522  -6.286
  629   1HB   ARG  81          2HB       ARG  81  55.700 -35.191  -5.848
  630   2HB   ARG  81          1HB       ARG  81  55.660 -36.664  -4.897
  631   1HG   ARG  81          2HG       ARG  81  57.897 -36.241  -4.083
  632   2HG   ARG  81          1HG       ARG  81  58.022 -34.809  -5.109
  633   1HD   ARG  81          2HD       ARG  81  56.168 -33.779  -3.902
  634   2HD   ARG  81          1HD       ARG  81  56.020 -35.215  -2.890
  635    HE   ARG  81           HE       ARG  81  58.439 -34.642  -2.244
  636   1HH1  ARG  81          1HH1      ARG  81  55.949 -32.295  -2.998
  637   2HH1  ARG  81          2HH1      ARG  81  56.638 -31.058  -1.993
  638   1HH2  ARG  81          1HH2      ARG  81  59.318 -33.011  -0.888
  639   2HH2  ARG  81          2HH2      ARG  81  58.544 -31.454  -0.822
  640    H    THR  82           H        THR  82  55.651 -35.972  -8.660
  641    HA   THR  82           HA       THR  82  53.411 -37.716  -8.652
  642    HB   THR  82           HB       THR  82  54.420 -36.178 -11.045
  643    HG1  THR  82           1HG      THR  82  52.955 -35.231  -8.784
  644   1HG2  THR  82          1HG2      THR  82  52.010 -35.956 -11.526
  645   2HG2  THR  82          2HG2      THR  82  51.645 -36.917 -10.093
  646   3HG2  THR  82          3HG2      THR  82  52.510 -37.645 -11.447
  647    H    ARG  83           H        ARG  83  56.588 -37.854  -9.910
  648    HA   ARG  83           HA       ARG  83  56.091 -40.100 -11.666
  649   1HB   ARG  83          2HB       ARG  83  58.620 -38.693 -10.799
  650   2HB   ARG  83          1HB       ARG  83  58.603 -40.070 -11.884
  651   1HG   ARG  83          2HG       ARG  83  57.383 -38.821 -13.535
  652   2HG   ARG  83          1HG       ARG  83  57.210 -37.458 -12.426
  653   1HD   ARG  83          2HD       ARG  83  59.558 -37.042 -12.453
  654   2HD   ARG  83          1HD       ARG  83  59.872 -38.541 -13.326
  655    HE   ARG  83           HE       ARG  83  58.633 -37.490 -15.222
  656   1HH1  ARG  83          1HH1      ARG  83  60.185 -35.495 -12.794
  657   2HH1  ARG  83          2HH1      ARG  83  60.411 -34.151 -13.864
  658   1HH2  ARG  83          1HH2      ARG  83  58.944 -35.716 -16.630
  659   2HH2  ARG  83          2HH2      ARG  83  59.708 -34.269 -16.031
  660    H    HIS  84           H        HIS  84  56.727 -42.219 -11.250
  661    HA   HIS  84           HA       HIS  84  57.792 -42.733  -8.544
  662   1HB   HIS  84          2HB       HIS  84  55.826 -44.377 -10.143
  663   2HB   HIS  84          1HB       HIS  84  56.712 -45.030  -8.769
  664    HD1  HIS  84           1HD      HIS  84  53.780 -45.113  -8.452
  665    HD2  HIS  84           2HD      HIS  84  55.986 -41.732  -7.453
  666    HE1  HIS  84           1HE      HIS  84  52.357 -43.829  -6.828
  667    HE2  HIS  84           2HE      HIS  84  53.615 -41.681  -6.422
  668    HA   PRO  85           HA       PRO  85  60.821 -44.464 -11.476
  669   1HB   PRO  85          2HB       PRO  85  62.937 -42.970 -10.756
  670   2HB   PRO  85          1HB       PRO  85  61.696 -42.357 -11.853
  671   1HG   PRO  85          2HG       PRO  85  62.237 -41.642  -9.049
  672   2HG   PRO  85          1HG       PRO  85  61.394 -40.720 -10.302
  673   1HD   PRO  85          2HD       PRO  85  60.263 -42.324  -8.193
  674   2HD   PRO  85          1HD       PRO  85  59.417 -41.360  -9.416
  675    H    ALA  86           H        ALA  86  63.235 -45.127 -10.844
  676    HA   ALA  86           HA       ALA  86  63.359 -46.074  -8.087
  677   1HB   ALA  86          1HB       ALA  86  63.579 -47.914 -10.472
  678   2HB   ALA  86          2HB       ALA  86  62.270 -47.897  -9.287
  679   3HB   ALA  86          3HB       ALA  86  63.900 -48.363  -8.795
  680    H    GLU  87           H        GLU  87  65.412 -46.253  -7.309
  681    HA   GLU  87           HA       GLU  87  67.536 -45.073  -8.851
  682   1HB   GLU  87          2HB       GLU  87  67.242 -44.766  -6.378
  683   2HB   GLU  87          1HB       GLU  87  67.686 -46.452  -6.161
  684   1HG   GLU  87          2HG       GLU  87  69.883 -46.020  -7.083
  685   2HG   GLU  87          1HG       GLU  87  69.439 -44.342  -7.396
  686    H    SER  88           H        SER  88  66.359 -48.213  -8.138
  687    HA   SER  88           HA       SER  88  68.587 -49.807  -8.683
  688   1HB   SER  88          2HB       SER  88  66.469 -50.653  -7.734
  689   2HB   SER  88          1HB       SER  88  65.670 -50.380  -9.279
  690    HG   SER  88           HG       SER  88  67.528 -51.846 -10.053
  691    H    CYS  89           H        CYS  89  66.547 -47.963 -10.812
  692    HA   CYS  89           HA       CYS  89  67.123 -49.400 -13.192
  693   1HB   CYS  89          2HB       CYS  89  66.171 -46.556 -12.841
  694   2HB   CYS  89          1HB       CYS  89  66.136 -47.469 -14.346
  695    HG   CYS  89           HG       CYS  89  63.846 -48.569 -13.975
  696    H    LEU  90           H        LEU  90  68.809 -46.974 -11.414
  697    HA   LEU  90           HA       LEU  90  70.435 -45.967 -13.522
  698   1HB   LEU  90          2HB       LEU  90  71.166 -46.113 -10.595
  699   2HB   LEU  90          1HB       LEU  90  71.808 -45.009 -11.797
  700    HG   LEU  90           HG       LEU  90  68.977 -45.028 -10.772
  701   1HD1  LEU  90          1HD1      LEU  90  70.566 -44.248  -9.096
  702   2HD1  LEU  90          2HD1      LEU  90  69.579 -42.916  -9.697
  703   3HD1  LEU  90          3HD1      LEU  90  71.241 -43.103 -10.255
  704   1HD2  LEU  90          1HD2      LEU  90  68.747 -42.920 -12.015
  705   2HD2  LEU  90          2HD2      LEU  90  69.094 -44.279 -13.085
  706   3HD2  LEU  90          3HD2      LEU  90  70.371 -43.138 -12.668
  707    H    GLU  91           H        GLU  91  70.836 -48.493 -11.100
  708    HA   GLU  91           HA       GLU  91  73.385 -49.343 -12.144
  709   1HB   GLU  91          2HB       GLU  91  72.849 -49.610  -9.755
  710   2HB   GLU  91          1HB       GLU  91  71.517 -50.682 -10.171
  711   1HG   GLU  91          2HG       GLU  91  73.110 -52.277 -11.123
  712   2HG   GLU  91          1HG       GLU  91  74.438 -51.207 -10.685
  713    H    HIS  92           H        HIS  92  70.072 -50.560 -12.161
  714    HA   HIS  92           HA       HIS  92  68.957 -52.055 -13.436
  715   1HB   HIS  92          2HB       HIS  92  69.896 -50.538 -15.268
  716   2HB   HIS  92          1HB       HIS  92  71.129 -51.770 -15.518
  717    HD1  HIS  92           1HD      HIS  92  70.533 -53.114 -17.519
  718    HD2  HIS  92           2HD      HIS  92  67.185 -52.082 -15.275
  719    HE1  HIS  92           1HE      HIS  92  68.581 -54.199 -18.671
  720    HE2  HIS  92           2HE      HIS  92  66.621 -53.770 -17.144
  721    H    HIS  93           H        HIS  93  70.992 -52.919 -11.574
  722    HA   HIS  93           HA       HIS  93  71.506 -55.601 -12.687
  723   1HB   HIS  93          2HB       HIS  93  73.099 -54.022 -10.658
  724   2HB   HIS  93          1HB       HIS  93  73.297 -55.753 -10.883
  725    HD1  HIS  93           1HD      HIS  93  73.110 -53.004 -13.524
  726    HD2  HIS  93           2HD      HIS  93  75.695 -55.932 -12.110
  727    HE1  HIS  93           1HE      HIS  93  75.087 -52.956 -15.064
  728    HE2  HIS  93           2HE      HIS  93  76.731 -54.562 -14.045
  729    H    HIS  94           H        HIS  94  71.994 -56.971 -10.406
  730    HA   HIS  94           HA       HIS  94  69.738 -56.398  -8.607
  731   1HB   HIS  94          2HB       HIS  94  69.393 -58.330 -10.298
  732   2HB   HIS  94          1HB       HIS  94  70.571 -59.205  -9.330
  733    HD1  HIS  94           1HD      HIS  94  67.019 -58.218  -9.447
  734    HD2  HIS  94           2HD      HIS  94  69.670 -59.839  -6.680
  735    HE1  HIS  94           1HE      HIS  94  65.590 -59.141  -7.599
  736    HE2  HIS  94           2HE      HIS  94  67.205 -60.301  -6.044
  737    H    HIS  95           H        HIS  95  72.154 -55.425  -8.054
  738    HA   HIS  95           HA       HIS  95  74.065 -57.085  -6.882
  739   1HB   HIS  95          2HB       HIS  95  74.324 -54.655  -7.532
  740   2HB   HIS  95          1HB       HIS  95  73.472 -54.241  -6.051
  741    HD1  HIS  95           1HD      HIS  95  76.769 -55.375  -7.341
  742    HD2  HIS  95           2HD      HIS  95  74.952 -54.654  -3.669
  743    HE1  HIS  95           1HE      HIS  95  78.638 -55.310  -5.653
  744    HE2  HIS  95           2HE      HIS  95  77.529 -54.677  -3.478
  745    H    HIS  96           H        HIS  96  72.180 -54.804  -4.911
  746    HA   HIS  96           HA       HIS  96  71.228 -54.950  -2.849
  747   1HB   HIS  96          2HB       HIS  96  69.878 -56.701  -4.117
  748   2HB   HIS  96          1HB       HIS  96  70.921 -57.912  -3.386
  749    HD1  HIS  96           1HD      HIS  96  70.091 -58.864  -1.253
  750    HD2  HIS  96           2HD      HIS  96  68.458 -55.113  -2.031
  751    HE1  HIS  96           1HE      HIS  96  68.419 -58.452   0.577
  752    HE2  HIS  96           2HE      HIS  96  67.304 -56.275  -0.025
  753    H    HIS  97           H        HIS  97  71.413 -56.220  -0.646
  754    HA   HIS  97           HA       HIS  97  74.030 -57.494  -0.406
  755   1HB   HIS  97          2HB       HIS  97  74.388 -56.358   1.788
  756   2HB   HIS  97          1HB       HIS  97  74.409 -55.257   0.419
  757    HD1  HIS  97           1HD      HIS  97  72.407 -53.572   0.216
  758    HD2  HIS  97           2HD      HIS  97  72.402 -55.889   3.675
  759    HE1  HIS  97           1HE      HIS  97  70.760 -52.474   1.773
  760    HE2  HIS  97           2HE      HIS  97  70.644 -53.994   3.782
  Start of MODEL   20
    1   1H    MET   1          1HT       MET   1  -1.488  18.334  -6.092
    2   2H    MET   1          2HT       MET   1  -1.104  18.372  -4.439
    3   3H    MET   1          3HT       MET   1  -2.661  17.921  -4.940
    4    HA   MET   1           HA       MET   1  -1.786  15.965  -6.019
    5   1HB   MET   1          2HB       MET   1   0.431  16.827  -6.557
    6   2HB   MET   1          1HB       MET   1   0.835  16.927  -4.849
    7   1HG   MET   1          2HG       MET   1   0.833  14.551  -4.640
    8   2HG   MET   1          1HG       MET   1   0.177  14.355  -6.264
    9   1HE   MET   1          1HE       MET   1   4.400  16.035  -5.469
   10   2HE   MET   1          2HE       MET   1   3.273  15.619  -4.179
   11   3HE   MET   1          3HE       MET   1   2.921  16.972  -5.255
   12    HA   PRO   2           HA       PRO   2  -3.150  14.640  -1.983
   13   1HB   PRO   2          2HB       PRO   2  -4.048  12.212  -2.741
   14   2HB   PRO   2          1HB       PRO   2  -4.904  13.704  -3.152
   15   1HG   PRO   2          2HG       PRO   2  -3.024  12.078  -4.831
   16   2HG   PRO   2          1HG       PRO   2  -4.595  12.778  -5.272
   17   1HD   PRO   2          2HD       PRO   2  -2.245  13.948  -5.927
   18   2HD   PRO   2          1HD       PRO   2  -3.712  14.884  -5.579
   19    H    THR   3           H        THR   3  -0.308  14.094  -3.065
   20    HA   THR   3           HA       THR   3   1.493  12.834  -2.793
   21    HB   THR   3           HB       THR   3   1.862  11.922  -0.545
   22    HG1  THR   3           1HG      THR   3  -0.815  12.054  -0.378
   23   1HG2  THR   3          1HG2      THR   3   1.760  14.096   0.631
   24   2HG2  THR   3          2HG2      THR   3   0.783  14.719  -0.697
   25   3HG2  THR   3          3HG2      THR   3   2.443  14.204  -0.991
   26    H    LYS   4           H        LYS   4   1.705  11.237  -4.133
   27    HA   LYS   4           HA       LYS   4   0.072   8.822  -3.818
   28   1HB   LYS   4          2HB       LYS   4   0.861   8.322  -6.137
   29   2HB   LYS   4          1HB       LYS   4  -0.060   9.816  -6.008
   30   1HG   LYS   4          2HG       LYS   4   2.083  11.065  -5.919
   31   2HG   LYS   4          1HG       LYS   4   2.933   9.546  -6.210
   32   1HD   LYS   4          2HD       LYS   4   1.883   9.299  -8.342
   33   2HD   LYS   4          1HD       LYS   4   0.829  10.680  -8.034
   34   1HE   LYS   4          2HE       LYS   4   2.820  12.134  -7.934
   35   2HE   LYS   4          1HE       LYS   4   3.829  10.747  -8.343
   36   1HZ   LYS   4          1HZ       LYS   4   2.757  10.576 -10.457
   37   2HZ   LYS   4          2HZ       LYS   4   3.261  12.179 -10.263
   38   3HZ   LYS   4          3HZ       LYS   4   1.628  11.771 -10.055
   39    H    THR   5           H        THR   5   2.966   9.994  -2.948
   40    HA   THR   5           HA       THR   5   4.818   7.988  -3.473
   41    HB   THR   5           HB       THR   5   5.901   8.873  -1.350
   42    HG1  THR   5           1HG      THR   5   3.809   9.634  -0.502
   43   1HG2  THR   5          1HG2      THR   5   5.159  10.832  -3.518
   44   2HG2  THR   5          2HG2      THR   5   6.510   9.700  -3.562
   45   3HG2  THR   5          3HG2      THR   5   6.502  11.017  -2.390
   46    H    TYR   6           H        TYR   6   4.974   5.990  -2.771
   47    HA   TYR   6           HA       TYR   6   3.324   5.128  -0.511
   48   1HB   TYR   6          2HB       TYR   6   4.111   2.798  -1.527
   49   2HB   TYR   6          1HB       TYR   6   2.742   3.680  -2.193
   50    HD1  TYR   6           1HD      TYR   6   6.417   3.201  -2.650
   51    HD2  TYR   6           2HD      TYR   6   2.702   4.220  -4.463
   52    HE1  TYR   6           1HE      TYR   6   7.503   3.216  -4.856
   53    HE2  TYR   6           2HE      TYR   6   3.781   4.235  -6.673
   54    HH   TYR   6           HH       TYR   6   6.035   4.533  -7.619
   55    H    SER   7           H        SER   7   4.185   4.151   1.254
   56    HA   SER   7           HA       SER   7   6.888   4.754   1.884
   57   1HB   SER   7          2HB       SER   7   4.992   2.905   3.354
   58   2HB   SER   7          1HB       SER   7   6.410   3.714   4.022
   59    HG   SER   7           HG       SER   7   3.961   4.853   3.169
   60    H    GLU   8           H        GLU   8   8.569   3.243   2.470
   61    HA   GLU   8           HA       GLU   8   9.014   1.203   0.598
   62   1HB   GLU   8          2HB       GLU   8  10.903   0.540   2.122
   63   2HB   GLU   8          1HB       GLU   8  10.898   2.233   1.644
   64   1HG   GLU   8          2HG       GLU   8   9.986   2.874   3.784
   65   2HG   GLU   8          1HG       GLU   8   9.848   1.184   4.263
   66    H    GLU   9           H        GLU   9   7.711   1.164   3.845
   67    HA   GLU   9           HA       GLU   9   7.693  -1.633   4.225
   68   1HB   GLU   9          2HB       GLU   9   7.445   0.162   5.980
   69   2HB   GLU   9          1HB       GLU   9   5.792   0.376   5.431
   70   1HG   GLU   9          2HG       GLU   9   5.178  -1.792   6.135
   71   2HG   GLU   9          1HG       GLU   9   6.859  -2.254   6.408
   72    H    PHE  10           H        PHE  10   5.529   0.573   2.635
   73    HA   PHE  10           HA       PHE  10   3.279  -1.121   2.415
   74   1HB   PHE  10          2HB       PHE  10   3.208   1.322   2.041
   75   2HB   PHE  10          1HB       PHE  10   4.159   1.116   0.577
   76    HD1  PHE  10           1HD      PHE  10   0.910   0.340   2.152
   77    HD2  PHE  10           2HD      PHE  10   3.141   0.552  -1.465
   78    HE1  PHE  10           1HE      PHE  10  -1.162   0.034   0.859
   79    HE2  PHE  10           2HE      PHE  10   1.075   0.254  -2.763
   80    HZ   PHE  10           HZ       PHE  10  -1.081  -0.009  -1.603
   81    H    LYS  11           H        LYS  11   5.965  -0.470   0.157
   82    HA   LYS  11           HA       LYS  11   5.162  -2.367  -1.776
   83   1HB   LYS  11          2HB       LYS  11   7.964  -1.364  -1.234
   84   2HB   LYS  11          1HB       LYS  11   7.358  -2.044  -2.740
   85   1HG   LYS  11          2HG       LYS  11   5.730  -0.118  -2.808
   86   2HG   LYS  11          1HG       LYS  11   6.654   0.591  -1.483
   87   1HD   LYS  11          2HD       LYS  11   7.765  -0.169  -4.181
   88   2HD   LYS  11          1HD       LYS  11   7.333   1.465  -3.686
   89   1HE   LYS  11          2HE       LYS  11   8.996   1.275  -1.856
   90   2HE   LYS  11          1HE       LYS  11   9.488  -0.281  -2.520
   91   1HZ   LYS  11          1HZ       LYS  11  10.073   0.860  -4.592
   92   2HZ   LYS  11          2HZ       LYS  11  10.954   1.465  -3.275
   93   3HZ   LYS  11          3HZ       LYS  11   9.645   2.343  -3.898
   94    H    ARG  12           H        ARG  12   7.105  -2.520   1.115
   95    HA   ARG  12           HA       ARG  12   8.127  -5.128   0.845
   96   1HB   ARG  12          2HB       ARG  12   9.133  -3.835   2.507
   97   2HB   ARG  12          1HB       ARG  12   7.601  -3.260   3.133
   98   1HG   ARG  12          2HG       ARG  12   8.271  -6.146   3.429
   99   2HG   ARG  12          1HG       ARG  12   9.071  -4.970   4.469
  100   1HD   ARG  12          2HD       ARG  12   6.786  -4.092   5.059
  101   2HD   ARG  12          1HD       ARG  12   6.111  -5.476   4.199
  102    HE   ARG  12           HE       ARG  12   8.041  -6.095   6.274
  103   1HH1  ARG  12          1HH1      ARG  12   4.645  -5.713   5.456
  104   2HH1  ARG  12          2HH1      ARG  12   4.085  -6.632   6.814
  105   1HH2  ARG  12          1HH2      ARG  12   7.313  -7.289   8.048
  106   2HH2  ARG  12          2HH2      ARG  12   5.612  -7.535   8.302
  107    H    ASP  13           H        ASP  13   5.058  -3.886   2.009
  108    HA   ASP  13           HA       ASP  13   4.122  -6.323   3.142
  109   1HB   ASP  13          2HB       ASP  13   3.313  -3.804   3.416
  110   2HB   ASP  13          1HB       ASP  13   2.216  -4.261   2.118
  111    H    ALA  14           H        ALA  14   3.885  -4.809  -0.008
  112    HA   ALA  14           HA       ALA  14   1.972  -6.492  -1.173
  113   1HB   ALA  14          1HB       ALA  14   4.294  -5.097  -2.502
  114   2HB   ALA  14          2HB       ALA  14   2.707  -4.393  -2.188
  115   3HB   ALA  14          3HB       ALA  14   2.866  -5.741  -3.316
  116    H    VAL  15           H        VAL  15   5.480  -6.812  -0.875
  117    HA   VAL  15           HA       VAL  15   5.724  -9.178  -2.402
  118    HB   VAL  15           HB       VAL  15   7.499  -8.258  -0.125
  119   1HG1  VAL  15          1HG1      VAL  15   9.227  -9.605  -1.160
  120   2HG1  VAL  15          2HG1      VAL  15   8.111 -10.103  -2.430
  121   3HG1  VAL  15          3HG1      VAL  15   7.833 -10.613  -0.765
  122   1HG2  VAL  15          1HG2      VAL  15   7.675  -7.699  -3.079
  123   2HG2  VAL  15          2HG2      VAL  15   8.879  -7.241  -1.872
  124   3HG2  VAL  15          3HG2      VAL  15   7.261  -6.535  -1.819
  125    H    ALA  16           H        ALA  16   5.102  -8.581   1.013
  126    HA   ALA  16           HA       ALA  16   5.244 -11.256   1.895
  127   1HB   ALA  16          1HB       ALA  16   5.316  -9.321   3.414
  128   2HB   ALA  16          2HB       ALA  16   4.076 -10.486   3.879
  129   3HB   ALA  16          3HB       ALA  16   3.621  -8.993   3.060
  130    H    LEU  17           H        LEU  17   2.639  -9.338   0.517
  131    HA   LEU  17           HA       LEU  17   0.530 -11.172   0.922
  132   1HB   LEU  17          2HB       LEU  17   0.805  -8.666  -0.232
  133   2HB   LEU  17          1HB       LEU  17   0.422  -9.685  -1.603
  134    HG   LEU  17           HG       LEU  17  -1.661  -8.927  -0.946
  135   1HD1  LEU  17          1HD1      LEU  17  -1.708 -11.348  -1.115
  136   2HD1  LEU  17          2HD1      LEU  17  -2.853 -10.779   0.100
  137   3HD1  LEU  17          3HD1      LEU  17  -1.319 -11.490   0.600
  138   1HD2  LEU  17          1HD2      LEU  17  -0.937  -7.792   1.081
  139   2HD2  LEU  17          2HD2      LEU  17  -0.882  -9.335   1.935
  140   3HD2  LEU  17          3HD2      LEU  17  -2.422  -8.702   1.347
  141    H    TYR  18           H        TYR  18   2.998 -10.862  -1.581
  142    HA   TYR  18           HA       TYR  18   1.870 -12.746  -3.382
  143   1HB   TYR  18          2HB       TYR  18   3.542 -11.003  -4.017
  144   2HB   TYR  18          1HB       TYR  18   4.770 -11.911  -3.143
  145    HD1  TYR  18           1HD      TYR  18   6.060 -13.438  -4.312
  146    HD2  TYR  18           2HD      TYR  18   2.243 -12.367  -5.857
  147    HE1  TYR  18           1HE      TYR  18   6.508 -14.770  -6.328
  148    HE2  TYR  18           2HE      TYR  18   2.676 -13.703  -7.873
  149    HH   TYR  18           HH       TYR  18   5.217 -15.918  -8.102
  150    H    GLU  19           H        GLU  19   3.759 -13.048  -0.511
  151    HA   GLU  19           HA       GLU  19   4.695 -15.696  -0.925
  152   1HB   GLU  19          2HB       GLU  19   4.160 -14.121   1.596
  153   2HB   GLU  19          1HB       GLU  19   4.877 -15.727   1.593
  154   1HG   GLU  19          2HG       GLU  19   6.027 -13.311   0.213
  155   2HG   GLU  19          1HG       GLU  19   6.546 -13.935   1.781
  156    H    ASN  20           H        ASN  20   1.648 -14.369  -0.276
  157    HA   ASN  20           HA       ASN  20   0.518 -16.909   0.669
  158   1HB   ASN  20          2HB       ASN  20  -0.518 -14.065   0.649
  159   2HB   ASN  20          1HB       ASN  20  -1.518 -15.438   1.089
  160   1HD2  ASN  20          1HD2      ASN  20   1.130 -13.387   2.047
  161   2HD2  ASN  20          2HD2      ASN  20   1.194 -13.914   3.693
  162    H    SER  21           H        SER  21   1.396 -16.578  -2.035
  163    HA   SER  21           HA       SER  21  -0.494 -15.494  -3.767
  164   1HB   SER  21          2HB       SER  21   0.685 -16.731  -5.540
  165   2HB   SER  21          1HB       SER  21   1.767 -15.812  -4.493
  166    HG   SER  21           HG       SER  21   2.558 -17.638  -3.661
  167    H    ASP  22           H        ASP  22  -0.390 -18.668  -2.348
  168    HA   ASP  22           HA       ASP  22  -1.981 -20.018  -4.227
  169   1HB   ASP  22          2HB       ASP  22  -0.761 -21.218  -2.480
  170   2HB   ASP  22          1HB       ASP  22  -1.778 -20.479  -1.243
  171    H    GLY  23           H        GLY  23  -2.745 -17.808  -1.676
  172   1HA   GLY  23          2HA       GLY  23  -5.615 -18.118  -2.266
  173   2HA   GLY  23          1HA       GLY  23  -4.958 -17.402  -0.801
  174    H    ALA  24           H        ALA  24  -3.061 -16.288  -3.268
  175    HA   ALA  24           HA       ALA  24  -4.805 -14.100  -4.060
  176   1HB   ALA  24          1HB       ALA  24  -3.394 -12.353  -3.163
  177   2HB   ALA  24          2HB       ALA  24  -2.284 -13.550  -2.498
  178   3HB   ALA  24          3HB       ALA  24  -3.920 -13.413  -1.854
  179    H    SER  25           H        SER  25  -4.509 -14.299  -6.184
  180    HA   SER  25           HA       SER  25  -2.101 -15.190  -7.400
  181   1HB   SER  25          2HB       SER  25  -4.298 -15.551  -8.433
  182   2HB   SER  25          1HB       SER  25  -4.521 -13.810  -8.598
  183    HG   SER  25           HG       SER  25  -3.564 -15.306 -10.407
  184    H    LEU  26           H        LEU  26  -0.725 -13.996  -8.836
  185    HA   LEU  26           HA       LEU  26   0.247 -11.559  -7.881
  186   1HB   LEU  26          2HB       LEU  26   1.535 -13.111  -9.300
  187   2HB   LEU  26          1HB       LEU  26   0.501 -12.729 -10.659
  188    HG   LEU  26           HG       LEU  26   1.298 -10.374 -10.555
  189   1HD1  LEU  26          1HD1      LEU  26   3.233 -11.467  -8.520
  190   2HD1  LEU  26          2HD1      LEU  26   1.952 -10.292  -8.218
  191   3HD1  LEU  26          3HD1      LEU  26   3.310  -9.869  -9.261
  192   1HD2  LEU  26          1HD2      LEU  26   3.470 -12.441 -10.862
  193   2HD2  LEU  26          2HD2      LEU  26   3.478 -10.809 -11.531
  194   3HD2  LEU  26          3HD2      LEU  26   2.295 -11.988 -12.097
  195    H    GLN  27           H        GLN  27  -1.997 -12.289 -10.495
  196    HA   GLN  27           HA       GLN  27  -2.442  -9.696 -11.462
  197   1HB   GLN  27          2HB       GLN  27  -3.332 -11.717 -12.560
  198   2HB   GLN  27          1HB       GLN  27  -4.411 -11.990 -11.202
  199   1HG   GLN  27          2HG       GLN  27  -5.730 -11.019 -12.881
  200   2HG   GLN  27          1HG       GLN  27  -5.429  -9.742 -11.709
  201   1HE2  GLN  27          1HE2      GLN  27  -3.105 -10.901 -14.086
  202   2HE2  GLN  27          2HE2      GLN  27  -3.068  -9.445 -15.016
  203    H    GLN  28           H        GLN  28  -3.907 -11.453  -8.759
  204    HA   GLN  28           HA       GLN  28  -5.976  -9.597  -8.248
  205   1HB   GLN  28          2HB       GLN  28  -5.907 -12.020  -7.541
  206   2HB   GLN  28          1HB       GLN  28  -4.769 -11.558  -6.287
  207   1HG   GLN  28          2HG       GLN  28  -7.478 -10.293  -6.502
  208   2HG   GLN  28          1HG       GLN  28  -7.231 -11.822  -5.665
  209   1HE2  GLN  28          1HE2      GLN  28  -8.116  -9.236  -4.639
  210   2HE2  GLN  28          2HE2      GLN  28  -7.004  -8.814  -3.388
  211    H    ILE  29           H        ILE  29  -2.737 -10.019  -6.863
  212    HA   ILE  29           HA       ILE  29  -2.934  -8.149  -4.793
  213    HB   ILE  29           HB       ILE  29  -0.444  -8.684  -6.420
  214   1HG1  ILE  29          2HG1      ILE  29  -1.413 -10.807  -5.696
  215   2HG1  ILE  29          1HG1      ILE  29   0.048 -10.457  -4.774
  216   1HG2  ILE  29          1HG2      ILE  29  -0.251  -6.781  -4.909
  217   2HG2  ILE  29          2HG2      ILE  29   0.735  -8.127  -4.341
  218   3HG2  ILE  29          3HG2      ILE  29  -0.808  -7.778  -3.565
  219   1HD1  ILE  29          1HD1      ILE  29  -2.772 -10.016  -3.819
  220   2HD1  ILE  29          2HD1      ILE  29  -1.298  -9.726  -2.895
  221   3HD1  ILE  29          3HD1      ILE  29  -1.727 -11.367  -3.377
  222    H    ALA  30           H        ALA  30  -1.805  -7.702  -8.133
  223    HA   ALA  30           HA       ALA  30  -1.432  -4.891  -7.884
  224   1HB   ALA  30          1HB       ALA  30  -0.266  -6.204  -9.588
  225   2HB   ALA  30          2HB       ALA  30  -1.201  -4.896 -10.313
  226   3HB   ALA  30          3HB       ALA  30  -1.805  -6.553 -10.377
  227    H    ASN  31           H        ASN  31  -4.098  -6.945  -8.755
  228    HA   ASN  31           HA       ASN  31  -5.749  -4.992  -9.976
  229   1HB   ASN  31          2HB       ASN  31  -5.958  -7.529 -10.117
  230   2HB   ASN  31          1HB       ASN  31  -6.708  -7.465  -8.530
  231   1HD2  ASN  31          1HD2      ASN  31  -7.093  -6.917 -11.893
  232   2HD2  ASN  31          2HD2      ASN  31  -8.772  -6.507 -11.854
  233    H    ASP  32           H        ASP  32  -5.547  -6.230  -6.649
  234    HA   ASP  32           HA       ASP  32  -7.775  -4.844  -5.622
  235   1HB   ASP  32          2HB       ASP  32  -6.579  -6.732  -4.464
  236   2HB   ASP  32          1HB       ASP  32  -5.274  -5.613  -4.097
  237    H    LEU  33           H        LEU  33  -4.348  -3.997  -5.744
  238    HA   LEU  33           HA       LEU  33  -4.725  -1.505  -4.384
  239   1HB   LEU  33          2HB       LEU  33  -2.414  -2.854  -5.728
  240   2HB   LEU  33          1HB       LEU  33  -2.304  -1.157  -5.314
  241    HG   LEU  33           HG       LEU  33  -2.723  -1.732  -2.939
  242   1HD1  LEU  33          1HD1      LEU  33  -2.537  -4.072  -2.228
  243   2HD1  LEU  33          2HD1      LEU  33  -2.553  -4.579  -3.918
  244   3HD1  LEU  33          3HD1      LEU  33  -3.968  -3.791  -3.220
  245   1HD2  LEU  33          1HD2      LEU  33  -0.526  -2.722  -2.521
  246   2HD2  LEU  33          2HD2      LEU  33  -0.452  -1.468  -3.758
  247   3HD2  LEU  33          3HD2      LEU  33  -0.402  -3.168  -4.223
  248    H    GLY  34           H        GLY  34  -4.884  -2.561  -7.659
  249   1HA   GLY  34          2HA       GLY  34  -5.626  -1.384  -9.514
  250   2HA   GLY  34          1HA       GLY  34  -5.665   0.076  -8.532
  251    H    ILE  35           H        ILE  35  -2.875  -2.006  -8.856
  252    HA   ILE  35           HA       ILE  35  -1.487   0.197 -10.231
  253    HB   ILE  35           HB       ILE  35   0.604  -0.664  -9.235
  254   1HG1  ILE  35          2HG1      ILE  35  -1.225  -2.449  -7.615
  255   2HG1  ILE  35          1HG1      ILE  35  -0.167  -3.000  -8.906
  256   1HG2  ILE  35          1HG2      ILE  35   0.209   0.162  -6.971
  257   2HG2  ILE  35          2HG2      ILE  35  -1.532   0.014  -7.217
  258   3HG2  ILE  35          3HG2      ILE  35  -0.602   1.171  -8.169
  259   1HD1  ILE  35          1HD1      ILE  35   0.717  -1.735  -6.325
  260   2HD1  ILE  35          2HD1      ILE  35   1.780  -2.284  -7.621
  261   3HD1  ILE  35          3HD1      ILE  35   0.801  -3.448  -6.730
  262    H    ASN  36           H        ASN  36   0.485  -0.600 -11.479
  263    HA   ASN  36           HA       ASN  36  -0.361  -2.401 -13.471
  264   1HB   ASN  36          2HB       ASN  36   1.281  -0.457 -13.646
  265   2HB   ASN  36          1HB       ASN  36   2.480  -1.538 -12.956
  266   1HD2  ASN  36          1HD2      ASN  36   2.200  -0.195 -15.561
  267   2HD2  ASN  36          2HD2      ASN  36   2.372  -1.439 -16.740
  268    H    ARG  37           H        ARG  37   0.276  -4.440 -13.950
  269    HA   ARG  37           HA       ARG  37   0.850  -6.211 -11.805
  270   1HB   ARG  37          2HB       ARG  37  -0.497  -6.745 -13.864
  271   2HB   ARG  37          1HB       ARG  37   0.994  -6.756 -14.778
  272   1HG   ARG  37          2HG       ARG  37   1.768  -8.550 -13.107
  273   2HG   ARG  37          1HG       ARG  37   0.055  -8.690 -12.707
  274   1HD   ARG  37          2HD       ARG  37   1.385  -9.165 -15.369
  275   2HD   ARG  37          1HD       ARG  37   0.507 -10.323 -14.372
  276    HE   ARG  37           HE       ARG  37  -1.215  -8.215 -15.072
  277   1HH1  ARG  37          1HH1      ARG  37   0.438 -10.935 -16.523
  278   2HH1  ARG  37          2HH1      ARG  37  -0.746 -11.162 -17.769
  279   1HH2  ARG  37          1HH2      ARG  37  -2.765  -8.461 -16.737
  280   2HH2  ARG  37          2HH2      ARG  37  -2.570  -9.745 -17.905
  281    H    VAL  38           H        VAL  38   2.716  -4.775 -14.412
  282    HA   VAL  38           HA       VAL  38   5.047  -6.363 -14.081
  283    HB   VAL  38           HB       VAL  38   4.841  -3.587 -15.274
  284   1HG1  VAL  38          1HG1      VAL  38   6.909  -5.757 -15.620
  285   2HG1  VAL  38          2HG1      VAL  38   7.132  -4.220 -14.785
  286   3HG1  VAL  38          3HG1      VAL  38   6.854  -4.243 -16.526
  287   1HG2  VAL  38          1HG2      VAL  38   4.626  -4.739 -17.433
  288   2HG2  VAL  38          2HG2      VAL  38   3.278  -5.097 -16.353
  289   3HG2  VAL  38          3HG2      VAL  38   4.558  -6.286 -16.587
  290    H    THR  39           H        THR  39   4.113  -3.146 -12.910
  291    HA   THR  39           HA       THR  39   6.542  -2.495 -11.665
  292    HB   THR  39           HB       THR  39   3.791  -1.581 -10.800
  293    HG1  THR  39           1HG      THR  39   5.335  -1.010 -13.078
  294   1HG2  THR  39          1HG2      THR  39   4.990   0.485 -10.180
  295   2HG2  THR  39          2HG2      THR  39   6.514  -0.275 -10.641
  296   3HG2  THR  39          3HG2      THR  39   5.585  -0.916  -9.287
  297    H    LEU  40           H        LEU  40   3.692  -4.223 -10.505
  298    HA   LEU  40           HA       LEU  40   4.432  -4.464  -7.804
  299   1HB   LEU  40          2HB       LEU  40   2.182  -4.958  -8.593
  300   2HB   LEU  40          1HB       LEU  40   2.786  -6.305  -9.538
  301    HG   LEU  40           HG       LEU  40   3.509  -7.386  -7.392
  302   1HD1  LEU  40          1HD1      LEU  40   2.471  -6.580  -5.323
  303   2HD1  LEU  40          2HD1      LEU  40   1.880  -5.160  -6.183
  304   3HD1  LEU  40          3HD1      LEU  40   3.613  -5.416  -5.990
  305   1HD2  LEU  40          1HD2      LEU  40   1.276  -8.144  -6.811
  306   2HD2  LEU  40          2HD2      LEU  40   1.470  -8.027  -8.562
  307   3HD2  LEU  40          3HD2      LEU  40   0.573  -6.783  -7.688
  308    H    LYS  41           H        LYS  41   4.979  -6.613 -10.569
  309    HA   LYS  41           HA       LYS  41   6.288  -8.680  -9.215
  310   1HB   LYS  41          2HB       LYS  41   5.451  -8.716 -11.590
  311   2HB   LYS  41          1HB       LYS  41   6.853  -7.761 -12.037
  312   1HG   LYS  41          2HG       LYS  41   8.310  -9.568 -11.188
  313   2HG   LYS  41          1HG       LYS  41   6.870 -10.537 -10.878
  314   1HD   LYS  41          2HD       LYS  41   6.308 -10.483 -13.255
  315   2HD   LYS  41          1HD       LYS  41   7.719  -9.474 -13.575
  316   1HE   LYS  41          2HE       LYS  41   9.151 -11.304 -12.685
  317   2HE   LYS  41          1HE       LYS  41   7.710 -12.307 -12.546
  318   1HZ   LYS  41          1HZ       LYS  41   8.999 -12.710 -14.591
  319   2HZ   LYS  41          2HZ       LYS  41   8.686 -11.122 -15.092
  320   3HZ   LYS  41          3HZ       LYS  41   7.406 -12.220 -14.910
  321    H    ASN  42           H        ASN  42   7.499  -5.744 -10.706
  322    HA   ASN  42           HA       ASN  42  10.235  -6.177 -10.446
  323   1HB   ASN  42          2HB       ASN  42   8.644  -3.616 -10.443
  324   2HB   ASN  42          1HB       ASN  42  10.402  -3.647 -10.434
  325   1HD2  ASN  42          1HD2      ASN  42   8.573  -2.603 -12.438
  326   2HD2  ASN  42          2HD2      ASN  42   8.954  -3.425 -13.905
  327    H    TRP  43           H        TRP  43   7.943  -4.863  -8.079
  328    HA   TRP  43           HA       TRP  43   9.840  -4.128  -6.127
  329   1HB   TRP  43          2HB       TRP  43   6.948  -4.958  -5.883
  330   2HB   TRP  43          1HB       TRP  43   7.905  -4.455  -4.496
  331    HD1  TRP  43           HD       TRP  43   9.201  -2.230  -6.925
  332    HE1  TRP  43           1HE      TRP  43   7.936   0.009  -7.000
  333    HE3  TRP  43           3HE      TRP  43   4.959  -3.591  -4.406
  334    HZ2  TRP  43           2HZ      TRP  43   5.477   1.050  -6.140
  335    HZ3  TRP  43           3HZ      TRP  43   3.189  -1.912  -4.097
  336    HH2  TRP  43           HH       TRP  43   3.442   0.366  -4.945
  337    H    ILE  44           H        ILE  44   8.050  -7.119  -6.662
  338    HA   ILE  44           HA       ILE  44   8.938  -8.523  -4.403
  339    HB   ILE  44           HB       ILE  44   8.210  -9.688  -7.102
  340   1HG1  ILE  44          2HG1      ILE  44   6.401  -9.145  -4.740
  341   2HG1  ILE  44          1HG1      ILE  44   6.512  -8.100  -6.148
  342   1HG2  ILE  44          1HG2      ILE  44   8.156 -10.867  -4.327
  343   2HG2  ILE  44          2HG2      ILE  44   9.258 -11.305  -5.632
  344   3HG2  ILE  44          3HG2      ILE  44   7.536 -11.656  -5.780
  345   1HD1  ILE  44          1HD1      ILE  44   5.734  -9.933  -7.564
  346   2HD1  ILE  44          2HD1      ILE  44   4.577  -9.546  -6.289
  347   3HD1  ILE  44          3HD1      ILE  44   5.613 -10.966  -6.140
  348    H    ILE  45           H        ILE  45  10.232  -8.353  -7.691
  349    HA   ILE  45           HA       ILE  45  12.293 -10.278  -7.280
  350    HB   ILE  45           HB       ILE  45  12.060  -8.163  -9.434
  351   1HG1  ILE  45          2HG1      ILE  45  11.260 -11.088  -9.447
  352   2HG1  ILE  45          1HG1      ILE  45  10.144  -9.727  -9.352
  353   1HG2  ILE  45          1HG2      ILE  45  14.339  -9.004  -9.202
  354   2HG2  ILE  45          2HG2      ILE  45  13.613  -9.574 -10.705
  355   3HG2  ILE  45          3HG2      ILE  45  13.751 -10.663  -9.324
  356   1HD1  ILE  45          1HD1      ILE  45  11.988 -10.326 -11.652
  357   2HD1  ILE  45          2HD1      ILE  45  10.828  -9.000 -11.565
  358   3HD1  ILE  45          3HD1      ILE  45  10.259 -10.671 -11.593
  359    H    LYS  46           H        LYS  46  12.072  -6.807  -6.882
  360    HA   LYS  46           HA       LYS  46  14.929  -6.432  -6.796
  361   1HB   LYS  46          2HB       LYS  46  13.371  -4.680  -7.618
  362   2HB   LYS  46          1HB       LYS  46  12.721  -4.528  -5.993
  363   1HG   LYS  46          2HG       LYS  46  14.913  -3.806  -5.184
  364   2HG   LYS  46          1HG       LYS  46  15.558  -3.944  -6.822
  365   1HD   LYS  46          2HD       LYS  46  13.818  -2.309  -7.552
  366   2HD   LYS  46          1HD       LYS  46  13.400  -2.079  -5.854
  367   1HE   LYS  46          2HE       LYS  46  14.912  -0.333  -6.553
  368   2HE   LYS  46          1HE       LYS  46  15.723  -1.393  -5.402
  369   1HZ   LYS  46          1HZ       LYS  46  16.740  -2.541  -7.337
  370   2HZ   LYS  46          2HZ       LYS  46  17.215  -0.921  -7.180
  371   3HZ   LYS  46          3HZ       LYS  46  16.070  -1.356  -8.352
  372    H    TYR  47           H        TYR  47  12.310  -6.645  -4.421
  373    HA   TYR  47           HA       TYR  47  14.223  -6.013  -2.310
  374   1HB   TYR  47          2HB       TYR  47  11.206  -6.096  -2.286
  375   2HB   TYR  47          1HB       TYR  47  12.203  -5.721  -0.885
  376    HD1  TYR  47           1HD      TYR  47  13.664  -3.678  -0.941
  377    HD2  TYR  47           2HD      TYR  47  10.717  -4.443  -3.907
  378    HE1  TYR  47           1HE      TYR  47  13.747  -1.318  -1.626
  379    HE2  TYR  47           2HE      TYR  47  10.791  -2.088  -4.601
  380    HH   TYR  47           HH       TYR  47  13.224   0.081  -3.497
  381    H    GLY  48           H        GLY  48  12.052  -8.696  -3.256
  382   1HA   GLY  48          2HA       GLY  48  13.347 -10.244  -1.101
  383   2HA   GLY  48          1HA       GLY  48  11.596 -10.180  -1.158
  384    H    SER  49           H        SER  49  14.033 -10.599  -3.723
  385    HA   SER  49           HA       SER  49  12.481 -12.839  -4.725
  386   1HB   SER  49          2HB       SER  49  14.138 -12.743  -6.623
  387   2HB   SER  49          1HB       SER  49  13.191 -11.274  -6.387
  388    HG   SER  49           HG       SER  49  14.986 -10.241  -6.090
  389    H    ASN  50           H        ASN  50  15.876 -12.239  -3.845
  390    HA   ASN  50           HA       ASN  50  16.398 -15.111  -4.034
  391   1HB   ASN  50          2HB       ASN  50  17.817 -13.355  -5.211
  392   2HB   ASN  50          1HB       ASN  50  18.413 -12.897  -3.621
  393   1HD2  ASN  50          1HD2      ASN  50  19.851 -14.249  -2.561
  394   2HD2  ASN  50          2HD2      ASN  50  20.604 -15.601  -3.332
  395    H    HIS  51           H        HIS  51  16.085 -12.579  -1.710
  396    HA   HIS  51           HA       HIS  51  16.693 -14.533   0.402
  397   1HB   HIS  51          2HB       HIS  51  17.584 -11.651   0.298
  398   2HB   HIS  51          1HB       HIS  51  17.516 -12.567   1.799
  399    HD1  HIS  51           1HD      HIS  51  19.053 -14.819   1.794
  400    HD2  HIS  51           2HD      HIS  51  19.905 -11.937  -1.086
  401    HE1  HIS  51           1HE      HIS  51  21.389 -15.324   0.994
  402    HE2  HIS  51           2HE      HIS  51  21.907 -13.543  -0.716
  403    H    ASN  52           H        ASN  52  14.887 -14.924   1.464
  404    HA   ASN  52           HA       ASN  52  12.712 -13.042   1.450
  405   1HB   ASN  52          2HB       ASN  52  13.030 -15.831   2.552
  406   2HB   ASN  52          1HB       ASN  52  11.583 -14.869   2.804
  407   1HD2  ASN  52          1HD2      ASN  52  10.196 -14.486   1.097
  408   2HD2  ASN  52          2HD2      ASN  52  10.304 -15.341  -0.403
  409    H    VAL  53           H        VAL  53  14.065 -11.462   2.615
  410    HA   VAL  53           HA       VAL  53  14.497 -11.895   5.437
  411    HB   VAL  53           HB       VAL  53  14.631  -9.313   3.856
  412   1HG1  VAL  53          1HG1      VAL  53  16.044  -8.515   5.708
  413   2HG1  VAL  53          2HG1      VAL  53  15.748 -10.025   6.572
  414   3HG1  VAL  53          3HG1      VAL  53  14.413  -8.919   6.250
  415   1HG2  VAL  53          1HG2      VAL  53  16.842 -11.233   4.594
  416   2HG2  VAL  53          2HG2      VAL  53  17.048  -9.683   3.779
  417   3HG2  VAL  53          3HG2      VAL  53  16.180 -10.991   2.976
  418    H    GLN  54           H        GLN  54  12.087 -10.568   3.356
  419    HA   GLN  54           HA       GLN  54  10.554  -9.282   5.398
  420   1HB   GLN  54          2HB       GLN  54   9.841 -10.147   2.588
  421   2HB   GLN  54          1HB       GLN  54   8.766  -9.235   3.636
  422   1HG   GLN  54          2HG       GLN  54   9.775  -7.706   2.135
  423   2HG   GLN  54          1HG       GLN  54  10.492  -7.437   3.719
  424   1HE2  GLN  54          1HE2      GLN  54  12.333  -6.482   2.885
  425   2HE2  GLN  54          2HE2      GLN  54  13.554  -7.366   2.032
  426    H    GLY  55           H        GLY  55   9.422 -10.322   6.901
  427   1HA   GLY  55          2HA       GLY  55   8.808 -13.128   6.645
  428   2HA   GLY  55          1HA       GLY  55   8.426 -12.093   8.016
  429    H    THR  56           H        THR  56   6.281 -12.458   8.319
  430    HA   THR  56           HA       THR  56   4.534 -11.603   6.136
  431    HB   THR  56           HB       THR  56   2.948 -13.510   6.741
  432    HG1  THR  56           1HG      THR  56   5.291 -14.905   7.516
  433   1HG2  THR  56          1HG2      THR  56   5.530 -14.139   5.312
  434   2HG2  THR  56          2HG2      THR  56   4.085 -13.425   4.598
  435   3HG2  THR  56          3HG2      THR  56   4.051 -15.085   5.195
  436    H    THR  57           H        THR  57   4.126  -9.773   7.282
  437    HA   THR  57           HA       THR  57   1.942 -10.134   9.182
  438    HB   THR  57           HB       THR  57   2.705  -7.963  10.321
  439    HG1  THR  57           1HG      THR  57   4.668  -7.225   9.936
  440   1HG2  THR  57          1HG2      THR  57   2.763 -10.126  11.455
  441   2HG2  THR  57          2HG2      THR  57   4.157  -9.143  11.905
  442   3HG2  THR  57          3HG2      THR  57   4.346 -10.463  10.751
  443    HA   PRO  58           HA       PRO  58   1.001  -7.721   5.415
  444   1HB   PRO  58          2HB       PRO  58  -1.571  -8.554   5.171
  445   2HB   PRO  58          1HB       PRO  58  -0.188  -9.488   4.591
  446   1HG   PRO  58          2HG       PRO  58  -1.780  -9.816   7.100
  447   2HG   PRO  58          1HG       PRO  58  -1.136 -11.055   6.008
  448   1HD   PRO  58          2HD       PRO  58   0.049 -10.389   8.365
  449   2HD   PRO  58          1HD       PRO  58   0.950 -10.990   6.958
  450    H    SER  59           H        SER  59   0.821  -5.652   5.828
  451    HA   SER  59           HA       SER  59  -0.943  -4.563   7.817
  452   1HB   SER  59          2HB       SER  59   0.433  -3.017   5.620
  453   2HB   SER  59          1HB       SER  59   0.012  -2.469   7.244
  454    HG   SER  59           HG       SER  59   2.065  -4.252   6.445
  455    H    ALA  60           H        ALA  60  -0.937  -5.046   4.350
  456    HA   ALA  60           HA       ALA  60  -3.207  -3.414   3.801
  457   1HB   ALA  60          1HB       ALA  60  -2.059  -5.685   2.189
  458   2HB   ALA  60          2HB       ALA  60  -1.565  -3.994   2.089
  459   3HB   ALA  60          3HB       ALA  60  -3.196  -4.466   1.612
  460    H    ALA  61           H        ALA  61  -2.842  -6.548   5.127
  461    HA   ALA  61           HA       ALA  61  -5.495  -7.408   4.293
  462   1HB   ALA  61          1HB       ALA  61  -4.947  -9.543   5.310
  463   2HB   ALA  61          2HB       ALA  61  -3.462  -8.859   5.975
  464   3HB   ALA  61          3HB       ALA  61  -3.652  -9.024   4.230
  465    H    VAL  62           H        VAL  62  -4.297  -5.512   6.677
  466    HA   VAL  62           HA       VAL  62  -5.701  -6.409   8.964
  467    HB   VAL  62           HB       VAL  62  -4.827  -3.601   8.253
  468   1HG1  VAL  62          1HG1      VAL  62  -6.551  -3.577   9.985
  469   2HG1  VAL  62          2HG1      VAL  62  -4.982  -3.134  10.657
  470   3HG1  VAL  62          3HG1      VAL  62  -5.632  -4.751  10.927
  471   1HG2  VAL  62          1HG2      VAL  62  -3.486  -5.686   9.973
  472   2HG2  VAL  62          2HG2      VAL  62  -2.897  -4.052   9.667
  473   3HG2  VAL  62          3HG2      VAL  62  -2.986  -5.221   8.349
  474    H    SER  63           H        SER  63  -6.593  -4.555   6.175
  475    HA   SER  63           HA       SER  63  -8.981  -3.399   7.037
  476   1HB   SER  63          2HB       SER  63  -8.444  -4.477   4.264
  477   2HB   SER  63          1HB       SER  63  -9.507  -3.146   4.712
  478    HG   SER  63           HG       SER  63  -7.599  -2.033   5.459
  479    H    GLU  64           H        GLU  64  -8.256  -6.650   5.919
  480    HA   GLU  64           HA       GLU  64 -11.006  -7.440   5.712
  481   1HB   GLU  64          2HB       GLU  64  -9.246  -8.470   4.323
  482   2HB   GLU  64          1HB       GLU  64  -8.506  -9.135   5.773
  483   1HG   GLU  64          2HG       GLU  64 -10.432 -10.524   6.175
  484   2HG   GLU  64          1HG       GLU  64 -11.287  -9.783   4.822
  485    H    ALA  65           H        ALA  65  -8.581  -7.432   8.162
  486    HA   ALA  65           HA       ALA  65  -9.597  -9.410   9.883
  487   1HB   ALA  65          1HB       ALA  65  -8.251  -8.382  11.617
  488   2HB   ALA  65          2HB       ALA  65  -8.083  -6.918  10.649
  489   3HB   ALA  65          3HB       ALA  65  -7.358  -8.425  10.096
  490    H    GLU  66           H        GLU  66 -10.636  -6.209   9.188
  491    HA   GLU  66           HA       GLU  66 -12.050  -5.499  11.478
  492   1HB   GLU  66          2HB       GLU  66 -11.634  -3.987   9.601
  493   2HB   GLU  66          1HB       GLU  66 -12.684  -4.952   8.578
  494   1HG   GLU  66          2HG       GLU  66 -14.557  -4.406  10.145
  495   2HG   GLU  66          1HG       GLU  66 -13.465  -3.268  10.934
  496    H    GLN  67           H        GLN  67 -13.227  -7.218   8.594
  497    HA   GLN  67           HA       GLN  67 -15.767  -7.775   9.820
  498   1HB   GLN  67          2HB       GLN  67 -16.198  -9.072   7.732
  499   2HB   GLN  67          1HB       GLN  67 -15.729  -7.405   7.443
  500   1HG   GLN  67          2HG       GLN  67 -13.380  -8.268   7.099
  501   2HG   GLN  67          1HG       GLN  67 -14.082  -9.883   7.069
  502   1HE2  GLN  67          1HE2      GLN  67 -13.840  -6.825   5.464
  503   2HE2  GLN  67          2HE2      GLN  67 -14.429  -7.354   3.923
  504    H    ILE  68           H        ILE  68 -12.739  -9.461   9.324
  505    HA   ILE  68           HA       ILE  68 -13.639 -12.086   9.762
  506    HB   ILE  68           HB       ILE  68 -10.925 -10.853  10.223
  507   1HG1  ILE  68          2HG1      ILE  68 -11.646 -10.850   7.895
  508   2HG1  ILE  68          1HG1      ILE  68 -10.353 -12.020   8.126
  509   1HG2  ILE  68          1HG2      ILE  68 -10.031 -13.124  10.304
  510   2HG2  ILE  68          2HG2      ILE  68 -11.669 -13.773  10.242
  511   3HG2  ILE  68          3HG2      ILE  68 -11.150 -12.822  11.632
  512   1HD1  ILE  68          1HD1      ILE  68 -11.969 -13.831   8.142
  513   2HD1  ILE  68          2HD1      ILE  68 -12.114 -12.872   6.667
  514   3HD1  ILE  68          3HD1      ILE  68 -13.286 -12.670   7.970
  515    H    ARG  69           H        ARG  69 -12.591  -9.578  12.035
  516    HA   ARG  69           HA       ARG  69 -12.343 -11.238  14.280
  517   1HB   ARG  69          2HB       ARG  69 -12.442  -9.222  15.633
  518   2HB   ARG  69          1HB       ARG  69 -11.455  -8.943  14.208
  519   1HG   ARG  69          2HG       ARG  69 -12.658  -7.009  14.245
  520   2HG   ARG  69          1HG       ARG  69 -13.715  -7.999  13.238
  521   1HD   ARG  69          2HD       ARG  69 -14.956  -8.615  15.336
  522   2HD   ARG  69          1HD       ARG  69 -14.005  -7.389  16.173
  523    HE   ARG  69           HE       ARG  69 -15.078  -6.037  14.078
  524   1HH1  ARG  69          1HH1      ARG  69 -16.427  -8.056  16.596
  525   2HH1  ARG  69          2HH1      ARG  69 -17.955  -7.228  16.639
  526   1HH2  ARG  69          1HH2      ARG  69 -17.074  -4.939  14.110
  527   2HH2  ARG  69          2HH2      ARG  69 -18.336  -5.462  15.199
  528    H    GLN  70           H        GLN  70 -15.171  -9.796  12.810
  529    HA   GLN  70           HA       GLN  70 -16.926 -10.457  14.988
  530   1HB   GLN  70          2HB       GLN  70 -17.122  -8.599  13.163
  531   2HB   GLN  70          1HB       GLN  70 -17.806  -9.880  12.181
  532   1HG   GLN  70          2HG       GLN  70 -18.944  -9.473  14.882
  533   2HG   GLN  70          1HG       GLN  70 -19.270  -8.254  13.659
  534   1HE2  GLN  70          1HE2      GLN  70 -21.463  -8.729  13.606
  535   2HE2  GLN  70          2HE2      GLN  70 -22.081 -10.191  12.904
  536    H    LEU  71           H        LEU  71 -16.341 -11.679  11.713
  537    HA   LEU  71           HA       LEU  71 -18.354 -13.636  11.748
  538   1HB   LEU  71          2HB       LEU  71 -16.042 -12.957  10.024
  539   2HB   LEU  71          1HB       LEU  71 -16.724 -14.554   9.851
  540    HG   LEU  71           HG       LEU  71 -18.924 -13.560   9.343
  541   1HD1  LEU  71          1HD1      LEU  71 -18.699 -11.469  10.572
  542   2HD1  LEU  71          2HD1      LEU  71 -19.104 -11.168   8.882
  543   3HD1  LEU  71          3HD1      LEU  71 -17.451 -10.930   9.444
  544   1HD2  LEU  71          1HD2      LEU  71 -17.424 -14.150   7.528
  545   2HD2  LEU  71          2HD2      LEU  71 -16.657 -12.564   7.625
  546   3HD2  LEU  71          3HD2      LEU  71 -18.342 -12.701   7.123
  547    H    LYS  72           H        LYS  72 -14.959 -13.759  12.672
  548    HA   LYS  72           HA       LYS  72 -14.863 -16.620  12.698
  549   1HB   LYS  72          2HB       LYS  72 -12.882 -15.125  12.326
  550   2HB   LYS  72          1HB       LYS  72 -12.947 -14.709  14.032
  551   1HG   LYS  72          2HG       LYS  72 -12.370 -16.894  14.695
  552   2HG   LYS  72          1HG       LYS  72 -12.675 -17.547  13.084
  553   1HD   LYS  72          2HD       LYS  72 -10.786 -16.228  12.218
  554   2HD   LYS  72          1HD       LYS  72 -10.465 -15.642  13.852
  555   1HE   LYS  72          2HE       LYS  72  -9.900 -17.812  14.619
  556   2HE   LYS  72          1HE       LYS  72 -10.525 -18.568  13.154
  557   1HZ   LYS  72          1HZ       LYS  72  -8.741 -17.505  11.902
  558   2HZ   LYS  72          2HZ       LYS  72  -8.128 -18.505  13.122
  559   3HZ   LYS  72          3HZ       LYS  72  -8.127 -16.820  13.326
  560    H    LYS  73           H        LYS  73 -15.943 -14.241  14.892
  561    HA   LYS  73           HA       LYS  73 -17.035 -14.395  16.869
  562   1HB   LYS  73          2HB       LYS  73 -18.016 -16.456  15.944
  563   2HB   LYS  73          1HB       LYS  73 -16.668 -17.380  16.580
  564   1HG   LYS  73          2HG       LYS  73 -17.332 -16.912  18.833
  565   2HG   LYS  73          1HG       LYS  73 -18.583 -15.799  18.274
  566   1HD   LYS  73          2HD       LYS  73 -19.843 -17.564  17.309
  567   2HD   LYS  73          1HD       LYS  73 -18.520 -18.711  17.516
  568   1HE   LYS  73          2HE       LYS  73 -19.996 -17.365  19.775
  569   2HE   LYS  73          1HE       LYS  73 -20.348 -18.985  19.172
  570   1HZ   LYS  73          1HZ       LYS  73 -17.768 -18.089  20.355
  571   2HZ   LYS  73          2HZ       LYS  73 -18.082 -19.640  19.744
  572   3HZ   LYS  73          3HZ       LYS  73 -18.921 -19.083  21.107
  573    H    GLU  74           H        GLU  74 -16.381 -13.966  18.855
  574    HA   GLU  74           HA       GLU  74 -14.990 -13.560  20.591
  575   1HB   GLU  74          2HB       GLU  74 -14.045 -16.312  19.870
  576   2HB   GLU  74          1HB       GLU  74 -13.179 -15.373  21.073
  577   1HG   GLU  74          2HG       GLU  74 -14.597 -16.617  22.373
  578   2HG   GLU  74          1HG       GLU  74 -15.510 -15.122  22.181
  579    H    ASN  75           H        ASN  75 -12.648 -15.307  18.621
  580    HA   ASN  75           HA       ASN  75 -10.645 -14.742  17.731
  581   1HB   ASN  75          2HB       ASN  75 -12.407 -13.192  16.505
  582   2HB   ASN  75          1HB       ASN  75 -11.553 -11.909  17.355
  583   1HD2  ASN  75          1HD2      ASN  75 -11.765 -12.637  14.478
  584   2HD2  ASN  75          2HD2      ASN  75 -10.132 -12.760  13.926
  585    H    ALA  76           H        ALA  76  -9.297 -12.185  17.819
  586    HA   ALA  76           HA       ALA  76  -7.928 -12.480  20.244
  587   1HB   ALA  76          1HB       ALA  76  -6.883 -11.610  18.224
  588   2HB   ALA  76          2HB       ALA  76  -6.682 -10.498  19.579
  589   3HB   ALA  76          3HB       ALA  76  -7.878 -10.157  18.328
  590    H    LEU  77           H        LEU  77 -10.821 -10.806  19.574
  591    HA   LEU  77           HA       LEU  77 -10.672  -8.571  21.227
  592   1HB   LEU  77          2HB       LEU  77 -13.064 -10.311  20.611
  593   2HB   LEU  77          1HB       LEU  77 -13.127  -8.693  21.268
  594    HG   LEU  77           HG       LEU  77 -12.051  -9.408  18.542
  595   1HD1  LEU  77          1HD1      LEU  77 -14.077  -8.344  17.694
  596   2HD1  LEU  77          2HD1      LEU  77 -14.648  -8.100  19.345
  597   3HD1  LEU  77          3HD1      LEU  77 -14.465  -9.734  18.706
  598   1HD2  LEU  77          1HD2      LEU  77 -10.967  -7.433  19.460
  599   2HD2  LEU  77          2HD2      LEU  77 -12.536  -6.732  19.852
  600   3HD2  LEU  77          3HD2      LEU  77 -12.077  -6.976  18.167
  601    H    GLN  78           H        GLN  78 -11.466 -11.919  21.948
  602    HA   GLN  78           HA       GLN  78 -12.444 -11.518  24.568
  603   1HB   GLN  78          2HB       GLN  78 -12.730 -13.576  23.118
  604   2HB   GLN  78          1HB       GLN  78 -11.069 -13.994  23.512
  605   1HG   GLN  78          2HG       GLN  78 -12.479 -15.252  24.934
  606   2HG   GLN  78          1HG       GLN  78 -11.725 -14.001  25.920
  607   1HE2  GLN  78          1HE2      GLN  78 -12.981 -12.377  26.792
  608   2HE2  GLN  78          2HE2      GLN  78 -14.713 -12.411  26.768
  609    H    ARG  79           H        ARG  79  -9.215 -11.923  23.263
  610    HA   ARG  79           HA       ARG  79  -8.061 -12.347  25.893
  611   1HB   ARG  79          2HB       ARG  79  -7.268 -13.626  23.912
  612   2HB   ARG  79          1HB       ARG  79  -6.699 -12.123  23.207
  613   1HG   ARG  79          2HG       ARG  79  -5.106 -11.842  25.007
  614   2HG   ARG  79          1HG       ARG  79  -5.703 -13.308  25.791
  615   1HD   ARG  79          2HD       ARG  79  -5.016 -14.623  23.842
  616   2HD   ARG  79          1HD       ARG  79  -4.423 -13.158  23.062
  617    HE   ARG  79           HE       ARG  79  -3.222 -13.564  25.620
  618   1HH1  ARG  79          1HH1      ARG  79  -3.106 -14.643  22.278
  619   2HH1  ARG  79          2HH1      ARG  79  -1.416 -15.041  22.341
  620   1HH2  ARG  79          1HH2      ARG  79  -1.016 -14.117  25.709
  621   2HH2  ARG  79          2HH2      ARG  79  -0.234 -14.756  24.297
  622    H    ALA  80           H        ALA  80  -8.510  -9.819  23.604
  623    HA   ALA  80           HA       ALA  80  -6.479  -8.073  24.619
  624   1HB   ALA  80          1HB       ALA  80  -8.879  -7.452  22.901
  625   2HB   ALA  80          2HB       ALA  80  -7.270  -7.880  22.318
  626   3HB   ALA  80          3HB       ALA  80  -7.517  -6.371  23.197
  627    H    ARG  81           H        ARG  81  -9.768  -8.754  25.400
  628    HA   ARG  81           HA       ARG  81 -10.454  -6.459  26.821
  629   1HB   ARG  81          2HB       ARG  81 -11.857  -8.366  25.845
  630   2HB   ARG  81          1HB       ARG  81 -11.425  -9.261  27.293
  631   1HG   ARG  81          2HG       ARG  81 -12.342  -7.406  28.611
  632   2HG   ARG  81          1HG       ARG  81 -12.942  -6.705  27.115
  633   1HD   ARG  81          2HD       ARG  81 -14.229  -8.751  26.685
  634   2HD   ARG  81          1HD       ARG  81 -13.645  -9.430  28.202
  635    HE   ARG  81           HE       ARG  81 -15.203  -6.936  28.219
  636   1HH1  ARG  81          1HH1      ARG  81 -14.824 -10.293  29.113
  637   2HH1  ARG  81          2HH1      ARG  81 -16.202 -10.304  30.164
  638   1HH2  ARG  81          1HH2      ARG  81 -17.038  -6.951  29.576
  639   2HH2  ARG  81          2HH2      ARG  81 -17.468  -8.409  30.423
  640    H    THR  82           H        THR  82  -8.509  -9.180  27.545
  641    HA   THR  82           HA       THR  82  -8.910  -9.108  30.397
  642    HB   THR  82           HB       THR  82  -6.848 -10.718  28.897
  643    HG1  THR  82           1HG      THR  82  -8.528 -12.321  28.786
  644   1HG2  THR  82          1HG2      THR  82  -7.149 -12.298  30.752
  645   2HG2  THR  82          2HG2      THR  82  -8.325 -11.210  31.491
  646   3HG2  THR  82          3HG2      THR  82  -6.638 -10.717  31.343
  647    H    ARG  83           H        ARG  83  -6.791  -7.565  28.201
  648    HA   ARG  83           HA       ARG  83  -4.995  -6.868  30.417
  649   1HB   ARG  83          2HB       ARG  83  -4.340  -7.368  27.523
  650   2HB   ARG  83          1HB       ARG  83  -3.270  -6.475  28.585
  651   1HG   ARG  83          2HG       ARG  83  -3.376  -8.521  30.116
  652   2HG   ARG  83          1HG       ARG  83  -4.062  -9.355  28.720
  653   1HD   ARG  83          2HD       ARG  83  -1.657  -9.710  28.824
  654   2HD   ARG  83          1HD       ARG  83  -2.076  -8.758  27.401
  655    HE   ARG  83           HE       ARG  83  -1.467  -7.010  29.508
  656   1HH1  ARG  83          1HH1      ARG  83   0.153  -9.338  27.449
  657   2HH1  ARG  83          2HH1      ARG  83   1.676  -8.496  27.483
  658   1HH2  ARG  83          1HH2      ARG  83   0.541  -5.911  29.565
  659   2HH2  ARG  83          2HH2      ARG  83   1.892  -6.541  28.670
  660    H    HIS  84           H        HIS  84  -3.891  -4.791  30.165
  661    HA   HIS  84           HA       HIS  84  -5.535  -2.804  28.737
  662   1HB   HIS  84          2HB       HIS  84  -5.600  -2.528  31.180
  663   2HB   HIS  84          1HB       HIS  84  -3.842  -2.478  31.231
  664    HD1  HIS  84           1HD      HIS  84  -2.734  -0.237  30.875
  665    HD2  HIS  84           2HD      HIS  84  -6.793  -0.200  29.952
  666    HE1  HIS  84           1HE      HIS  84  -3.325   2.179  30.499
  667    HE2  HIS  84           2HE      HIS  84  -5.759   2.172  29.836
  668    HA   PRO  85           HA       PRO  85  -1.765  -2.382  26.339
  669   1HB   PRO  85          2HB       PRO  85  -2.681  -0.501  24.625
  670   2HB   PRO  85          1HB       PRO  85  -3.157  -2.200  24.508
  671   1HG   PRO  85          2HG       PRO  85  -4.638   0.107  25.716
  672   2HG   PRO  85          1HG       PRO  85  -5.248  -1.197  24.681
  673   1HD   PRO  85          2HD       PRO  85  -5.545  -1.197  27.382
  674   2HD   PRO  85          1HD       PRO  85  -5.401  -2.684  26.426
  675    H    ALA  86           H        ALA  86  -0.423  -0.461  25.564
  676    HA   ALA  86           HA       ALA  86  -0.471   1.659  27.610
  677   1HB   ALA  86          1HB       ALA  86   1.384   0.116  27.970
  678   2HB   ALA  86          2HB       ALA  86   1.959   1.720  27.520
  679   3HB   ALA  86          3HB       ALA  86   1.965   0.419  26.328
  680    H    GLU  87           H        GLU  87  -1.165   3.455  26.667
  681    HA   GLU  87           HA       GLU  87  -0.936   3.936  23.866
  682   1HB   GLU  87          2HB       GLU  87  -1.890   6.163  24.403
  683   2HB   GLU  87          1HB       GLU  87  -2.819   4.834  25.077
  684   1HG   GLU  87          2HG       GLU  87  -1.631   5.226  27.247
  685   2HG   GLU  87          1HG       GLU  87  -0.949   6.685  26.530
  686    H    SER  88           H        SER  88   1.020   4.666  26.606
  687    HA   SER  88           HA       SER  88   2.505   6.823  25.576
  688   1HB   SER  88          2HB       SER  88   4.234   5.986  27.273
  689   2HB   SER  88          1HB       SER  88   2.638   6.405  27.905
  690    HG   SER  88           HG       SER  88   3.478   4.363  28.672
  691    H    CYS  89           H        CYS  89   2.829   3.344  25.260
  692    HA   CYS  89           HA       CYS  89   5.309   3.562  23.779
  693   1HB   CYS  89          2HB       CYS  89   4.878   1.679  25.360
  694   2HB   CYS  89          1HB       CYS  89   3.586   1.131  24.299
  695    HG   CYS  89           HG       CYS  89   5.168   0.319  22.249
  696    H    LEU  90           H        LEU  90   1.934   3.346  23.192
  697    HA   LEU  90           HA       LEU  90   2.028   2.379  20.521
  698   1HB   LEU  90          2HB       LEU  90  -0.003   2.269  21.893
  699   2HB   LEU  90          1HB       LEU  90  -0.087   4.020  21.920
  700    HG   LEU  90           HG       LEU  90  -0.421   4.000  19.450
  701   1HD1  LEU  90          1HD1      LEU  90  -1.008   1.886  18.366
  702   2HD1  LEU  90          2HD1      LEU  90  -0.605   1.014  19.845
  703   3HD1  LEU  90          3HD1      LEU  90   0.652   1.872  18.955
  704   1HD2  LEU  90          1HD2      LEU  90  -2.324   4.144  20.969
  705   2HD2  LEU  90          2HD2      LEU  90  -2.400   2.384  21.059
  706   3HD2  LEU  90          3HD2      LEU  90  -2.737   3.203  19.534
  707    H    GLU  91           H        GLU  91   1.855   5.610  21.946
  708    HA   GLU  91           HA       GLU  91   1.781   7.029  19.497
  709   1HB   GLU  91          2HB       GLU  91   1.049   8.027  21.606
  710   2HB   GLU  91          1HB       GLU  91   2.684   7.922  22.244
  711   1HG   GLU  91          2HG       GLU  91   3.468   9.526  20.631
  712   2HG   GLU  91          1HG       GLU  91   1.895   9.552  19.838
  713    H    HIS  92           H        HIS  92   4.354   5.712  21.426
  714    HA   HIS  92           HA       HIS  92   6.549   5.345  21.004
  715   1HB   HIS  92          2HB       HIS  92   5.981   4.764  18.726
  716   2HB   HIS  92          1HB       HIS  92   5.885   6.460  18.271
  717    HD1  HIS  92           1HD      HIS  92   7.858   7.220  17.011
  718    HD2  HIS  92           2HD      HIS  92   8.815   4.188  19.701
  719    HE1  HIS  92           1HE      HIS  92  10.309   6.755  16.677
  720    HE2  HIS  92           2HE      HIS  92  10.811   4.777  18.154
  721    H    HIS  93           H        HIS  93   7.386   6.678  22.504
  722    HA   HIS  93           HA       HIS  93   7.994   9.432  21.686
  723   1HB   HIS  93          2HB       HIS  93   7.797   8.128  24.396
  724   2HB   HIS  93          1HB       HIS  93   8.618   9.670  24.174
  725    HD1  HIS  93           1HD      HIS  93   7.095  11.660  23.242
  726    HD2  HIS  93           2HD      HIS  93   5.063   8.277  24.550
  727    HE1  HIS  93           1HE      HIS  93   4.723  12.393  23.603
  728    HE2  HIS  93           2HE      HIS  93   3.473  10.264  24.080
  729    H    HIS  94           H        HIS  94  10.152  10.194  22.768
  730    HA   HIS  94           HA       HIS  94  12.169   8.540  21.546
  731   1HB   HIS  94          2HB       HIS  94  12.201  11.297  22.740
  732   2HB   HIS  94          1HB       HIS  94  13.696  10.471  22.309
  733    HD1  HIS  94           1HD      HIS  94  14.450  10.711  19.967
  734    HD2  HIS  94           2HD      HIS  94  10.410  11.604  20.397
  735    HE1  HIS  94           1HE      HIS  94  13.697  11.555  17.717
  736    HE2  HIS  94           2HE      HIS  94  11.288  12.227  18.040
  737    H    HIS  95           H        HIS  95  12.280   6.758  22.852
  738    HA   HIS  95           HA       HIS  95  14.323   6.947  24.809
  739   1HB   HIS  95          2HB       HIS  95  13.184   6.027  26.736
  740   2HB   HIS  95          1HB       HIS  95  12.370   7.506  26.257
  741    HD1  HIS  95           1HD      HIS  95   9.903   7.367  25.988
  742    HD2  HIS  95           2HD      HIS  95  11.709   3.620  25.976
  743    HE1  HIS  95           1HE      HIS  95   8.017   5.703  26.015
  744    HE2  HIS  95           2HE      HIS  95   9.151   3.469  26.293
  745    H    HIS  96           H        HIS  96  15.180   4.855  25.335
  746    HA   HIS  96           HA       HIS  96  14.904   3.070  23.126
  747   1HB   HIS  96          2HB       HIS  96  16.711   1.842  24.035
  748   2HB   HIS  96          1HB       HIS  96  17.048   3.519  24.422
  749    HD1  HIS  96           1HD      HIS  96  17.829   0.625  25.884
  750    HD2  HIS  96           2HD      HIS  96  15.458   3.747  27.272
  751    HE1  HIS  96           1HE      HIS  96  17.795   0.392  28.388
  752    HE2  HIS  96           2HE      HIS  96  16.146   2.133  29.169
  753    H    HIS  97           H        HIS  97  13.851   1.173  22.963
  754    HA   HIS  97           HA       HIS  97  12.318   0.289  25.319
  755   1HB   HIS  97          2HB       HIS  97  10.853   1.317  23.629
  756   2HB   HIS  97          1HB       HIS  97  11.467   0.203  22.414
  757    HD1  HIS  97           1HD      HIS  97   9.566   0.104  25.698
  758    HD2  HIS  97           2HD      HIS  97  10.043  -2.102  22.203
  759    HE1  HIS  97           1HE      HIS  97   7.884  -1.763  25.837
  760    HE2  HIS  97           2HE      HIS  97   8.039  -2.940  23.612