*HEADER    HYDROLASE                               07-MAR-03   1OQ6              
*TITLE     SOLUTION STRUCTURE OF COPPER-S46V COPA FROM BACILLUS                  
*TITLE    2 SUBTILIS                                                             
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: POTENTIAL COPPER-TRANSPORTING ATPASE;                      
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: COPPER FORM OF N-TERMINAL S46V OF COPA;                    
*COMPND   5 EC: 3.6.3.4;                                                         
*COMPND   6 ENGINEERED: YES;                                                     
*COMPND   7 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS;                              
*SOURCE   3 ORGANISM_COMMON: BACTERIA;                                           
*SOURCE   4 GENE: YVGX;                                                          
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3)PLYSS;                            
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLSAMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET21A                                    
*KEYWDS    P-TYPE ATPASE, MUTATION, NMR, FOLDING, COPPER COMPLEX,                
*EXPDTA    NMR, 30 STRUCTURES                                                    
*AUTHOR    L.BANCI, I.BERTINI, S.CIOFI-BAFFONI, L.GONNELLI, X.C.SU               
*REVDAT   1   16-SEP-03 1OQ6    0                                                

  3 SER  
         HN      4 GLU  HN      4.30
         HA      4 GLU  HN      2.90
         QB      5 GLN  HN      7.00
         QB      5 GLN  HE21    7.00
         QB      5 GLN  HE22    7.00
  4 GLU  
         HN      4 GLU  HB2     3.40
         HN      4 GLU  HB3     3.40
         HN      4 GLU  QB      3.18
         HN      4 GLU  HG2     4.10
         HN      4 GLU  HG3     4.10
         HN      5 GLN  HN      5.00
         HN     52 PRO  QD      6.88
         HN     53 ALA  HN      4.60
         HA      4 GLU  HB2     2.90
         HA      4 GLU  HB3     2.90
         HA      4 GLU  HG2     3.00
         HA      4 GLU  HG3     3.00
         HA      5 GLN  HN      2.80
         HB2     4 GLU  HG2     2.90
         HB2     4 GLU  HG3     2.90
         HB2     5 GLN  HN      3.80
         HB3     4 GLU  HG2     2.90
         HB3     4 GLU  HG3     2.90
         HB3     5 GLN  HN      3.80
         HG2     5 GLN  HN      5.60
         HG3     5 GLN  HN      5.60
         QG      5 GLN  HN      5.19
  5 GLN  
         HN      5 GLN  HB2     4.00
         HN      5 GLN  HB3     4.00
         HN      5 GLN  QB      3.75
         HN      5 GLN  HG2     4.10
         HN      5 GLN  HG3     4.10
         HN      6 LYS  HN      4.70
         HN     51 ASP  HA      6.00
         HN     52 PRO  QD      6.88
         HA      5 GLN  HG2     4.00
         HA      5 GLN  HG3     4.00
         HA      5 GLN  QG      3.47
         HA      5 GLN  HE21    6.00
         HA      5 GLN  HE22    6.00
         HA      5 GLN  QE2     5.74
         HA      6 LYS  HN      3.00
         HA     49 ILE  QG2     7.00
         HA     50 TYR  HN      4.80
         HA     51 ASP  HA      3.00
         HA     52 PRO  HD2     6.00
         HA     52 PRO  HD3     6.00
         HB2     5 GLN  HE21    6.95
         HB2     5 GLN  HE22    6.95
         HB2     6 LYS  HN      4.00
         HB2    50 TYR  HN      6.00
         HB2    51 ASP  HB2     7.75
         HB2    51 ASP  HB3     7.75
         HB3     5 GLN  HE21    6.95
         HB3     5 GLN  HE22    6.95
         HB3     6 LYS  HN      4.00
         HB3    50 TYR  HN      6.00
         HB3    51 ASP  HB2     7.75
         HB3    51 ASP  HB3     7.75
         QB      6 LYS  HN      3.65
         QB     51 ASP  QB      6.52
         HG2     6 LYS  HN      5.50
         HG3     6 LYS  HN      5.50
         HE21   35 THR  QG2     7.00
         HE21   49 ILE  QG2     7.00
         HE21   49 ILE  QD1     7.00
         HE21   51 ASP  HB2     7.73
         HE21   51 ASP  HB3     7.73
         HE22   35 THR  QG2     7.00
         HE22   49 ILE  QG2     7.00
         HE22   49 ILE  QD1     7.00
         HE22   51 ASP  HB2     7.73
         HE22   51 ASP  HB3     7.73
         QE2    51 ASP  HA      6.87
         QE2    51 ASP  QB      6.36
  6 LYS  
         HN      6 LYS  HB2     4.10
         HN      6 LYS  HB3     4.10
         HN      6 LYS  QB      3.81
         HN      6 LYS  HG2     4.70
         HN      6 LYS  HG3     4.70
         HN      6 LYS  QG      4.47
         HN      6 LYS  QD      6.30
         HN      7 GLU  HN      5.50
         HN      7 GLU  HA      5.30
         HN     49 ILE  HA      5.40
         HN     49 ILE  QG2     6.20
         HN     50 TYR  HN      3.90
         HN     50 TYR  QB      6.88
         HN     50 TYR  QD      8.00
         HN     50 TYR  QE      8.00
         HN     51 ASP  HA      4.50
         HN     52 PRO  QG      6.88
         HN     52 PRO  HD2     5.70
         HN     52 PRO  HD3     5.70
         HN     52 PRO  QD      5.38
         HA      6 LYS  HG2     3.80
         HA      6 LYS  HG3     3.80
         HA      6 LYS  QG      3.45
         HA      6 LYS  QD      4.70
         HA      7 GLU  HN      2.80
         HA     50 TYR  QE      8.00
         HB2     7 GLU  HN      3.70
         HB2    50 TYR  QD      8.00
         HB2    50 TYR  QE      8.00
         HB3     7 GLU  HN      3.70
         HB3    50 TYR  QD      8.00
         HB3    50 TYR  QE      8.00
         QB      8 ILE  HN      6.08
         QB     50 TYR  HN      6.88
         HG2     7 GLU  HN      5.70
         HG3     7 GLU  HN      5.70
         QG      7 GLU  HN      5.53
         QG     50 TYR  QD      8.88
         QG     50 TYR  QE      8.88
         QD      7 GLU  HN      7.00
         QD     50 TYR  QE      9.00
  7 GLU  
         HN      7 GLU  QB      3.91
         HN      7 GLU  QG      5.30
         HN      8 ILE  HN      4.70
         HN      8 ILE  QG2     7.00
         HN     50 TYR  HN      6.00
         HA      8 ILE  HN      2.90
         HA     49 ILE  HA      2.70
         HA     49 ILE  HB      6.00
         HA     49 ILE  QG2     7.00
         HA     49 ILE  QG1     6.40
         HA     49 ILE  QD1     7.00
         HA     50 TYR  HN      4.80
         HA     50 TYR  QD      8.00
         HA     50 TYR  QE      8.00
         HB2     8 ILE  HN      4.50
         HB3     8 ILE  HN      4.50
         QB      8 ILE  HN      4.12
         QB     48 VAL  HN      6.88
         QB     49 ILE  HN      6.38
         QB     49 ILE  QG1     7.88
         QB     49 ILE  QD1     7.88
         QG      8 ILE  HN      6.50
         QG     47 ASN  HD21    7.00
         QG     47 ASN  HD22    7.00
         QG     48 VAL  HN      7.00
         QG     49 ILE  HN      7.00
         QG     49 ILE  QG1     8.00
         QG     49 ILE  QD1     8.00
         QG     50 TYR  HN      7.00
  8 ILE  
         HN      8 ILE  HB      4.00
         HN      8 ILE  QG2     4.30
         HN      8 ILE  QG1     6.20
         HN      8 ILE  QD1     4.90
         HN      9 ALA  HN      5.00
         HN     48 VAL  HN      3.20
         HN     49 ILE  HA      4.50
         HN     49 ILE  QG2     6.60
         HN     50 TYR  QD      8.00
         HN     50 TYR  QE      8.00
         HA      8 ILE  HB      2.90
         HA      8 ILE  QG2     3.40
         HA      8 ILE  QD1     4.10
         HA      9 ALA  HN      2.70
         HB      8 ILE  QD1     3.60
         HB      9 ALA  HN      3.50
         HB     48 VAL  QG1     7.00
         HB     48 VAL  QG2     7.00
         HB     50 TYR  QD      8.00
         HB     50 TYR  QE      8.00
         QG2     8 ILE  QD1     4.40
         QG2     9 ALA  HN      4.80
         QG2     9 ALA  HA      7.00
         QG2    48 VAL  HN      5.90
         QG2    48 VAL  QG1     8.00
         QG2    48 VAL  QG2     8.00
         QG2    50 TYR  QD      9.00
         QG2    50 TYR  QE      9.00
         QG2    73 ILE  QD1     8.00
         QG1     9 ALA  HN      6.70
         QG1    50 TYR  QD      9.00
         QG1    50 TYR  QE      9.00
         QD1     9 ALA  HN      5.90
         QD1    50 TYR  QD      9.00
         QD1    50 TYR  QE      9.00
         QD1    60 ILE  QD1     8.00
  9 ALA  
         HN      9 ALA  QB      3.50
         HN     10 MET  HN      5.10
         HN     10 MET  QG      6.88
         HN     47 ASN  HA      5.60
         HA     10 MET  HN      3.00
         HA     45 THR  QG2     7.00
         HA     46 VAL  HN      6.00
         HA     47 ASN  HA      2.70
         HA     47 ASN  QB      7.00
         HA     48 VAL  HN      4.70
         QB     10 MET  HN      4.10
         QB     10 MET  QG      7.88
         QB     47 ASN  HA      7.00
         QB     47 ASN  HD21    6.70
         QB     47 ASN  HD22    6.70
         QB     47 ASN  QD2     6.45
         QB     48 VAL  HN      7.00
 10 MET  
         HN     10 MET  QB      3.81
         HN     10 MET  HG2     4.60
         HN     10 MET  HG3     4.60
         HN     12 VAL  QQG     8.56
         HN     45 THR  HA      6.00
         HN     45 THR  QG2     7.00
         HN     46 VAL  HN      4.10
         HN     46 VAL  QG1     7.00
         HN     46 VAL  QG2     7.00
         HN     47 ASN  HA      4.00
         HN     48 VAL  QQG     8.56
         HA     11 GLN  HN      2.80
         HA     73 ILE  HA      4.20
         HB2    11 GLN  HN      4.10
         HB2    73 ILE  QG2     7.00
         HB3    11 GLN  HN      4.10
         HB3    73 ILE  QG2     7.00
         QB     11 GLN  HN      3.81
         HG2    11 GLN  HN      6.00
         HG2    71 VAL  QG1     8.75
         HG2    71 VAL  QG2     8.75
         HG3    11 GLN  HN      6.00
         HG3    71 VAL  QG1     8.75
         HG3    71 VAL  QG2     8.75
         QG     71 VAL  QQG     7.72
         QG     73 ILE  QG2     7.88
         QG     73 ILE  QG1     7.75
 11 GLN  
         HN     11 GLN  QG      5.90
         HN     12 VAL  HN      5.10
         HN     12 VAL  QQG     8.56
         HN     45 THR  QG2     7.00
         HN     71 VAL  QG1     7.00
         HN     71 VAL  QG2     7.00
         HN     72 VAL  HN      5.60
         HN     72 VAL  QQG     8.56
         HN     73 ILE  HA      6.00
         HA     11 GLN  QE2     6.47
         HA     12 VAL  HN      3.10
         HA     45 THR  HA      2.90
         HA     45 THR  QG2     7.00
         HA     46 VAL  HN      4.60
         QB     11 GLN  HE21    6.10
         QB     11 GLN  HE22    6.10
         QB     45 THR  QG2     8.00
         QB     46 VAL  HN      7.00
         QB     72 VAL  HN      7.00
         QB     72 VAL  QQG     9.56
         QB     73 ILE  HN      7.00
         QG     12 VAL  HN      7.00
         QG     45 THR  HA      6.40
         QG     45 THR  QG2     8.00
         QG     72 VAL  HB      7.00
         HE21   44 GLU  HB2     6.75
         HE21   44 GLU  HB3     6.75
         HE21   45 THR  QG2     7.00
         HE21   72 VAL  HB      6.00
         HE21   72 VAL  QG1     9.92
         HE21   72 VAL  QG2     9.92
         HE22   44 GLU  HB2     6.75
         HE22   44 GLU  HB3     6.75
         HE22   45 THR  QG2     7.00
         HE22   72 VAL  HB      6.00
         HE22   72 VAL  QG1     9.92
         HE22   72 VAL  QG2     9.92
         QE2    12 VAL  HA      6.87
         QE2    44 GLU  QB      5.76
         QE2    45 THR  QG2     6.46
         QE2    72 VAL  QQG     8.12
 12 VAL  
         HN     12 VAL  HB      3.70
         HN     13 SER  HN      5.20
         HN     44 GLU  HA      6.00
         HN     44 GLU  QB      6.38
         HN     45 THR  HN      6.00
         HN     45 THR  HA      4.60
         HN     45 THR  QG2     7.00
         HN     46 VAL  HN      5.80
         HA     13 SER  HN      3.10
         HA     71 VAL  HA      2.90
         HA     71 VAL  HB      4.90
         HA     71 VAL  QG1     7.00
         HA     71 VAL  QG2     7.00
         HA     72 VAL  HN      4.50
         HB     13 SER  HN      5.00
         HB     15 MET  QG      5.48
         HB     24 ILE  QD1     7.00
         QG1    13 SER  HN      5.80
         QG1    69 TYR  QD      9.00
         QG1    69 TYR  QE      9.00
         QG1    71 VAL  HB      7.00
         QG1    71 VAL  QG1     11.12
         QG1    71 VAL  QG2     11.12
         QG2    13 SER  HN      5.80
         QG2    69 TYR  QD      9.00
         QG2    69 TYR  QE      9.00
         QG2    71 VAL  HB      7.00
         QG2    71 VAL  QG1     11.12
         QG2    71 VAL  QG2     11.12
         QQG    13 SER  HN      5.38
         QQG    14 GLY  HN      8.56
         QQG    15 MET  HN      8.56
         QQG    15 MET  QG      9.44
         QQG    24 ILE  QG2     9.56
         QQG    24 ILE  QD1     9.56
         QQG    45 THR  HA      8.56
         QQG    46 VAL  HN      7.46
         QQG    69 TYR  QB      9.44
         QQG    70 HID  HN      7.96
         QQG    71 VAL  HA      8.56
         QQG    71 VAL  QQG     8.61
         QQG    72 VAL  HN      7.46
 13 SER  
         HN     13 SER  HB2     4.20
         HN     13 SER  HB3     4.20
         HN     14 GLY  HN      6.00
         HN     69 TYR  HA      6.00
         HN     70 HID  HN      4.80
         HN     70 HID  QB      6.88
         HN     71 VAL  HA      5.10
         HN     72 VAL  HN      6.00
         HA     14 GLY  HN      3.10
         HA     15 MET  HN      5.80
         HB2    14 GLY  HN      3.70
         HB2    70 HID  HB2     7.75
         HB2    70 HID  HB3     7.75
         HB3    14 GLY  HN      3.70
         HB3    70 HID  HB2     7.75
         HB3    70 HID  HB3     7.75
         QB     70 HID  HN      6.88
         QB     70 HID  QB      6.36
         QB     70 HID  HD2     6.88
         QB     71 VAL  HN      6.88
         QB     72 VAL  QQG     9.44
 14 GLY  
         HN     15 MET  HN      3.90
         HN     69 TYR  QD      8.00
         HA1    15 MET  HG2     7.75
         HA1    15 MET  HG3     7.75
         HA1    69 TYR  QD      8.00
         HA1    69 TYR  QE      8.00
         HA2    15 MET  HG2     7.75
         HA2    15 MET  HG3     7.75
         HA2    69 TYR  QD      8.00
         HA2    69 TYR  QE      8.00
         QA     15 MET  QG      6.82
 15 MET  
         HN     15 MET  HB2     3.90
         HN     15 MET  HB3     3.90
         HN     15 MET  HG2     5.70
         HN     15 MET  HG3     5.70
         HN     15 MET  QG      5.02
         HN     16 THR  HN      4.80
         HN     69 TYR  QD      8.00
         HA     16 THR  HN      3.50
         HA     17 CYSS HN      6.00
         HA     20 CYSS QB      6.88
         HA     69 TYR  QD      8.00
         HA     69 TYR  QE      8.00
         HB2    16 THR  HN      6.00
         HB2    17 CYSS HN      6.00
         HB2    20 CYSS HB2     7.75
         HB2    20 CYSS HB3     7.75
         HB2    41 LEU  QD1     8.75
         HB2    41 LEU  QD2     8.75
         HB3    16 THR  HN      6.00
         HB3    17 CYSS HN      6.00
         HB3    20 CYSS HB2     7.75
         HB3    20 CYSS HB3     7.75
         HB3    41 LEU  QD1     8.75
         HB3    41 LEU  QD2     8.75
         QB     16 THR  HB      6.88
         QB     17 CYSS HN      5.84
         QB     20 CYSS QB      6.48
         QB     24 ILE  QD1     7.88
         QB     41 LEU  QQD     7.26
         QB     69 TYR  QD      8.88
         QB     69 TYR  QE      8.88
         QG     16 THR  HN      6.88
         QG     21 ALA  QB      7.88
         QG     24 ILE  QD1     7.88
         QG     41 LEU  QQD     9.45
         QG     69 TYR  QD      8.88
         QG     69 TYR  QE      8.88
 16 THR  
         HN     17 CYSS HN      3.50
         HN     20 CYSS HB2     6.00
         HN     20 CYSS HB3     6.00
         HN     69 TYR  QD      8.00
         HB     17 CYSS HN      4.20
         QG2    17 CYSS HN      7.00
 17 CYSS 
         HN     19 ALA  QB      7.00
         HN     20 CYSS HN      5.50
         HN     20 CYSS HB2     6.00
         HN     20 CYSS HB3     6.00
         HN     20 CYSS QB      5.69
         HN     21 ALA  HN      6.00
         QB     20 CYSS QB      7.75
 19 ALA  
         HN     19 ALA  QB      3.60
         HN     20 CYSS HN      3.60
         HA     22 ALA  HN      4.80
         HA     22 ALA  QB      4.80
         QB     22 ALA  QB      8.00
         QB     23 ARG  QD      8.00
 20 CYSS 
         HN     20 CYSS QB      3.91
         HN     21 ALA  HN      3.70
         HN     21 ALA  QB      5.60
         HN     22 ALA  HN      6.00
         HA     22 ALA  HN      5.80
         HA     22 ALA  QB      5.20
         HA     23 ARG  QB      4.90
         HA     23 ARG  HG2     5.80
         HA     23 ARG  HG3     5.80
         HA     24 ILE  HN      4.90
         HB2    21 ALA  HN      4.80
         HB3    21 ALA  HN      4.80
         QB     21 ALA  HN      4.38
         QB     23 ARG  QB      7.58
         QB     69 TYR  QD      8.88
         QB     69 TYR  QE      8.88
 21 ALA  
         HN     22 ALA  HN      3.80
         HN     23 ARG  HN      6.00
         HA     24 ILE  HN      6.00
         HA     24 ILE  QG1     6.88
         HA     24 ILE  QD1     7.00
         HA     25 GLU  HN      6.00
         HA     39 VAL  QQG     8.56
         QB     22 ALA  HN      4.20
         QB     39 VAL  QG1     8.00
         QB     39 VAL  QG2     8.00
         QB     41 LEU  QD1     8.00
         QB     41 LEU  QD2     8.00
         QB     46 VAL  QQG     9.56
 22 ALA  
         HN     22 ALA  QB      3.60
         HN     23 ARG  HN      3.70
         HN     23 ARG  QB      6.40
         HN     23 ARG  QG      6.58
         HN     26 LYS  HN      6.00
         HA     25 GLU  HN      5.00
         HA     25 GLU  HB2     4.70
         HA     25 GLU  HB3     4.70
         HA     25 GLU  QB      4.52
         HA     25 GLU  QG      7.00
         HA     26 LYS  HN      6.00
         HA     39 VAL  HB      6.00
         QB     23 ARG  HN      4.00
         QB     26 LYS  QB      7.88
 23 ARG  
         HN     23 ARG  HG2     5.30
         HN     23 ARG  HG3     5.30
         HN     23 ARG  QG      5.03
         HN     23 ARG  QD      7.00
         HN     24 ILE  HN      3.30
         HN     24 ILE  HA      5.70
         HN     26 LYS  HN      6.00
         HA     23 ARG  HG2     4.10
         HA     23 ARG  HG3     4.10
         HA     23 ARG  QD      7.00
         HA     26 LYS  HN      5.90
         HA     26 LYS  QB      5.68
         HA     27 GLY  HN      6.00
         HA     27 GLY  QA      6.18
         HG2    24 ILE  HN      6.00
         HG3    24 ILE  HN      6.00
         QD     24 ILE  HN      7.00
 24 ILE  
         HN     24 ILE  HB      3.80
         HN     24 ILE  HG12    5.70
         HN     24 ILE  HG13    5.70
         HN     24 ILE  QG1     5.02
         HN     24 ILE  QD1     5.50
         HN     25 GLU  HN      3.80
         HN     69 TYR  QD      8.00
         HA     24 ILE  QG1     3.58
         HA     26 LYS  HN      6.00
         HA     27 GLY  HN      4.20
         HA     67 LEU  QB      6.88
         HA     67 LEU  QD1     7.00
         HA     67 LEU  QD2     7.00
         HA     69 TYR  QD      8.00
         HA     69 TYR  QE      8.00
         HB     25 GLU  HN      3.70
         HB     64 ILE  QG2     7.00
         HB     64 ILE  QD1     7.00
         HB     67 LEU  QB      6.88
         HB     67 LEU  HG      6.00
         QG2    25 GLU  HN      7.00
         QG2    64 ILE  QG2     8.00
         QG2    67 LEU  QB      7.88
         QG2    67 LEU  QQD     9.57
         QG2    69 TYR  QD      9.00
         QG2    69 TYR  QE      9.00
         HG12   25 GLU  HN      5.90
         HG13   25 GLU  HN      5.90
         QG1    25 GLU  HN      5.73
         QG1    25 GLU  HA      6.88
         QG1    64 ILE  QG2     7.88
         QG1    67 LEU  QB      7.75
         QG1    69 TYR  QD      8.88
         QG1    69 TYR  QE      8.88
         QD1    25 GLU  HN      7.00
         QD1    41 LEU  HG      7.00
         QD1    64 ILE  QG2     8.00
         QD1    67 LEU  QB      7.88
         QD1    69 TYR  QD      9.00
         QD1    69 TYR  QE      9.00
 25 GLU  
         HN     25 GLU  HB2     3.70
         HN     25 GLU  HB3     3.70
         HN     25 GLU  QG      5.50
         HN     26 LYS  HN      3.40
         HN     28 LEU  QB      6.88
         HN     28 LEU  QQD     8.57
         HA     28 LEU  QB      4.78
         HA     28 LEU  HG      4.90
         HA     28 LEU  QQD     8.57
         HA     29 LYS  HN      6.00
         HB2    26 LYS  HN      4.20
         HB2    46 VAL  QG1     8.75
         HB2    46 VAL  QG2     8.75
         HB3    26 LYS  HN      4.20
         HB3    46 VAL  QG1     8.75
         HB3    46 VAL  QG2     8.75
         QB     26 LYS  HN      3.96
         QB     28 LEU  HN      6.88
         QB     46 VAL  QQG     7.72
         QB     48 VAL  QQG     9.44
         QG     26 LYS  HN      7.00
         QG     48 VAL  HB      6.00
         QG     48 VAL  QQG     9.56
         QG     64 ILE  QG1     7.88
 26 LYS  
         HN     26 LYS  HB2     3.70
         HN     26 LYS  HB3     3.70
         HN     26 LYS  QG      6.60
         HN     26 LYS  HD2     5.10
         HN     26 LYS  HD3     5.10
         HN     26 LYS  QD      4.78
         HN     27 GLY  HN      3.80
         HN     28 LEU  HN      3.70
         HA     26 LYS  HD2     3.80
         HA     26 LYS  HD3     3.80
         HA     26 LYS  QD      3.55
         HA     26 LYS  HE2     6.00
         HA     26 LYS  HE3     6.00
         HA     29 LYS  HN      5.20
         HA     29 LYS  HB2     3.40
         HA     29 LYS  HB3     3.40
         HB2    27 GLY  HN      4.10
         HB3    27 GLY  HN      4.10
         QB     26 LYS  QD      3.24
         QB     37 ALA  QB      7.88
         QG     39 VAL  HN      7.00
         HD2    27 GLY  HN      6.00
         HD3    27 GLY  HN      6.00
         QD     37 ALA  HN      6.88
         QD     37 ALA  QB      7.88
 27 GLY  
         HN     28 LEU  HN      3.60
         HN     28 LEU  HA      5.60
         HN     29 LYS  HN      6.00
         HN     29 LYS  QB      6.68
         HN     67 LEU  QQD     7.97
         HA1    30 ARG  HN      6.00
         HA1    30 ARG  HB2     5.55
         HA1    30 ARG  HB3     5.55
         HA1    67 LEU  QD1     8.75
         HA1    67 LEU  QD2     8.75
         HA2    30 ARG  HN      6.00
         HA2    30 ARG  HB2     5.55
         HA2    30 ARG  HB3     5.55
         HA2    67 LEU  QD1     8.75
         HA2    67 LEU  QD2     8.75
         QA     29 LYS  HN      5.78
         QA     30 ARG  HN      5.45
         QA     30 ARG  QB      4.24
         QA     67 LEU  QQD     7.26
 28 LEU  
         HN     28 LEU  HB2     4.00
         HN     28 LEU  HB3     4.00
         HN     28 LEU  QB      3.47
         HN     28 LEU  HG      6.00
         HN     28 LEU  QD1     5.50
         HN     28 LEU  QD2     5.50
         HN     28 LEU  QQD     5.07
         HN     29 LYS  HN      3.80
         HN     30 ARG  HN      6.00
         HN     63 LYS  QG      6.88
         HA     28 LEU  QD1     4.80
         HA     28 LEU  QD2     4.80
         HA     28 LEU  QQD     3.99
         HA     31 MET  HN      5.20
         HA     31 MET  QB      4.88
         HA     34 VAL  QQG     8.56
         HB2    29 LYS  HN      4.50
         HB2    34 VAL  QG1     8.75
         HB2    34 VAL  QG2     8.75
         HB3    29 LYS  HN      4.50
         HB3    34 VAL  QG1     8.75
         HB3    34 VAL  QG2     8.75
         QB     29 LYS  HN      4.03
         QB     31 MET  HN      6.88
         QB     34 VAL  QQG     7.26
         QB     60 ILE  QD1     7.88
         HG     29 LYS  HN      6.00
         HG     64 ILE  HB      6.00
         QD1    29 LYS  HN      7.00
         QD1    63 LYS  HB2     8.75
         QD1    63 LYS  HB3     8.75
         QD2    29 LYS  HN      7.00
         QD2    63 LYS  HB2     8.75
         QD2    63 LYS  HB3     8.75
         QQD    37 ALA  HN      8.57
         QQD    38 ASN  HN      8.57
         QQD    48 VAL  QQG     11.13
         QQD    59 ALA  HN      8.57
         QQD    63 LYS  HN      8.57
         QQD    63 LYS  QB      7.72
         QQD    63 LYS  QG      9.45
         QQD    64 ILE  HA      8.57
         QQD    64 ILE  HB      8.57
 29 LYS  
         HN     29 LYS  HB2     3.80
         HN     29 LYS  HB3     3.80
         HN     29 LYS  QB      3.45
         HN     29 LYS  QE      6.88
         HN     30 ARG  HN      3.80
         HN     31 MET  HN      4.90
         HN     34 VAL  QQG     8.56
         HA     29 LYS  QD      5.20
         HA     31 MET  HN      5.00
         HA     34 VAL  HB      6.00
         HA     34 VAL  QQG     8.56
         HA     37 ALA  HN      6.00
         HB2    30 ARG  HN      4.90
         HB2    37 ALA  HN      6.00
         HB2    37 ALA  QB      7.00
         HB3    30 ARG  HN      4.90
         HB3    37 ALA  HN      6.00
         HB3    37 ALA  QB      7.00
         QB     30 ARG  HN      4.57
         QB     36 ASP  HN      6.78
         QB     37 ALA  HN      5.32
         QE     37 ALA  HN      5.58
 30 ARG  
         HN     30 ARG  HB2     4.00
         HN     30 ARG  HB3     4.00
         HN     30 ARG  QB      3.61
         HN     30 ARG  QG      7.00
         HN     30 ARG  QD      7.00
         HN     31 MET  HN      3.50
         HA     30 ARG  QD      5.80
         HB2    31 MET  HN      4.40
         HB3    31 MET  HN      4.40
         QB     31 MET  HN      4.06
         QG     31 MET  HN      7.00
         QD     31 MET  HN      7.00
 31 MET  
         HN     31 MET  HB2     3.90
         HN     31 MET  HB3     3.90
         HN     31 MET  HG2     4.50
         HN     31 MET  HG3     4.50
         HN     31 MET  QG      4.17
         HN     32 PRO  HD2     6.00
         HN     32 PRO  HD3     6.00
         HN     34 VAL  HN      5.00
         HN     34 VAL  HB      5.00
         HN     34 VAL  QG1     7.00
         HN     34 VAL  QG2     7.00
         HA     31 MET  QG      3.83
         HA     34 VAL  HN      6.00
         HB2    34 VAL  HN      5.20
         HB3    34 VAL  HN      5.20
         QB     34 VAL  HN      4.98
         HG2    60 ILE  QD1     7.00
         HG3    60 ILE  QD1     7.00
         QG     34 VAL  HN      6.88
         QG     34 VAL  QQG     9.44
         QG     55 THR  QG2     7.88
         QG     63 LYS  QD      7.88
         QE     60 ILE  HA      7.00
 32 PRO  
         HA     33 GLY  HN      2.90
         HB2    33 GLY  HN      4.20
         HB3    33 GLY  HN      4.20
         QB     33 GLY  HN      4.01
         HG2    33 GLY  HN      5.70
         HG3    33 GLY  HN      5.70
         QG     33 GLY  HN      5.43
         QD     63 LYS  QG      7.25
         QD     63 LYS  QD      7.28
 33 GLY  
         HN     34 VAL  HN      3.40
         HN     34 VAL  HB      5.60
         HN     34 VAL  QQG     8.56
         HN     50 TYR  QB      6.88
         HN     51 ASP  HN      5.90
         HN     51 ASP  QB      6.88
         HN     54 GLU  QB      6.88
         HN     55 THR  QG2     7.00
         HA1    51 ASP  HN      5.20
         HA1    54 GLU  HN      5.60
         HA1    54 GLU  HB2     6.85
         HA1    54 GLU  HB3     6.85
         HA1    55 THR  HN      5.40
         HA1    55 THR  QG2     7.00
         HA2    51 ASP  HN      5.20
         HA2    54 GLU  HN      5.60
         HA2    54 GLU  HB2     6.85
         HA2    54 GLU  HB3     6.85
         HA2    55 THR  HN      5.40
         HA2    55 THR  QG2     7.00
         QA     51 ASP  HN      4.93
         QA     51 ASP  QB      7.75
         QA     54 GLU  HN      5.43
         QA     54 GLU  QB      5.89
         QA     54 GLU  QG      7.88
         QA     55 THR  HN      4.89
 34 VAL  
         HN     34 VAL  HB      2.80
         HN     34 VAL  QG1     4.60
         HN     34 VAL  QG2     4.60
         HN     34 VAL  QQG     3.97
         HN     35 THR  HN      5.90
         HN     48 VAL  QQG     8.56
         HN     50 TYR  HA      5.10
         HN     51 ASP  HN      6.00
         HN     54 GLU  QB      6.68
         HN     55 THR  QG2     7.00
         HN     60 ILE  QD1     7.00
         HA     35 THR  HN      3.40
         HA     36 ASP  HN      4.50
         HA     50 TYR  HN      6.00
         HA     50 TYR  HA      2.80
         HA     50 TYR  HB2     6.00
         HA     50 TYR  HB3     6.00
         HA     50 TYR  QD      8.00
         HA     51 ASP  HN      4.20
         HB     35 THR  HN      5.20
         QG1    35 THR  HN      5.70
         QG1    51 ASP  HN      7.00
         QG1    60 ILE  QD1     8.00
         QG2    35 THR  HN      5.70
         QG2    51 ASP  HN      7.00
         QG2    60 ILE  QD1     8.00
         QQG    35 THR  HN      5.23
         QQG    36 ASP  HN      6.06
         QQG    37 ALA  HN      8.46
         QQG    50 TYR  HA      8.56
         QQG    55 THR  HB      8.56
 35 THR  
         HN     35 THR  HB      3.80
         HN     36 ASP  HN      3.20
         HN     36 ASP  HA      5.60
         HN     49 ILE  HN      5.20
         HN     49 ILE  HB      4.70
         HN     49 ILE  QG1     7.00
         HN     50 TYR  HA      3.60
         HN     50 TYR  HB2     6.00
         HN     50 TYR  HB3     6.00
         HN     51 ASP  HN      4.60
         HA     35 THR  HB      2.90
         HB     36 ASP  HN      3.60
         HB     49 ILE  HB      5.50
         HB     49 ILE  QG2     7.00
         HB     50 TYR  HA      6.00
         QG2    36 ASP  HN      6.00
         QG2    49 ILE  QG2     8.00
         QG2    49 ILE  QG1     8.00
         QG2    50 TYR  HA      7.00
         QG2    51 ASP  HN      7.00
 36 ASP  
         HN     36 ASP  HB2     3.70
         HN     36 ASP  HB3     3.70
         HN     36 ASP  QB      3.49
         HN     37 ALA  HN      4.30
         HN     37 ALA  HA      5.60
         HN     37 ALA  QB      5.20
         HN     49 ILE  HN      4.10
         HN     49 ILE  HB      4.30
         HN     49 ILE  QG2     5.40
         HN     49 ILE  QG1     7.00
         HN     50 TYR  HA      4.50
         HA     37 ALA  HN      2.80
         HB2    37 ALA  HN      4.00
         HB2    49 ILE  HN      6.00
         HB2    49 ILE  HB      6.00
         HB3    37 ALA  HN      4.00
         HB3    49 ILE  HN      6.00
         HB3    49 ILE  HB      6.00
         QB     37 ALA  HN      3.80
         QB     49 ILE  QG2     7.88
 37 ALA  
         HN     38 ASN  HN      5.40
         HN     38 ASN  QD2     6.87
         HN     49 ILE  QG2     7.00
         HA     38 ASN  HN      3.00
         HA     38 ASN  QB      5.10
         HA     47 ASN  HN      6.00
         HA     48 VAL  HA      2.60
         HA     48 VAL  QG1     7.00
         HA     48 VAL  QG2     7.00
         HA     49 ILE  HN      4.50
         HA     49 ILE  QG1     7.00
         QB     38 ASN  HN      4.40
         QB     48 VAL  HA      7.00
         QB     48 VAL  HB      7.00
         QB     48 VAL  QQG     9.56
         QB     49 ILE  HN      7.00
 38 ASN  
         HN     38 ASN  HD21    6.00
         HN     38 ASN  HD22    6.00
         HN     39 VAL  HN      6.00
         HN     39 VAL  HB      5.30
         HN     39 VAL  QQG     8.56
         HN     46 VAL  QQG     8.56
         HN     47 ASN  HN      3.30
         HN     48 VAL  HA      4.70
         HN     48 VAL  QQG     8.56
         HN     49 ILE  HN      6.00
         HN     49 ILE  QD1     7.00
         HA     38 ASN  HD21    5.40
         HA     38 ASN  HD22    5.40
         HA     39 VAL  HN      3.00
         HA     47 ASN  HN      6.00
         QB     47 ASN  QB      6.60
         HD21   49 ILE  QD1     7.00
         HD22   49 ILE  QD1     7.00
         QD2    40 ASN  QB      6.74
         QD2    46 VAL  HA      6.27
         QD2    49 ILE  HA      6.87
         QD2    49 ILE  QD1     6.70
 39 VAL  
         HN     39 VAL  HB      3.20
         HN     40 ASN  HN      6.00
         HN     46 VAL  HA      6.00
         HN     46 VAL  HB      6.00
         HA     40 ASN  HN      3.10
         HA     46 VAL  HN      6.00
         HA     46 VAL  HA      3.00
         HA     46 VAL  QQG     8.56
         HA     47 ASN  HN      4.70
         HB     40 ASN  HN      5.50
         HB     46 VAL  QQG     8.56
         HB     47 ASN  HN      6.00
         QG1    40 ASN  HN      7.00
         QG1    41 LEU  QD1     11.12
         QG1    41 LEU  QD2     11.12
         QG2    40 ASN  HN      7.00
         QG2    41 LEU  QD1     11.12
         QG2    41 LEU  QD2     11.12
         QQG    40 ASN  HN      5.92
         QQG    41 LEU  HG      8.56
         QQG    41 LEU  QQD     9.43
         QQG    46 VAL  HB      8.56
         QQG    47 ASN  HN      8.56
 40 ASN  
         HN     40 ASN  HB2     3.90
         HN     40 ASN  HB3     3.90
         HN     40 ASN  QB      3.70
         HN     41 LEU  HN      5.20
         HN     45 THR  HN      4.40
         HN     45 THR  HB      6.00
         HN     46 VAL  HA      4.90
         HN     46 VAL  HB      6.00
         HN     47 ASN  HN      5.20
         HA     41 LEU  HN      3.10
         HA     42 ALA  HN      4.80
         HA     43 THR  HN      6.00
         HB2    41 LEU  HN      6.00
         HB2    43 THR  HN      6.00
         HB2    43 THR  QG2     7.00
         HB3    41 LEU  HN      6.00
         HB3    43 THR  HN      6.00
         HB3    43 THR  QG2     7.00
         QB     42 ALA  HN      6.88
         QB     43 THR  HN      5.59
         QB     45 THR  HN      6.18
         QB     45 THR  HB      5.48
         HD21   45 THR  QG2     7.00
         HD22   45 THR  QG2     7.00
         QD2    42 ALA  QB      7.87
         QD2    43 THR  HN      6.87
         QD2    45 THR  QG2     6.56
 41 LEU  
         HN     41 LEU  HG      4.40
         HN     41 LEU  QD1     5.60
         HN     41 LEU  QD2     5.60
         HN     42 ALA  HN      3.70
         HN     43 THR  HN      6.00
         HA     41 LEU  HG      4.20
         HA     41 LEU  QD1     4.60
         HA     41 LEU  QD2     4.60
         HA     41 LEU  QQD     3.96
         HA     43 THR  HN      6.00
         HA     44 GLU  HN      5.30
         HA     44 GLU  HA      4.20
         HB2    41 LEU  HG      2.50
         HB2    42 ALA  HN      4.00
         HB3    41 LEU  HG      2.50
         HB3    42 ALA  HN      4.00
         QB     42 ALA  HN      3.51
         QB     44 GLU  HN      5.98
         HG     42 ALA  HN      5.70
         QD1    42 ALA  HN      7.00
         QD1    43 THR  HN      7.00
         QD1    45 THR  HN      7.00
         QD2    42 ALA  HN      7.00
         QD2    43 THR  HN      7.00
         QD2    45 THR  HN      7.00
         QQD    44 GLU  HN      8.57
 42 ALA  
         HN     43 THR  HN      3.40
         HN     43 THR  QG2     7.00
         HN     44 GLU  HN      5.20
         HA     44 GLU  HN      6.00
         QB     43 THR  HN      3.60
         QB     43 THR  HA      5.00
 43 THR  
         HN     43 THR  QG2     4.00
         HN     44 GLU  HN      3.20
         HN     44 GLU  HA      5.20
         HN     44 GLU  QB      6.68
         HN     45 THR  HN      5.10
         HA     43 THR  HB      2.40
         HA     45 THR  HN      5.50
         HB     44 GLU  HN      6.00
         QG2    44 GLU  HN      7.00
         QG2    44 GLU  QB      7.88
         QG2    45 THR  HA      7.00
         QG2    45 THR  HB      7.00
 44 GLU  
         HN     44 GLU  QG      5.50
         HN     45 THR  HN      3.60
         HB2    45 THR  HN      4.80
         HB3    45 THR  HN      4.80
         QB     45 THR  HN      4.42
         QG     45 THR  HN      7.00
 45 THR  
         HN     45 THR  HB      3.30
         HN     45 THR  QG2     4.50
         HN     46 VAL  HN      6.00
         HA     46 VAL  HN      3.10
         HB     46 VAL  HN      4.90
         QG2    46 VAL  HN      6.50
 46 VAL  
         HN     46 VAL  HB      3.80
         HN     47 ASN  HN      6.00
         HA     47 ASN  HN      3.00
         HB     47 ASN  HN      4.40
         QG1    47 ASN  HN      7.00
         QG1    47 ASN  HD21    10.12
         QG1    47 ASN  HD22    10.12
         QG1    71 VAL  QG1     11.12
         QG1    71 VAL  QG2     11.12
         QG2    47 ASN  HN      7.00
         QG2    47 ASN  HD21    10.12
         QG2    47 ASN  HD22    10.12
         QG2    71 VAL  QG1     11.12
         QG2    71 VAL  QG2     11.12
         QQG    47 ASN  HN      6.24
         QQG    47 ASN  QD2     8.52
         QQG    48 VAL  HN      8.56
         QQG    71 VAL  QQG     9.43
 47 ASN  
         HN     47 ASN  HD21    6.00
         HN     47 ASN  HD22    6.00
         HN     48 VAL  HN      4.60
         HN     48 VAL  QQG     8.56
         HN     49 ILE  QD1     7.00
         HA     47 ASN  HD21    6.00
         HA     47 ASN  HD22    6.00
         HA     48 VAL  HN      2.90
         HD21   48 VAL  HN      6.00
         HD21   49 ILE  QD1     7.00
         HD22   48 VAL  HN      6.00
         HD22   49 ILE  QD1     7.00
 48 VAL  
         HN     48 VAL  HB      3.50
         HN     49 ILE  HN      5.20
         HN     49 ILE  HA      4.40
         HA     49 ILE  HN      3.00
         HB     49 ILE  HN      4.70
         HB     60 ILE  QD1     7.00
         QG1    49 ILE  HN      5.30
         QG1    50 TYR  HB2     10.12
         QG1    50 TYR  HB3     10.12
         QG1    50 TYR  QD      9.00
         QG1    50 TYR  QE      9.00
         QG2    49 ILE  HN      5.30
         QG2    50 TYR  HB2     10.12
         QG2    50 TYR  HB3     10.12
         QG2    50 TYR  QD      9.00
         QG2    50 TYR  QE      9.00
         QQG    49 ILE  HN      4.86
         QQG    49 ILE  HA      8.56
         QQG    50 TYR  HN      8.56
         QQG    50 TYR  QB      8.52
         QQG    60 ILE  QD1     9.56
 49 ILE  
         HN     49 ILE  HB      3.40
         HN     49 ILE  QG1     5.60
         HN     49 ILE  QD1     5.10
         HN     50 TYR  HN      5.50
         HN     50 TYR  HA      6.00
         HN     50 TYR  QD      8.00
         HA     49 ILE  QG2     3.50
         HA     49 ILE  QD1     4.10
         HA     50 TYR  HN      3.00
         HB     50 TYR  HN      5.00
         QG2    49 ILE  QD1     4.40
         QG2    50 TYR  HN      6.20
         QG2    50 TYR  HA      7.00
         QG1    50 TYR  HN      7.00
         QG1    50 TYR  HA      7.00
         QD1    50 TYR  HN      6.10
 50 TYR  
         HN     50 TYR  QE      6.80
         HN     51 ASP  HN      5.50
         HA     51 ASP  HN      3.20
         HB2    51 ASP  HN      3.60
         HB3    51 ASP  HN      3.60
         QD     51 ASP  HN      7.80
         QD     51 ASP  HA      8.00
         QD     52 PRO  HA      7.10
         QD     52 PRO  QB      9.00
         QD     52 PRO  HG2     8.00
         QD     52 PRO  HG3     8.00
         QD     53 ALA  HN      8.00
         QD     54 GLU  HN      8.00
         QD     55 THR  HN      8.00
         QD     56 GLY  HN      8.00
         QD     56 GLY  HA1     8.00
         QD     56 GLY  HA2     8.00
         QD     60 ILE  QD1     9.00
         QE     51 ASP  HN      8.00
         QE     51 ASP  HA      8.00
         QE     52 PRO  HA      6.90
         QE     52 PRO  QB      8.90
         QE     52 PRO  HG2     8.00
         QE     52 PRO  HG3     8.00
         QE     52 PRO  QD      8.88
         QE     55 THR  HN      8.00
         QE     56 GLY  HN      8.00
         QE     56 GLY  HA1     8.00
         QE     56 GLY  HA2     8.00
         QE     56 GLY  QA      7.85
         QE     57 THR  HN      8.00
         QE     57 THR  HB      8.00
         QE     60 ILE  QD1     9.00
 51 ASP  
         HN     51 ASP  HB2     3.80
         HN     51 ASP  HB3     3.80
         HN     51 ASP  QB      3.50
         HN     52 PRO  QD      6.88
         HN     53 ALA  HN      6.00
         HN     54 GLU  HN      6.00
         HN     54 GLU  HB2     6.00
         HN     54 GLU  HB3     6.00
         HN     54 GLU  QB      5.74
         HN     55 THR  QG2     6.10
         HA     53 ALA  HN      4.80
         HB2    53 ALA  HN      6.00
         HB2    54 GLU  HN      5.90
         HB2    55 THR  HN      6.00
         HB3    53 ALA  HN      6.00
         HB3    54 GLU  HN      5.90
         HB3    55 THR  HN      6.00
         QB     52 PRO  QD      7.75
         QB     53 ALA  HN      5.74
         QB     55 THR  QG2     7.88
 52 PRO  
         HA     54 GLU  HN      5.00
         HA     55 THR  HN      4.40
         QB     57 THR  QG2     8.00
         HG2    53 ALA  HN      5.50
         HG3    53 ALA  HN      5.50
         QG     53 ALA  HN      4.95
         HD2    53 ALA  HN      5.60
         HD3    53 ALA  HN      5.60
         QD     53 ALA  HN      5.38
         QD     55 THR  HN      6.88
 53 ALA  
         HN     53 ALA  QB      3.40
         HN     54 GLU  HN      3.00
         HN     54 GLU  HA      4.70
         HN     55 THR  HN      4.40
         HA     55 THR  HN      6.00
         QB     54 GLU  HN      3.80
         QB     55 THR  HN      5.70
 54 GLU  
         HN     54 GLU  HB2     3.40
         HN     54 GLU  HB3     3.40
         HN     54 GLU  QG      5.80
         HN     55 THR  HN      2.80
         HN     55 THR  HA      5.60
         HN     55 THR  QG2     6.90
         HN     56 GLY  HN      6.00
         HB2    55 THR  HN      3.70
         HB2    55 THR  QG2     7.00
         HB3    55 THR  HN      3.70
         HB3    55 THR  QG2     7.00
         QG     55 THR  HN      6.80
 55 THR  
         HN     55 THR  QG2     4.40
         HN     56 GLY  HN      4.30
         HA     55 THR  HB      3.00
         HA     55 THR  HG1     3.30
         HA     56 GLY  HN      3.20
         HB     56 GLY  HN      4.20
         HB     59 ALA  QB      7.00
         HB     60 ILE  QG1     5.98
         QG2    56 GLY  HN      5.00
         QG2    57 THR  HN      7.00
         QG2    58 ALA  HA      7.00
         QG2    59 ALA  HN      7.00
         QG2    59 ALA  QB      8.00
         QG2    60 ILE  HN      7.00
         QG2    60 ILE  QG2     8.00
         QG2    60 ILE  QG1     7.88
         QG2    60 ILE  QD1     8.00
         HG1    56 GLY  HN      5.20
         HG1    59 ALA  QB      7.00
         HG1    60 ILE  QG1     6.88
 56 GLY  
         HN     57 THR  HN      5.30
         HN     58 ALA  QB      5.70
         HN     59 ALA  HN      5.00
         HN     59 ALA  QB      5.70
         HN     60 ILE  HN      5.90
         HN     60 ILE  HB      6.00
         HN     60 ILE  QG2     7.00
         HN     60 ILE  QG1     6.48
         HN     60 ILE  QD1     7.00
         QA     59 ALA  HN      6.48
 57 THR  
         HN     57 THR  HB      3.80
         HN     57 THR  QG2     4.30
         HN     58 ALA  HN      4.40
         HN     58 ALA  QB      5.40
         HN     59 ALA  HN      4.50
         HN     60 ILE  HB      6.00
         HN     60 ILE  QD1     7.00
         HA     57 THR  QG2     3.50
         HA     59 ALA  HN      5.50
         HA     60 ILE  HN      4.80
         HA     60 ILE  HB      3.60
         HA     60 ILE  QG1     6.88
         HA     60 ILE  QD1     7.00
         HA     61 GLN  HN      4.80
         HB     60 ILE  HB      5.40
         QG2    58 ALA  HN      7.00
         QG2    60 ILE  QD1     8.00
         QG2    61 GLN  HN      7.00
         QG2    61 GLN  HE21    7.00
         QG2    61 GLN  HE22    7.00
         QG2    73 ILE  QG2     8.00
 58 ALA  
         HN     58 ALA  QB      3.60
         HN     59 ALA  HN      4.00
         HN     60 ILE  HN      6.00
         HA     59 ALA  HN      3.60
         HA     61 GLN  HN      4.40
         HA     61 GLN  QB      4.40
         HA     61 GLN  HE21    6.00
         HA     61 GLN  HE22    6.00
         QB     59 ALA  HN      3.40
         QB     61 GLN  HN      6.20
 59 ALA  
         HN     59 ALA  QB      3.40
         HN     60 ILE  HN      3.20
         HN     60 ILE  HB      4.20
         HN     60 ILE  HG12    6.00
         HN     60 ILE  HG13    6.00
         HN     60 ILE  QD1     7.00
         HN     62 GLU  QB      5.28
         HA     61 GLN  HN      5.50
         HA     62 GLU  HN      4.10
         HA     62 GLU  HB2     3.70
         HA     62 GLU  HB3     3.70
         HA     62 GLU  QB      3.49
         HA     62 GLU  QG      7.00
         HA     63 LYS  HN      4.90
         QB     60 ILE  HN      4.00
         QB     60 ILE  QD1     8.00
         QB     62 GLU  HN      5.70
         QB     62 GLU  QB      7.88
         QB     63 LYS  HN      5.90
 60 ILE  
         HN     60 ILE  HB      2.90
         HN     60 ILE  QG2     4.60
         HN     60 ILE  HG12    4.30
         HN     60 ILE  HG13    4.30
         HN     60 ILE  QG1     3.96
         HN     60 ILE  QD1     4.80
         HN     61 GLN  HN      3.40
         HN     61 GLN  HA      6.00
         HN     61 GLN  QB      6.00
         HN     62 GLU  HN      5.70
         HN     63 LYS  QG      6.88
         HN     64 ILE  QG1     6.88
         HA     60 ILE  HG12    3.70
         HA     60 ILE  HG13    3.70
         HA     60 ILE  QG1     3.30
         HA     60 ILE  QD1     4.40
         HA     62 GLU  HN      5.70
         HA     63 LYS  HN      4.90
         HA     63 LYS  QB      4.18
         HB     61 GLN  HN      3.30
         QG2    61 GLN  HN      7.00
         HG12   61 GLN  HN      5.50
         HG13   61 GLN  HN      5.50
         QG1    61 GLN  HN      5.09
         QG1    61 GLN  HA      6.28
         QG1    64 ILE  HA      6.88
         QD1    61 GLN  HN      7.00
 61 GLN  
         HN     61 GLN  QB      3.80
         HN     61 GLN  HG2     4.80
         HN     61 GLN  HG3     4.80
         HN     62 GLU  HN      3.30
         HN     63 LYS  HN      4.60
         HN     64 ILE  HN      6.00
         HN     64 ILE  HG12    6.00
         HN     64 ILE  HG13    6.00
         HA     61 GLN  HG2     4.20
         HA     61 GLN  HG3     4.20
         HA     61 GLN  QG      3.67
         HA     63 LYS  HN      6.00
         HA     64 ILE  HN      5.20
         HA     64 ILE  HB      3.90
         HA     64 ILE  QG2     7.00
         HA     64 ILE  QG1     6.18
         HA     65 GLU  HN      6.00
         QB     61 GLN  HE21    7.00
         QB     61 GLN  HE22    7.00
         QB     64 ILE  HG12    7.00
         QB     64 ILE  HG13    7.00
         QB     64 ILE  QD1     8.00
         HG2    62 GLU  HN      5.40
         HG2    71 VAL  QG1     8.75
         HG2    71 VAL  QG2     8.75
         HG3    62 GLU  HN      5.40
         HG3    71 VAL  QG1     8.75
         HG3    71 VAL  QG2     8.75
         QG     62 GLU  HN      5.08
         QG     71 VAL  QQG     7.72
         HE21   71 VAL  QG1     7.00
         HE21   71 VAL  QG2     7.00
         HE21   73 ILE  QD1     7.00
         HE22   71 VAL  QG1     7.00
         HE22   71 VAL  QG2     7.00
         HE22   73 ILE  QD1     7.00
         QE2    64 ILE  HB      6.87
 62 GLU  
         HN     62 GLU  HB2     3.50
         HN     62 GLU  HB3     3.50
         HN     62 GLU  QB      3.14
         HN     62 GLU  QG      5.40
         HN     63 LYS  HN      3.40
         HN     64 ILE  HN      5.80
         HA     63 LYS  HN      3.60
         HA     64 ILE  HN      5.50
         HA     65 GLU  HN      4.60
         HA     65 GLU  QB      4.68
         HA     66 LYS  HN      4.90
         HB2    63 LYS  HN      3.90
         HB3    63 LYS  HN      3.90
         QB     63 LYS  HN      3.50
         QG     63 LYS  HN      7.00
 63 LYS  
         HN     63 LYS  HB2     3.30
         HN     63 LYS  HB3     3.30
         HN     63 LYS  QB      3.08
         HN     63 LYS  HG2     4.90
         HN     63 LYS  HG3     4.90
         HN     63 LYS  QG      4.43
         HN     63 LYS  QD      5.80
         HN     63 LYS  QE      6.88
         HN     64 ILE  HN      3.40
         HN     64 ILE  QG2     7.00
         HN     64 ILE  QG1     6.28
         HN     65 GLU  HN      5.10
         HN     66 LYS  HN      6.00
         HA     63 LYS  QD      4.10
         HA     63 LYS  QE      6.08
         HA     65 GLU  QB      5.88
         HA     66 LYS  HN      5.60
         HA     66 LYS  HB2     4.10
         HA     66 LYS  HB3     4.10
         HA     66 LYS  QB      3.71
         HB2    64 ILE  HN      3.50
         HB3    64 ILE  HN      3.50
         QB     63 LYS  QE      5.55
         HG2    64 ILE  HN      6.00
         HG3    64 ILE  HN      6.00
         QG     67 LEU  HN      6.88
         QD     64 ILE  HN      7.00
 64 ILE  
         HN     64 ILE  HB      3.10
         HN     64 ILE  QG2     4.10
         HN     64 ILE  HG12    5.30
         HN     64 ILE  HG13    5.30
         HN     64 ILE  QG1     4.75
         HN     64 ILE  QD1     5.20
         HN     65 GLU  HN      3.60
         HN     65 GLU  QB      5.78
         HN     65 GLU  HG2     6.00
         HN     65 GLU  HG3     6.00
         HN     66 LYS  HN      6.00
         HA     64 ILE  HG12    3.50
         HA     64 ILE  HG13    3.50
         HA     64 ILE  QD1     4.60
         HA     66 LYS  HN      5.80
         HA     67 LEU  HN      4.50
         HA     67 LEU  HB2     4.70
         HA     67 LEU  HB3     4.70
         HA     67 LEU  QB      4.37
         HA     67 LEU  QD1     7.00
         HA     67 LEU  QD2     7.00
         HA     69 TYR  QD      8.00
         HA     69 TYR  QE      8.00
         HB     65 GLU  HN      3.50
         QG2    64 ILE  QD1     4.40
         QG2    65 GLU  HN      7.00
         QG2    71 VAL  HB      7.00
         HG12   65 GLU  HN      6.00
         HG13   65 GLU  HN      6.00
         QG1    65 GLU  HN      5.74
         QG1    70 HID  HA      6.88
         QD1    65 GLU  HN      6.90
         QD1    69 TYR  HN      5.40
         QD1    69 TYR  QD      9.00
         QD1    69 TYR  QE      9.00
         QD1    70 HID  HA      7.00
         QD1    71 VAL  HN      7.00
         QD1    71 VAL  QQG     9.56
 65 GLU  
         HN     65 GLU  HB2     3.60
         HN     65 GLU  HB3     3.60
         HN     65 GLU  HG2     4.30
         HN     65 GLU  HG3     4.30
         HN     66 LYS  HN      3.80
         HA     67 LEU  HN      4.90
         HA     68 GLY  HN      4.70
         HA     69 TYR  HN      4.20
         HB2    65 GLU  HG2     3.00
         HB2    65 GLU  HG3     3.00
         HB2    66 LYS  HN      3.80
         HB3    65 GLU  HG2     3.00
         HB3    65 GLU  HG3     3.00
         HB3    66 LYS  HN      3.80
         HG2    66 LYS  HN      6.00
         HG3    66 LYS  HN      6.00
         QG     71 VAL  HN      6.88
 66 LYS  
         HN     66 LYS  HB2     3.90
         HN     66 LYS  HB3     3.90
         HN     66 LYS  QB      3.65
         HN     66 LYS  QG      6.00
         HN     66 LYS  QD      5.40
         HN     67 LEU  HN      3.60
         HN     67 LEU  QQD     8.57
         HN     68 GLY  HN      6.00
         HA     66 LYS  QG      3.40
         HA     66 LYS  QD      4.00
         HA     66 LYS  QE      6.88
         HB2    67 LEU  HN      3.60
         HB3    67 LEU  HN      3.60
         QG     67 LEU  HN      7.00
         QD     67 LEU  HN      6.80
 67 LEU  
         HN     67 LEU  HB2     3.90
         HN     67 LEU  HB3     3.90
         HN     67 LEU  QB      3.60
         HN     67 LEU  HG      3.70
         HN     67 LEU  QD1     4.90
         HN     67 LEU  QD2     4.90
         HN     67 LEU  QQD     4.49
         HN     68 GLY  HN      3.50
         HN     69 TYR  HN      4.80
         HA     67 LEU  HG      2.90
         HA     67 LEU  QD1     4.60
         HA     67 LEU  QD2     4.60
         HA     67 LEU  QQD     4.01
         HA     69 TYR  QB      6.88
         HB2    68 GLY  HN      5.00
         HB2    69 TYR  HN      5.70
         HB3    68 GLY  HN      5.00
         HB3    69 TYR  HN      5.70
         QB     68 GLY  HN      4.72
         QB     69 TYR  HN      5.10
         QB     69 TYR  QD      8.88
         QB     69 TYR  QE      8.88
         HG     68 GLY  HN      6.00
         QD1    68 GLY  HN      7.00
         QD2    68 GLY  HN      7.00
         QQD    69 TYR  QD      10.57
         QQD    69 TYR  QE      10.57
 68 GLY  
         HN     69 TYR  HN      3.20
         HN     69 TYR  QD      8.00
 69 TYR  
         HN     69 TYR  QE      7.00
         HN     70 HID  HN      4.60
         HA     69 TYR  QE      4.90
         HA     70 HID  HN      3.50
         HB2    70 HID  HN      4.00
         HB3    70 HID  HN      4.00
         QB     70 HID  HN      3.70
         QD     70 HID  HN      8.00
 70 HID  
         HN     71 VAL  HN      5.50
         HA     71 VAL  HN      3.10
         HB2    71 VAL  HN      5.60
         HB3    71 VAL  HN      5.60
         QB     71 VAL  HN      5.09
         HD2    72 VAL  QG1     7.00
         HD2    72 VAL  QG2     7.00
 71 VAL  
         HN     71 VAL  HB      3.50
         HN     72 VAL  HN      5.30
         HA     72 VAL  HN      3.00
         QG1    72 VAL  HN      6.30
         QG2    72 VAL  HN      6.30
         QQG    72 VAL  HN      5.95
         QQG    73 ILE  QD1     9.56
 72 VAL  
         HN     72 VAL  HB      3.40
         HN     73 ILE  HN      5.70
         HN     73 ILE  HA      6.00
         HA     72 VAL  HB      2.90
         HA     73 ILE  HN      3.00
         HA     74 GLU  HN      5.10
         HB     73 ILE  HN      3.80
         QQG    73 ILE  HN      7.46
 73 ILE  
         HN     73 ILE  HB      3.50
         HN     73 ILE  HG12    4.40
         HN     73 ILE  HG13    4.40
         HN     73 ILE  QG1     4.21
         HN     73 ILE  QD1     4.60
         HN     74 GLU  HN      3.70
         HA     73 ILE  QG2     3.40
         HA     73 ILE  HG12    3.70
         HA     73 ILE  HG13    3.70
         HA     73 ILE  QD1     3.90
         HA     74 GLU  HN      2.80
         HB     73 ILE  HG12    3.00
         HB     73 ILE  HG13    3.00
         HB     74 GLU  HN      4.60
         QG2    73 ILE  QD1     4.40
         QG2    74 GLU  HN      4.60
         QG2    75 GLY  HN      5.80
         QG2    76 ARG  HN      5.40
         HG12   74 GLU  HN      6.00
         HG13   74 GLU  HN      6.00
         QG1    74 GLU  HN      5.84
         QD1    74 GLU  HN      6.10
 74 GLU  
         HN     74 GLU  HA      2.70
         HN     74 GLU  HB2     3.40
         HN     74 GLU  HB3     3.40
         HN     74 GLU  QB      3.18
         HN     74 GLU  QG      5.20
         HN     75 GLY  HN      3.50
         HN     76 ARG  HN      5.20
         HA     74 GLU  HB2     3.00
         HA     74 GLU  HB3     3.00
         HA     74 GLU  QB      2.72
         HA     74 GLU  QG      3.70
         HA     75 GLY  HN      3.10
         HB2    75 GLY  HN      4.10
         HB3    75 GLY  HN      4.10
         QB     75 GLY  HN      3.90
         QG     75 GLY  HN      7.00
 75 GLY  
         HN     76 ARG  HN      3.60
         HA1    76 ARG  HN      3.60
         HA2    76 ARG  HN      3.60
         QA     76 ARG  HN      3.20
 76 ARG  
         HN     76 ARG  HA      2.90
         HN     76 ARG  HB2     3.40
         HN     76 ARG  HB3     3.40
         HN     76 ARG  QB      3.08
         HN     76 ARG  QG      5.00
         HN     76 ARG  QD      6.80


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1          H1        MET   1  -1.995  20.790  16.375
    2   2H    MET   1          H2        MET   1  -3.503  20.939  15.681
    3   3H    MET   1          H3        MET   1  -2.957  19.469  16.230
    4    HA   MET   1           HA       MET   1  -2.677  19.434  13.900
    5   1HB   MET   1          2HB       MET   1  -2.701  22.004  13.763
    6   2HB   MET   1          3HB       MET   1  -1.024  21.963  14.319
    7   1HG   MET   1          2HG       MET   1  -0.777  20.287  12.212
    8   2HG   MET   1          3HG       MET   1  -2.199  21.180  11.673
    9   1HE   MET   1          1HE       MET   1  -0.622  24.871  11.678
   10   2HE   MET   1          2HE       MET   1  -2.139  23.950  11.542
   11   3HE   MET   1          3HE       MET   1  -1.321  24.109  13.120
   12    H    LEU   2           H        LEU   2  -1.008  17.874  13.517
   13    HA   LEU   2           HA       LEU   2   1.654  18.437  14.231
   14   1HB   LEU   2          2HB       LEU   2   0.544  17.608  16.488
   15   2HB   LEU   2          3HB       LEU   2   0.727  16.003  15.813
   16    HG   LEU   2           HG       LEU   2   3.008  18.032  16.000
   17   1HD1  LEU   2          1HD1      LEU   2   2.101  17.663  18.240
   18   2HD1  LEU   2          2HD1      LEU   2   2.211  15.902  18.020
   19   3HD1  LEU   2          3HD1      LEU   2   3.686  16.895  18.071
   20   1HD2  LEU   2          1HD2      LEU   2   3.450  16.139  14.455
   21   2HD2  LEU   2          2HD2      LEU   2   4.444  16.015  15.910
   22   3HD2  LEU   2          3HD2      LEU   2   3.008  14.987  15.735
   23    H    SER   3           H        SER   3  -0.156  15.343  14.085
   24    HA   SER   3           HA       SER   3  -0.068  13.595  12.711
   25   1HB   SER   3          2HB       SER   3  -0.086  15.726  10.554
   26   2HB   SER   3          3HB       SER   3  -0.651  14.052  10.409
   27    HG   SER   3           HG       SER   3  -2.291  14.501  11.860
   28    H    GLU   4           H        GLU   4   1.804  12.340  12.706
   29    HA   GLU   4           HA       GLU   4   4.343  13.555  11.768
   30   1HB   GLU   4          2HB       GLU   4   3.603  11.269  13.505
   31   2HB   GLU   4          3HB       GLU   4   5.011  11.070  12.496
   32   1HG   GLU   4          2HG       GLU   4   5.716  13.358  13.456
   33   2HG   GLU   4          3HG       GLU   4   4.517  12.993  14.699
   34    H    GLN   5           H        GLN   5   5.605  11.863  10.334
   35    HA   GLN   5           HA       GLN   5   3.726  10.309   8.649
   36   1HB   GLN   5          2HB       GLN   5   6.055  12.006   7.785
   37   2HB   GLN   5          3HB       GLN   5   5.283  10.865   6.698
   38   1HG   GLN   5          2HG       GLN   5   3.717  13.128   8.069
   39   2HG   GLN   5          3HG       GLN   5   4.632  13.366   6.601
   40   1HE2  GLN   5          1HE2      GLN   5   3.288  10.153   6.706
   41   2HE2  GLN   5          2HE2      GLN   5   1.981  10.499   5.602
   42    H    LYS   6           H        LYS   6   4.455   8.327   8.206
   43    HA   LYS   6           HA       LYS   6   7.280   7.717   8.517
   44   1HB   LYS   6          2HB       LYS   6   5.099   6.179  10.000
   45   2HB   LYS   6          3HB       LYS   6   6.690   5.522   9.642
   46   1HG   LYS   6          2HG       LYS   6   7.503   7.861  10.789
   47   2HG   LYS   6          3HG       LYS   6   5.918   7.722  11.536
   48   1HD   LYS   6          2HD       LYS   6   7.202   6.556  13.054
   49   2HD   LYS   6          3HD       LYS   6   6.729   5.209  12.023
   50   1HE   LYS   6          2HE       LYS   6   9.363   6.789  12.038
   51   2HE   LYS   6          3HE       LYS   6   9.125   5.104  12.510
   52   1HZ   LYS   6          1HZ       LYS   6   9.019   6.154   9.708
   53   2HZ   LYS   6          2HZ       LYS   6  10.132   5.210  10.368
   54   3HZ   LYS   6          3HZ       LYS   6   8.619   4.634  10.148
   55    H    GLU   7           H        GLU   7   7.865   5.873   7.570
   56    HA   GLU   7           HA       GLU   7   6.496   5.218   5.064
   57   1HB   GLU   7          2HB       GLU   7   9.411   4.672   5.421
   58   2HB   GLU   7          3HB       GLU   7   8.526   5.467   4.128
   59   1HG   GLU   7          2HG       GLU   7   9.943   7.075   4.926
   60   2HG   GLU   7          3HG       GLU   7   8.431   7.540   5.688
   61    H    ILE   8           H        ILE   8   5.489   3.214   5.389
   62    HA   ILE   8           HA       ILE   8   7.004   1.118   6.938
   63    HB   ILE   8           HB       ILE   8   5.173  -0.325   6.705
   64   1HG1  ILE   8          2HG1      ILE   8   2.955   0.570   5.945
   65   2HG1  ILE   8          3HG1      ILE   8   3.855   1.865   5.103
   66   1HG2  ILE   8          1HG2      ILE   8   3.623   0.770   8.107
   67   2HG2  ILE   8          2HG2      ILE   8   5.286   1.140   8.611
   68   3HG2  ILE   8          3HG2      ILE   8   4.336   2.368   7.741
   69   1HD1  ILE   8          1HD1      ILE   8   4.892   0.201   3.697
   70   2HD1  ILE   8          2HD1      ILE   8   4.443  -1.090   4.846
   71   3HD1  ILE   8          3HD1      ILE   8   3.195  -0.290   3.854
   72    H    ALA   9           H        ALA   9   7.273  -0.983   5.848
   73    HA   ALA   9           HA       ALA   9   7.602  -0.873   2.936
   74   1HB   ALA   9          1HB       ALA   9   9.796  -1.979   3.097
   75   2HB   ALA   9          2HB       ALA   9   9.873  -0.381   3.870
   76   3HB   ALA   9          3HB       ALA   9   9.762  -1.843   4.869
   77    H    MET  10           H        MET  10   6.725  -2.835   2.150
   78    HA   MET  10           HA       MET  10   6.741  -5.206   3.858
   79   1HB   MET  10          2HB       MET  10   4.286  -5.528   3.787
   80   2HB   MET  10          3HB       MET  10   4.761  -4.128   4.765
   81   1HG   MET  10          2HG       MET  10   4.240  -2.685   2.758
   82   2HG   MET  10          3HG       MET  10   3.603  -4.162   1.977
   83   1HE   MET  10          1HE       MET  10   1.495  -2.726   1.410
   84   2HE   MET  10          2HE       MET  10   0.431  -1.993   2.629
   85   3HE   MET  10          3HE       MET  10   2.044  -1.322   2.314
   86    H    GLN  11           H        GLN  11   5.545  -7.043   2.661
   87    HA   GLN  11           HA       GLN  11   6.557  -6.993  -0.132
   88   1HB   GLN  11          2HB       GLN  11   6.047  -9.139   1.975
   89   2HB   GLN  11          3HB       GLN  11   6.034  -9.586   0.277
   90   1HG   GLN  11          2HG       GLN  11   8.335  -8.295   1.804
   91   2HG   GLN  11          3HG       GLN  11   8.248  -9.974   1.248
   92   1HE2  GLN  11          1HE2      GLN  11   7.297  -9.792  -1.337
   93   2HE2  GLN  11          2HE2      GLN  11   8.190  -8.604  -2.281
   94    H    VAL  12           H        VAL  12   5.279  -8.212  -1.709
   95    HA   VAL  12           HA       VAL  12   2.328  -7.859  -1.387
   96    HB   VAL  12           HB       VAL  12   2.458  -7.418  -3.910
   97   1HG1  VAL  12          1HG1      VAL  12   1.733  -5.719  -2.309
   98   2HG1  VAL  12          2HG1      VAL  12   3.422  -5.347  -1.904
   99   3HG1  VAL  12          3HG1      VAL  12   2.792  -4.974  -3.520
  100   1HG2  VAL  12          1HG2      VAL  12   4.443  -6.413  -4.757
  101   2HG2  VAL  12          2HG2      VAL  12   5.254  -6.454  -3.186
  102   3HG2  VAL  12          3HG2      VAL  12   4.936  -7.969  -4.074
  103    H    SER  13           H        SER  13   1.005  -9.338  -2.591
  104    HA   SER  13           HA       SER  13   2.258 -11.388  -4.232
  105   1HB   SER  13          2HB       SER  13   0.845 -12.029  -1.605
  106   2HB   SER  13          3HB       SER  13   1.050 -13.220  -2.897
  107    HG   SER  13           HG       SER  13   3.343 -11.845  -2.103
  108    H    GLY  14           H        GLY  14   0.493 -12.730  -5.230
  109   1HA   GLY  14          2HA       GLY  14  -1.478 -12.919  -6.395
  110   2HA   GLY  14          3HA       GLY  14  -2.256 -12.031  -5.075
  111    H    MET  15           H        MET  15  -0.275 -11.577  -8.067
  112    HA   MET  15           HA       MET  15  -1.710  -9.079  -8.644
  113   1HB   MET  15          2HB       MET  15   0.277  -7.782  -8.827
  114   2HB   MET  15          3HB       MET  15   0.271  -8.518  -7.211
  115   1HG   MET  15          2HG       MET  15   2.456  -8.912  -7.782
  116   2HG   MET  15          3HG       MET  15   1.747 -10.374  -8.468
  117   1HE   MET  15          1HE       MET  15   4.396  -9.805 -11.178
  118   2HE   MET  15          2HE       MET  15   4.521  -9.841  -9.401
  119   3HE   MET  15          3HE       MET  15   3.466 -11.003 -10.251
  120    H    THR  16           H        THR  16  -1.498  -8.402 -10.843
  121    HA   THR  16           HA       THR  16  -0.887 -10.475 -12.809
  122    HB   THR  16           HB       THR  16  -1.650  -8.327 -14.215
  123    HG1  THR  16           1HG      THR  16  -2.831  -6.901 -12.932
  124   1HG2  THR  16          1HG2      THR  16  -4.020  -8.956 -13.834
  125   2HG2  THR  16          2HG2      THR  16  -2.974 -10.376 -14.019
  126   3HG2  THR  16          3HG2      THR  16  -3.536  -9.897 -12.402
  127    H    CYS  17           H        CYS  17  -0.050  -7.001 -12.376
  128    HA   CYS  17           HA       CYS  17   2.738  -7.490 -13.196
  129   1HB   CYS  17          2HB       CYS  17   2.311  -5.720 -15.081
  130   2HB   CYS  17          3HB       CYS  17   1.859  -7.409 -15.340
  131    H    ALA  18           H        ALA  18   4.022  -5.616 -13.263
  132    HA   ALA  18           HA       ALA  18   3.808  -4.020 -10.887
  133   1HB   ALA  18          1HB       ALA  18   6.011  -3.204 -11.591
  134   2HB   ALA  18          2HB       ALA  18   5.929  -4.964 -11.820
  135   3HB   ALA  18          3HB       ALA  18   5.779  -3.884 -13.214
  136    H    ALA  19           H        ALA  19   1.604  -3.302 -12.029
  137    HA   ALA  19           HA       ALA  19   1.938  -0.487 -12.872
  138   1HB   ALA  19          1HB       ALA  19   0.529  -2.574 -14.605
  139   2HB   ALA  19          2HB       ALA  19   0.474  -0.814 -14.854
  140   3HB   ALA  19          3HB       ALA  19   2.010  -1.687 -15.014
  141    H    CYS  20           H        CYS  20  -0.411  -3.205 -12.470
  142    HA   CYS  20           HA       CYS  20  -2.520  -1.579 -11.407
  143   1HB   CYS  20          2HB       CYS  20  -1.909  -4.524 -10.825
  144   2HB   CYS  20          3HB       CYS  20  -3.475  -3.702 -10.691
  145    H    ALA  21           H        ALA  21   0.229  -3.302 -10.058
  146    HA   ALA  21           HA       ALA  21   0.214  -2.828  -7.361
  147   1HB   ALA  21          1HB       ALA  21   2.016  -3.873  -8.914
  148   2HB   ALA  21          2HB       ALA  21   2.624  -2.223  -9.116
  149   3HB   ALA  21          3HB       ALA  21   2.577  -2.976  -7.508
  150    H    ALA  22           H        ALA  22   0.636  -0.316  -9.926
  151    HA   ALA  22           HA       ALA  22   1.435   1.739  -8.004
  152   1HB   ALA  22          1HB       ALA  22   1.129   3.271  -9.857
  153   2HB   ALA  22          2HB       ALA  22   2.007   1.840 -10.440
  154   3HB   ALA  22          3HB       ALA  22   0.279   2.046 -10.806
  155    H    ARG  23           H        ARG  23  -1.545   0.780  -9.743
  156    HA   ARG  23           HA       ARG  23  -3.123   2.955  -8.751
  157   1HB   ARG  23          2HB       ARG  23  -3.894   0.286  -9.985
  158   2HB   ARG  23          3HB       ARG  23  -5.065   1.503  -9.463
  159   1HG   ARG  23          2HG       ARG  23  -4.829   2.608 -11.398
  160   2HG   ARG  23          3HG       ARG  23  -3.168   2.982 -10.960
  161   1HD   ARG  23          2HD       ARG  23  -3.061   2.014 -13.082
  162   2HD   ARG  23          3HD       ARG  23  -2.464   0.775 -11.959
  163    HE   ARG  23           HE       ARG  23  -5.232   0.346 -12.259
  164   1HH1  ARG  23          2HH2      ARG  23  -2.314   0.177 -14.204
  165   2HH1  ARG  23          1HH2      ARG  23  -2.983  -0.838 -15.447
  166   1HH2  ARG  23          2HH1      ARG  23  -6.201  -0.970 -13.917
  167   2HH2  ARG  23          1HH1      ARG  23  -5.249  -1.520 -15.257
  168    H    ILE  24           H        ILE  24  -2.530  -0.332  -7.402
  169    HA   ILE  24           HA       ILE  24  -4.474  -0.010  -5.374
  170    HB   ILE  24           HB       ILE  24  -3.603  -1.722  -4.149
  171   1HG1  ILE  24          2HG1      ILE  24  -0.999  -1.172  -5.463
  172   2HG1  ILE  24          3HG1      ILE  24  -1.446  -1.102  -3.741
  173   1HG2  ILE  24          1HG2      ILE  24  -3.597  -3.465  -5.700
  174   2HG2  ILE  24          2HG2      ILE  24  -4.445  -2.180  -6.564
  175   3HG2  ILE  24          3HG2      ILE  24  -2.744  -2.524  -6.933
  176   1HD1  ILE  24          1HD1      ILE  24  -1.711  -3.555  -3.729
  177   2HD1  ILE  24          2HD1      ILE  24  -1.147  -3.582  -5.429
  178   3HD1  ILE  24          3HD1      ILE  24  -0.057  -3.046  -4.147
  179    H    GLU  25           H        GLU  25  -0.977   0.779  -5.043
  180    HA   GLU  25           HA       GLU  25  -1.165   2.159  -2.622
  181   1HB   GLU  25          2HB       GLU  25   0.743   2.157  -4.934
  182   2HB   GLU  25          3HB       GLU  25   0.858   3.515  -3.803
  183   1HG   GLU  25          2HG       GLU  25   2.334   1.608  -3.180
  184   2HG   GLU  25          3HG       GLU  25   1.180   2.023  -1.909
  185    H    LYS  26           H        LYS  26  -1.727   3.454  -5.889
  186    HA   LYS  26           HA       LYS  26  -1.780   6.199  -4.950
  187   1HB   LYS  26          2HB       LYS  26  -2.481   4.928  -7.587
  188   2HB   LYS  26          3HB       LYS  26  -3.034   6.555  -7.201
  189   1HG   LYS  26          2HG       LYS  26  -1.033   6.907  -8.325
  190   2HG   LYS  26          3HG       LYS  26  -0.640   7.202  -6.620
  191   1HD   LYS  26          2HD       LYS  26   0.476   5.092  -6.426
  192   2HD   LYS  26          3HD       LYS  26  -0.125   4.611  -8.029
  193   1HE   LYS  26          2HE       LYS  26   1.208   6.182  -9.198
  194   2HE   LYS  26          3HE       LYS  26   1.592   7.095  -7.730
  195   1HZ   LYS  26          1HZ       LYS  26   2.934   5.319  -6.977
  196   2HZ   LYS  26          2HZ       LYS  26   2.538   4.362  -8.263
  197   3HZ   LYS  26          3HZ       LYS  26   3.415   5.735  -8.493
  198    H    GLY  27           H        GLY  27  -4.303   3.745  -5.666
  199   1HA   GLY  27          2HA       GLY  27  -6.573   5.340  -4.936
  200   2HA   GLY  27          3HA       GLY  27  -6.445   3.569  -4.891
  201    H    LEU  28           H        LEU  28  -4.289   3.251  -3.121
  202    HA   LEU  28           HA       LEU  28  -5.735   3.304  -0.680
  203   1HB   LEU  28          2HB       LEU  28  -4.132   1.599  -1.159
  204   2HB   LEU  28          3HB       LEU  28  -2.812   2.755  -1.261
  205    HG   LEU  28           HG       LEU  28  -3.000   1.260   0.802
  206   1HD1  LEU  28          1HD1      LEU  28  -2.024   2.950   2.245
  207   2HD1  LEU  28          2HD1      LEU  28  -1.503   3.265   0.586
  208   3HD1  LEU  28          3HD1      LEU  28  -2.785   4.242   1.329
  209   1HD2  LEU  28          1HD2      LEU  28  -5.276   1.435   1.329
  210   2HD2  LEU  28          2HD2      LEU  28  -4.405   2.205   2.660
  211   3HD2  LEU  28          3HD2      LEU  28  -5.263   3.187   1.515
  212    H    LYS  29           H        LYS  29  -3.135   5.448  -1.904
  213    HA   LYS  29           HA       LYS  29  -2.731   7.154   0.206
  214   1HB   LYS  29          2HB       LYS  29  -1.768   7.342  -2.123
  215   2HB   LYS  29          3HB       LYS  29  -3.292   8.114  -2.598
  216   1HG   LYS  29          2HG       LYS  29  -2.796   9.793  -0.625
  217   2HG   LYS  29          3HG       LYS  29  -1.172   9.143  -0.674
  218   1HD   LYS  29          2HD       LYS  29  -2.643  10.241  -3.121
  219   2HD   LYS  29          3HD       LYS  29  -1.757  11.290  -2.001
  220   1HE   LYS  29          2HE       LYS  29   0.309  10.485  -2.530
  221   2HE   LYS  29          3HE       LYS  29  -0.267   8.920  -3.152
  222   1HZ   LYS  29          1HZ       LYS  29  -1.048  10.124  -5.074
  223   2HZ   LYS  29          2HZ       LYS  29  -0.518  11.555  -4.431
  224   3HZ   LYS  29          3HZ       LYS  29   0.569  10.379  -4.802
  225    H    ARG  30           H        ARG  30  -5.771   6.828  -1.590
  226    HA   ARG  30           HA       ARG  30  -6.730   9.404  -0.807
  227   1HB   ARG  30          2HB       ARG  30  -7.236   7.897  -2.866
  228   2HB   ARG  30          3HB       ARG  30  -8.465   7.139  -1.858
  229   1HG   ARG  30          2HG       ARG  30  -8.448  10.145  -1.922
  230   2HG   ARG  30          3HG       ARG  30  -8.747   9.377  -3.473
  231   1HD   ARG  30          2HD       ARG  30 -10.700   8.314  -2.791
  232   2HD   ARG  30          3HD       ARG  30 -10.353   8.445  -1.074
  233    HE   ARG  30           HE       ARG  30 -11.554  10.449  -2.823
  234   1HH1  ARG  30          2HH2      ARG  30  -9.770   9.969   0.234
  235   2HH1  ARG  30          1HH2      ARG  30 -10.263  11.482   0.913
  236   1HH2  ARG  30          2HH1      ARG  30 -12.154  12.493  -1.936
  237   2HH2  ARG  30          1HH1      ARG  30 -11.636  12.950  -0.347
  238    H    MET  31           H        MET  31  -6.352   6.679   1.177
  239    HA   MET  31           HA       MET  31  -8.740   7.084   2.818
  240   1HB   MET  31          2HB       MET  31  -6.513   5.136   2.512
  241   2HB   MET  31          3HB       MET  31  -6.831   5.502   4.185
  242   1HG   MET  31          2HG       MET  31  -8.095   3.584   3.267
  243   2HG   MET  31          3HG       MET  31  -9.125   4.824   3.980
  244   1HE   MET  31          1HE       MET  31 -10.431   2.653   2.646
  245   2HE   MET  31          2HE       MET  31 -11.362   4.095   3.090
  246   3HE   MET  31          3HE       MET  31 -11.551   3.397   1.465
  247    HA   PRO  32           HA       PRO  32  -7.093  10.044   5.565
  248   1HB   PRO  32          2HB       PRO  32  -7.806   9.279   8.086
  249   2HB   PRO  32          3HB       PRO  32  -9.006   9.741   6.846
  250   1HG   PRO  32          2HG       PRO  32  -8.098   6.952   7.591
  251   2HG   PRO  32          3HG       PRO  32  -9.779   7.541   7.433
  252   1HD   PRO  32          2HD       PRO  32  -8.489   6.215   5.460
  253   2HD   PRO  32          3HD       PRO  32  -9.632   7.524   5.049
  254    H    GLY  33           H        GLY  33  -5.475  10.501   7.264
  255   1HA   GLY  33          2HA       GLY  33  -3.430  10.340   8.154
  256   2HA   GLY  33          3HA       GLY  33  -3.671   8.597   8.271
  257    H    VAL  34           H        VAL  34  -3.926   8.160   5.331
  258    HA   VAL  34           HA       VAL  34  -1.118   8.059   4.705
  259    HB   VAL  34           HB       VAL  34  -3.436   7.623   2.840
  260   1HG1  VAL  34          1HG1      VAL  34  -0.512   6.619   2.986
  261   2HG1  VAL  34          2HG1      VAL  34  -1.669   6.036   1.802
  262   3HG1  VAL  34          3HG1      VAL  34  -1.162   7.725   1.768
  263   1HG2  VAL  34          1HG2      VAL  34  -2.161   5.648   4.785
  264   2HG2  VAL  34          2HG2      VAL  34  -3.858   6.166   4.739
  265   3HG2  VAL  34          3HG2      VAL  34  -3.214   5.187   3.432
  266    H    THR  35           H        THR  35   0.067   9.245   3.269
  267    HA   THR  35           HA       THR  35  -1.260  11.625   2.059
  268    HB   THR  35           HB       THR  35   0.670  11.592   4.246
  269    HG1  THR  35           1HG      THR  35  -1.399  12.570   4.164
  270   1HG2  THR  35          1HG2      THR  35   1.839  13.646   3.489
  271   2HG2  THR  35          2HG2      THR  35   2.336  12.172   2.643
  272   3HG2  THR  35          3HG2      THR  35   1.252  13.355   1.842
  273    H    ASP  36           H        ASP  36   1.538   9.309   1.928
  274    HA   ASP  36           HA       ASP  36   1.067   9.474  -0.868
  275   1HB   ASP  36          2HB       ASP  36   3.222  11.023  -0.114
  276   2HB   ASP  36          3HB       ASP  36   4.003   9.477  -0.470
  277    H    ALA  37           H        ALA  37   2.357   7.866  -2.077
  278    HA   ALA  37           HA       ALA  37   2.939   5.444  -0.586
  279   1HB   ALA  37          1HB       ALA  37   1.043   4.101  -1.330
  280   2HB   ALA  37          2HB       ALA  37   0.445   5.488  -0.418
  281   3HB   ALA  37          3HB       ALA  37   0.351   5.496  -2.192
  282    H    ASN  38           H        ASN  38   4.043   3.889  -1.809
  283    HA   ASN  38           HA       ASN  38   4.595   4.570  -4.640
  284   1HB   ASN  38          2HB       ASN  38   7.152   4.373  -3.473
  285   2HB   ASN  38          3HB       ASN  38   6.391   5.782  -4.186
  286   1HD2  ASN  38          1HD2      ASN  38   5.906   4.125  -0.992
  287   2HD2  ASN  38          2HD2      ASN  38   6.281   5.578  -0.066
  288    H    VAL  39           H        VAL  39   4.251   2.597  -5.447
  289    HA   VAL  39           HA       VAL  39   5.007   0.234  -3.939
  290    HB   VAL  39           HB       VAL  39   3.014   0.462  -5.392
  291   1HG1  VAL  39          1HG1      VAL  39   4.072   1.559  -7.379
  292   2HG1  VAL  39          2HG1      VAL  39   4.926   0.041  -7.741
  293   3HG1  VAL  39          3HG1      VAL  39   3.179   0.089  -7.793
  294   1HG2  VAL  39          1HG2      VAL  39   4.510  -1.879  -6.431
  295   2HG2  VAL  39          2HG2      VAL  39   4.323  -1.751  -4.671
  296   3HG2  VAL  39          3HG2      VAL  39   2.892  -1.770  -5.698
  297    H    ASN  40           H        ASN  40   7.049  -0.714  -3.939
  298    HA   ASN  40           HA       ASN  40   9.058   0.349  -5.878
  299   1HB   ASN  40          2HB       ASN  40   9.453   0.809  -3.460
  300   2HB   ASN  40          3HB       ASN  40   9.496  -0.935  -3.159
  301   1HD2  ASN  40          1HD2      ASN  40  11.728   0.131  -2.364
  302   2HD2  ASN  40          2HD2      ASN  40  13.021   0.016  -3.548
  303    H    LEU  41           H        LEU  41   7.488  -1.226  -7.058
  304    HA   LEU  41           HA       LEU  41   7.752  -4.015  -6.574
  305   1HB   LEU  41          2HB       LEU  41   6.061  -2.387  -8.052
  306   2HB   LEU  41          3HB       LEU  41   6.950  -3.198  -9.323
  307    HG   LEU  41           HG       LEU  41   4.772  -4.219  -8.636
  308   1HD1  LEU  41          1HD1      LEU  41   7.123  -6.109  -8.170
  309   2HD1  LEU  41          2HD1      LEU  41   5.492  -6.537  -8.715
  310   3HD1  LEU  41          3HD1      LEU  41   6.560  -5.581  -9.760
  311   1HD2  LEU  41          1HD2      LEU  41   6.014  -5.436  -6.190
  312   2HD2  LEU  41          2HD2      LEU  41   5.269  -3.846  -6.068
  313   3HD2  LEU  41          3HD2      LEU  41   4.315  -5.220  -6.650
  314    H    ALA  42           H        ALA  42   9.767  -1.776  -8.248
  315    HA   ALA  42           HA       ALA  42  11.339  -3.319  -9.955
  316   1HB   ALA  42          1HB       ALA  42  11.697  -0.902  -9.504
  317   2HB   ALA  42          2HB       ALA  42  12.255  -1.306  -7.858
  318   3HB   ALA  42          3HB       ALA  42  13.187  -1.846  -9.264
  319    H    THR  43           H        THR  43  11.217  -3.340  -6.368
  320    HA   THR  43           HA       THR  43  12.866  -5.815  -6.466
  321    HB   THR  43           HB       THR  43  14.276  -4.023  -5.681
  322    HG1  THR  43           1HG      THR  43  13.463  -6.015  -3.872
  323   1HG2  THR  43          1HG2      THR  43  12.324  -3.685  -3.358
  324   2HG2  THR  43          2HG2      THR  43  13.917  -2.930  -3.518
  325   3HG2  THR  43          3HG2      THR  43  12.629  -2.514  -4.657
  326    H    GLU  44           H        GLU  44  10.098  -5.593  -6.746
  327    HA   GLU  44           HA       GLU  44   8.135  -6.414  -6.000
  328   1HB   GLU  44          2HB       GLU  44  10.174  -8.338  -4.807
  329   2HB   GLU  44          3HB       GLU  44   8.447  -8.690  -4.965
  330   1HG   GLU  44          2HG       GLU  44   8.518  -8.432  -7.384
  331   2HG   GLU  44          3HG       GLU  44  10.227  -7.965  -7.326
  332    H    THR  45           H        THR  45   9.023  -4.236  -4.233
  333    HA   THR  45           HA       THR  45   7.886  -5.089  -1.607
  334    HB   THR  45           HB       THR  45  10.090  -3.098  -2.327
  335    HG1  THR  45           1HG      THR  45  10.656  -5.377  -2.371
  336   1HG2  THR  45          1HG2      THR  45   8.963  -3.930   0.368
  337   2HG2  THR  45          2HG2      THR  45  10.461  -3.007   0.134
  338   3HG2  THR  45          3HG2      THR  45   8.917  -2.293  -0.350
  339    H    VAL  46           H        VAL  46   6.672  -3.315  -0.520
  340    HA   VAL  46           HA       VAL  46   5.920  -1.031  -2.297
  341    HB   VAL  46           HB       VAL  46   4.099  -2.600  -2.450
  342   1HG1  VAL  46          1HG1      VAL  46   4.475  -3.942  -0.401
  343   2HG1  VAL  46          2HG1      VAL  46   3.991  -2.520   0.560
  344   3HG1  VAL  46          3HG1      VAL  46   2.820  -3.336  -0.495
  345   1HG2  VAL  46          1HG2      VAL  46   3.384  -0.364  -0.487
  346   2HG2  VAL  46          2HG2      VAL  46   3.474  -0.227  -2.259
  347   3HG2  VAL  46          3HG2      VAL  46   2.281  -1.304  -1.488
  348    H    ASN  47           H        ASN  47   5.641   0.990  -1.264
  349    HA   ASN  47           HA       ASN  47   6.288   1.061   1.632
  350   1HB   ASN  47          2HB       ASN  47   7.471   2.664  -0.682
  351   2HB   ASN  47          3HB       ASN  47   7.493   3.248   0.985
  352   1HD2  ASN  47          1HD2      ASN  47   8.475   1.697   2.647
  353   2HD2  ASN  47          2HD2      ASN  47  10.009   1.023   2.124
  354    H    VAL  48           H        VAL  48   5.085   2.683   2.752
  355    HA   VAL  48           HA       VAL  48   3.039   4.160   1.206
  356    HB   VAL  48           HB       VAL  48   2.509   2.257   3.517
  357   1HG1  VAL  48          1HG1      VAL  48   0.498   3.983   2.056
  358   2HG1  VAL  48          2HG1      VAL  48   0.238   2.896   3.450
  359   3HG1  VAL  48          3HG1      VAL  48   1.175   4.376   3.645
  360   1HG2  VAL  48          1HG2      VAL  48   2.671   1.031   1.410
  361   2HG2  VAL  48          2HG2      VAL  48   0.983   1.128   1.921
  362   3HG2  VAL  48          3HG2      VAL  48   1.573   2.186   0.624
  363    H    ILE  49           H        ILE  49   3.070   6.209   1.934
  364    HA   ILE  49           HA       ILE  49   4.660   6.842   4.304
  365    HB   ILE  49           HB       ILE  49   3.838   8.711   2.047
  366   1HG1  ILE  49          2HG1      ILE  49   5.081   6.992   0.945
  367   2HG1  ILE  49          3HG1      ILE  49   6.038   8.460   1.062
  368   1HG2  ILE  49          1HG2      ILE  49   5.766  10.041   2.852
  369   2HG2  ILE  49          2HG2      ILE  49   4.491   9.862   4.064
  370   3HG2  ILE  49          3HG2      ILE  49   5.973   8.902   4.201
  371   1HD1  ILE  49          1HD1      ILE  49   7.294   7.489   2.992
  372   2HD1  ILE  49          2HD1      ILE  49   6.366   5.983   2.806
  373   3HD1  ILE  49          3HD1      ILE  49   7.446   6.529   1.513
  374    H    TYR  50           H        TYR  50   3.212   7.011   6.049
  375    HA   TYR  50           HA       TYR  50   0.763   8.659   5.724
  376   1HB   TYR  50          2HB       TYR  50  -0.689   6.962   6.606
  377   2HB   TYR  50          3HB       TYR  50   0.132   6.295   5.209
  378    HD1  TYR  50           HD1      TYR  50   2.105   4.686   5.602
  379    HD2  TYR  50           HD2      TYR  50  -0.628   5.887   8.691
  380    HE1  TYR  50           HE1      TYR  50   2.324   2.489   6.688
  381    HE2  TYR  50           HE2      TYR  50  -0.067   3.846   9.970
  382    HH   TYR  50           HH       TYR  50   1.047   1.849   9.963
  383    H    ASP  51           H        ASP  51  -0.410   8.768   7.826
  384    HA   ASP  51           HA       ASP  51   1.592   9.352   9.977
  385   1HB   ASP  51          2HB       ASP  51   0.152  11.197   9.616
  386   2HB   ASP  51          3HB       ASP  51  -1.276  10.175   9.680
  387    HA   PRO  52           HA       PRO  52   0.099   5.388  11.501
  388   1HB   PRO  52          2HB       PRO  52   2.075   4.683  13.177
  389   2HB   PRO  52          3HB       PRO  52   2.333   4.795  11.419
  390   1HG   PRO  52          2HG       PRO  52   2.918   6.944  13.499
  391   2HG   PRO  52          3HG       PRO  52   4.043   6.295  12.271
  392   1HD   PRO  52          2HD       PRO  52   2.585   8.588  11.877
  393   2HD   PRO  52          3HD       PRO  52   2.940   7.459  10.534
  394    H    ALA  53           H        ALA  53  -0.457   8.297  12.963
  395    HA   ALA  53           HA       ALA  53  -1.427   7.056  15.484
  396   1HB   ALA  53          1HB       ALA  53  -1.984   9.286  16.135
  397   2HB   ALA  53          2HB       ALA  53  -0.300   9.301  15.563
  398   3HB   ALA  53          3HB       ALA  53  -1.604   9.934  14.534
  399    H    GLU  54           H        GLU  54  -2.311   8.243  12.242
  400    HA   GLU  54           HA       GLU  54  -5.181   8.188  12.946
  401   1HB   GLU  54          2HB       GLU  54  -3.728  10.114  11.696
  402   2HB   GLU  54          3HB       GLU  54  -4.238   9.182  10.292
  403   1HG   GLU  54          2HG       GLU  54  -6.627   9.383  11.137
  404   2HG   GLU  54          3HG       GLU  54  -6.006  10.464  12.397
  405    H    THR  55           H        THR  55  -2.942   7.120  10.377
  406    HA   THR  55           HA       THR  55  -4.540   4.711  10.071
  407    HB   THR  55           HB       THR  55  -2.695   4.307   8.053
  408    HG1  THR  55           1HG      THR  55  -3.825   6.689   7.470
  409   1HG2  THR  55          1HG2      THR  55  -5.507   5.522   8.085
  410   2HG2  THR  55          2HG2      THR  55  -4.686   4.802   6.672
  411   3HG2  THR  55          3HG2      THR  55  -5.121   3.765   8.064
  412    H    GLY  56           H        GLY  56  -3.030   2.912   9.388
  413   1HA   GLY  56          2HA       GLY  56  -0.948   2.085  11.111
  414   2HA   GLY  56          3HA       GLY  56  -2.546   1.554  11.704
  415    H    THR  57           H        THR  57  -2.501  -0.588  10.963
  416    HA   THR  57           HA       THR  57  -1.767  -1.349   8.223
  417    HB   THR  57           HB       THR  57  -2.343  -3.617   9.237
  418    HG1  THR  57           1HG      THR  57  -3.072  -3.619  11.253
  419   1HG2  THR  57          1HG2      THR  57   0.002  -2.746   9.141
  420   2HG2  THR  57          2HG2      THR  57  -0.222  -1.930  10.698
  421   3HG2  THR  57          3HG2      THR  57  -0.268  -3.702  10.611
  422    H    ALA  58           H        ALA  58  -4.426  -0.762  10.427
  423    HA   ALA  58           HA       ALA  58  -6.345  -2.334   9.550
  424   1HB   ALA  58          1HB       ALA  58  -6.543  -0.923  11.534
  425   2HB   ALA  58          2HB       ALA  58  -6.760   0.515  10.514
  426   3HB   ALA  58          3HB       ALA  58  -7.990  -0.767  10.520
  427    H    ALA  59           H        ALA  59  -6.012   0.903   8.316
  428    HA   ALA  59           HA       ALA  59  -8.380   0.560   6.567
  429   1HB   ALA  59          1HB       ALA  59  -7.914   2.765   5.725
  430   2HB   ALA  59          2HB       ALA  59  -7.708   2.799   7.490
  431   3HB   ALA  59          3HB       ALA  59  -6.281   2.753   6.414
  432    H    ILE  60           H        ILE  60  -4.897   0.347   6.330
  433    HA   ILE  60           HA       ILE  60  -4.689   0.185   3.510
  434    HB   ILE  60           HB       ILE  60  -2.927  -0.373   5.918
  435   1HG1  ILE  60          2HG1      ILE  60  -1.394   1.077   4.538
  436   2HG1  ILE  60          3HG1      ILE  60  -2.662   1.098   3.307
  437   1HG2  ILE  60          1HG2      ILE  60  -2.417  -2.363   4.559
  438   2HG2  ILE  60          2HG2      ILE  60  -2.146  -1.320   3.141
  439   3HG2  ILE  60          3HG2      ILE  60  -1.099  -1.198   4.579
  440   1HD1  ILE  60          1HD1      ILE  60  -2.932   2.121   6.196
  441   2HD1  ILE  60          2HD1      ILE  60  -2.544   3.153   4.812
  442   3HD1  ILE  60          3HD1      ILE  60  -4.126   2.370   4.907
  443    H    GLN  61           H        GLN  61  -5.010  -2.376   6.007
  444    HA   GLN  61           HA       GLN  61  -4.812  -4.510   4.089
  445   1HB   GLN  61          2HB       GLN  61  -5.308  -4.264   6.957
  446   2HB   GLN  61          3HB       GLN  61  -6.460  -5.364   6.201
  447   1HG   GLN  61          2HG       GLN  61  -4.781  -6.787   6.821
  448   2HG   GLN  61          3HG       GLN  61  -4.482  -6.554   5.101
  449   1HE2  GLN  61          1HE2      GLN  61  -3.338  -3.687   6.006
  450   2HE2  GLN  61          2HE2      GLN  61  -1.710  -4.143   6.479
  451    H    GLU  62           H        GLU  62  -7.603  -2.780   5.579
  452    HA   GLU  62           HA       GLU  62  -9.735  -4.056   4.282
  453   1HB   GLU  62          2HB       GLU  62  -9.185  -1.300   5.386
  454   2HB   GLU  62          3HB       GLU  62 -10.547  -1.441   4.291
  455   1HG   GLU  62          2HG       GLU  62 -11.418  -3.344   5.722
  456   2HG   GLU  62          3HG       GLU  62 -10.153  -2.930   6.900
  457    H    LYS  63           H        LYS  63  -7.842  -1.226   3.084
  458    HA   LYS  63           HA       LYS  63  -9.225  -1.104   0.632
  459   1HB   LYS  63          2HB       LYS  63  -6.775   0.022   1.889
  460   2HB   LYS  63          3HB       LYS  63  -6.778   0.060   0.152
  461   1HG   LYS  63          2HG       LYS  63  -9.134   1.119   1.730
  462   2HG   LYS  63          3HG       LYS  63  -7.685   2.082   1.487
  463   1HD   LYS  63          2HD       LYS  63  -9.185   2.765  -0.237
  464   2HD   LYS  63          3HD       LYS  63  -7.834   1.916  -0.944
  465   1HE   LYS  63          2HE       LYS  63  -9.924   1.328  -2.066
  466   2HE   LYS  63          3HE       LYS  63  -9.224  -0.091  -1.302
  467   1HZ   LYS  63          1HZ       LYS  63 -10.787   0.232   0.529
  468   2HZ   LYS  63          2HZ       LYS  63 -11.447   1.531  -0.237
  469   3HZ   LYS  63          3HZ       LYS  63 -11.562   0.031  -0.902
  470    H    ILE  64           H        ILE  64  -6.157  -2.702   1.533
  471    HA   ILE  64           HA       ILE  64  -5.038  -3.305  -0.872
  472    HB   ILE  64           HB       ILE  64  -5.046  -4.319   1.886
  473   1HG1  ILE  64          2HG1      ILE  64  -3.636  -2.454   0.869
  474   2HG1  ILE  64          3HG1      ILE  64  -2.853  -3.671   1.877
  475   1HG2  ILE  64          1HG2      ILE  64  -4.003  -6.062  -0.310
  476   2HG2  ILE  64          2HG2      ILE  64  -3.525  -6.165   1.409
  477   3HG2  ILE  64          3HG2      ILE  64  -5.197  -6.451   0.957
  478   1HD1  ILE  64          1HD1      ILE  64  -1.544  -3.157  -0.125
  479   2HD1  ILE  64          2HD1      ILE  64  -2.059  -4.858  -0.062
  480   3HD1  ILE  64          3HD1      ILE  64  -2.873  -3.726  -1.164
  481    H    GLU  65           H        GLU  65  -7.408  -5.240   1.059
  482    HA   GLU  65           HA       GLU  65  -7.909  -7.323  -0.786
  483   1HB   GLU  65          2HB       GLU  65  -9.646  -6.010   1.355
  484   2HB   GLU  65          3HB       GLU  65 -10.127  -7.469   0.479
  485   1HG   GLU  65          2HG       GLU  65  -7.449  -7.453   1.867
  486   2HG   GLU  65          3HG       GLU  65  -8.929  -7.639   2.815
  487    H    LYS  66           H        LYS  66  -9.812  -4.324  -0.237
  488    HA   LYS  66           HA       LYS  66 -11.661  -4.762  -2.314
  489   1HB   LYS  66          2HB       LYS  66 -10.900  -2.555  -0.530
  490   2HB   LYS  66          3HB       LYS  66 -11.365  -1.940  -2.114
  491   1HG   LYS  66          2HG       LYS  66 -13.055  -3.940  -0.560
  492   2HG   LYS  66          3HG       LYS  66 -13.227  -2.192  -0.375
  493   1HD   LYS  66          2HD       LYS  66 -13.669  -1.947  -2.812
  494   2HD   LYS  66          3HD       LYS  66 -13.534  -3.700  -3.020
  495   1HE   LYS  66          2HE       LYS  66 -15.442  -4.039  -1.453
  496   2HE   LYS  66          3HE       LYS  66 -15.582  -2.287  -1.235
  497   1HZ   LYS  66          1HZ       LYS  66 -16.099  -2.100  -3.576
  498   2HZ   LYS  66          2HZ       LYS  66 -15.964  -3.728  -3.779
  499   3HZ   LYS  66          3HZ       LYS  66 -17.154  -3.112  -2.829
  500    H    LEU  67           H        LEU  67  -8.458  -3.354  -2.498
  501    HA   LEU  67           HA       LEU  67  -8.634  -2.365  -5.212
  502   1HB   LEU  67          2HB       LEU  67  -6.351  -2.920  -3.305
  503   2HB   LEU  67          3HB       LEU  67  -6.113  -2.249  -4.916
  504    HG   LEU  67           HG       LEU  67  -8.034  -0.948  -2.955
  505   1HD1  LEU  67          1HD1      LEU  67  -5.869  -1.119  -1.823
  506   2HD1  LEU  67          2HD1      LEU  67  -5.076  -0.373  -3.205
  507   3HD1  LEU  67          3HD1      LEU  67  -6.241   0.560  -2.257
  508   1HD2  LEU  67          1HD2      LEU  67  -6.672  -0.058  -5.507
  509   2HD2  LEU  67          2HD2      LEU  67  -8.390  -0.053  -5.096
  510   3HD2  LEU  67          3HD2      LEU  67  -7.297   1.105  -4.326
  511    H    GLY  68           H        GLY  68  -8.248  -5.526  -3.815
  512   1HA   GLY  68          2HA       GLY  68  -8.297  -7.523  -4.938
  513   2HA   GLY  68          3HA       GLY  68  -7.970  -6.714  -6.478
  514    H    TYR  69           H        TYR  69  -6.170  -6.610  -3.334
  515    HA   TYR  69           HA       TYR  69  -3.861  -8.030  -4.583
  516   1HB   TYR  69          2HB       TYR  69  -4.046  -5.214  -4.034
  517   2HB   TYR  69          3HB       TYR  69  -2.998  -5.898  -2.817
  518    HD1  TYR  69           HD1      TYR  69  -0.729  -6.340  -3.359
  519    HD2  TYR  69           HD2      TYR  69  -3.641  -5.938  -6.513
  520    HE1  TYR  69           HE1      TYR  69   1.069  -5.973  -4.993
  521    HE2  TYR  69           HE2      TYR  69  -1.850  -5.764  -8.160
  522    HH   TYR  69           HH       TYR  69   0.462  -5.590  -8.493
  523    H    HIS  70           H        HIS  70  -2.227  -8.561  -2.777
  524    HA   HIS  70           HA       HIS  70  -3.276  -8.277  -0.084
  525   1HB   HIS  70          2HB       HIS  70  -4.057 -10.567  -0.991
  526   2HB   HIS  70          3HB       HIS  70  -2.358 -11.046  -0.913
  527    HD1  HIS  70           1HD      HIS  70  -4.290  -8.954   1.741
  528    HD2  HIS  70           2HD      HIS  70  -2.690 -12.790   1.096
  529    HE1  HIS  70           1HE      HIS  70  -4.469 -10.199   3.955
  530    H    VAL  71           H        VAL  71  -1.620  -7.799   1.354
  531    HA   VAL  71           HA       VAL  71   1.121  -7.870   0.291
  532    HB   VAL  71           HB       VAL  71   1.517  -6.294   2.174
  533   1HG1  VAL  71          1HG1      VAL  71   1.600  -5.292   0.130
  534   2HG1  VAL  71          2HG1      VAL  71  -0.058  -5.712  -0.304
  535   3HG1  VAL  71          3HG1      VAL  71   0.245  -4.397   0.846
  536   1HG2  VAL  71          1HG2      VAL  71  -0.563  -6.770   3.487
  537   2HG2  VAL  71          2HG2      VAL  71  -0.279  -5.052   3.172
  538   3HG2  VAL  71          3HG2      VAL  71  -1.492  -5.919   2.232
  539    H    VAL  72           H        VAL  72   2.800  -8.303   1.866
  540    HA   VAL  72           HA       VAL  72   2.061 -10.434   3.800
  541    HB   VAL  72           HB       VAL  72   4.362 -10.617   1.923
  542   1HG1  VAL  72          1HG1      VAL  72   4.550 -11.898   4.053
  543   2HG1  VAL  72          2HG1      VAL  72   3.004 -12.692   3.697
  544   3HG1  VAL  72          3HG1      VAL  72   4.416 -12.971   2.657
  545   1HG2  VAL  72          1HG2      VAL  72   2.377 -10.799   0.506
  546   2HG2  VAL  72          2HG2      VAL  72   3.038 -12.416   0.753
  547   3HG2  VAL  72          3HG2      VAL  72   1.609 -11.901   1.672
  548    H    ILE  73           H        ILE  73   3.329 -10.465   5.603
  549    HA   ILE  73           HA       ILE  73   5.172  -8.149   6.051
  550    HB   ILE  73           HB       ILE  73   3.212  -9.381   7.986
  551   1HG1  ILE  73          2HG1      ILE  73   2.067  -8.016   6.248
  552   2HG1  ILE  73          3HG1      ILE  73   1.989  -7.358   7.873
  553   1HG2  ILE  73          1HG2      ILE  73   5.168  -8.575   9.170
  554   2HG2  ILE  73          2HG2      ILE  73   5.196  -7.073   8.249
  555   3HG2  ILE  73          3HG2      ILE  73   3.877  -7.398   9.398
  556   1HD1  ILE  73          1HD1      ILE  73   2.363  -5.624   6.135
  557   2HD1  ILE  73          2HD1      ILE  73   3.623  -5.640   7.377
  558   3HD1  ILE  73          3HD1      ILE  73   3.935  -6.357   5.784
  559    H    GLU  74           H        GLU  74   6.839  -9.768   5.260
  560    HA   GLU  74           HA       GLU  74   7.476 -11.905   6.940
  561   1HB   GLU  74          2HB       GLU  74   8.894 -10.475   4.681
  562   2HB   GLU  74          3HB       GLU  74   9.546 -11.886   5.498
  563   1HG   GLU  74          2HG       GLU  74   7.550 -13.216   4.879
  564   2HG   GLU  74          3HG       GLU  74   6.836 -11.799   4.088
  565    H    GLY  75           H        GLY  75   7.702  -8.812   7.578
  566   1HA   GLY  75          2HA       GLY  75  10.418  -8.610   8.723
  567   2HA   GLY  75          3HA       GLY  75   9.229  -7.317   8.558
  568    H    ARG  76           H        ARG  76   7.073  -8.906   9.914
  569    HA   ARG  76           HA       ARG  76   7.848  -8.245  12.675
  570   1HB   ARG  76          2HB       ARG  76   5.774  -7.211  11.853
  571   2HB   ARG  76          3HB       ARG  76   5.154  -8.816  11.397
  572   1HG   ARG  76          2HG       ARG  76   5.156  -9.547  13.716
  573   2HG   ARG  76          3HG       ARG  76   5.828  -8.001  14.248
  574   1HD   ARG  76          2HD       ARG  76   3.219  -8.222  12.670
  575   2HD   ARG  76          3HD       ARG  76   3.218  -8.477  14.401
  576    HE   ARG  76           HE       ARG  76   3.441  -5.955  12.973
  577   1HH1  ARG  76          2HH2      ARG  76   4.410  -7.567  15.931
  578   2HH1  ARG  76          1HH2      ARG  76   4.259  -6.182  16.969
  579   1HH2  ARG  76          2HH1      ARG  76   3.224  -4.047  14.296
  580   2HH2  ARG  76          1HH1      ARG  76   3.600  -4.112  15.987
  Start of MODEL    2
    1   1H    MET   1          H1        MET   1   3.331  17.682  12.713
    2   2H    MET   1          H2        MET   1   4.705  17.236  13.523
    3   3H    MET   1          H3        MET   1   3.385  16.232  13.427
    4    HA   MET   1           HA       MET   1   3.749  17.440  15.594
    5   1HB   MET   1          2HB       MET   1   2.838  19.678  13.746
    6   2HB   MET   1          3HB       MET   1   2.353  19.658  15.447
    7   1HG   MET   1          2HG       MET   1   4.675  19.585  16.177
    8   2HG   MET   1          3HG       MET   1   5.226  19.704  14.494
    9   1HE   MET   1          1HE       MET   1   5.954  21.661  17.046
   10   2HE   MET   1          2HE       MET   1   6.709  21.805  15.436
   11   3HE   MET   1          3HE       MET   1   5.968  23.228  16.207
   12    H    LEU   2           H        LEU   2   0.848  18.679  13.946
   13    HA   LEU   2           HA       LEU   2  -0.924  17.474  15.683
   14   1HB   LEU   2          2HB       LEU   2  -1.138  19.227  13.586
   15   2HB   LEU   2          3HB       LEU   2  -1.807  17.796  12.821
   16    HG   LEU   2           HG       LEU   2  -3.597  19.063  13.680
   17   1HD1  LEU   2          1HD1      LEU   2  -3.781  16.607  14.106
   18   2HD1  LEU   2          2HD1      LEU   2  -3.205  16.879  15.768
   19   3HD1  LEU   2          3HD1      LEU   2  -4.726  17.602  15.228
   20   1HD2  LEU   2          1HD2      LEU   2  -2.235  19.170  16.404
   21   2HD2  LEU   2          2HD2      LEU   2  -2.336  20.496  15.228
   22   3HD2  LEU   2          3HD2      LEU   2  -3.809  19.858  15.975
   23    H    SER   3           H        SER   3   0.267  16.291  12.575
   24    HA   SER   3           HA       SER   3  -0.255  13.480  13.344
   25   1HB   SER   3          2HB       SER   3  -0.208  14.808  10.582
   26   2HB   SER   3          3HB       SER   3  -0.096  13.063  10.839
   27    HG   SER   3           HG       SER   3  -2.103  12.967  11.478
   28    H    GLU   4           H        GLU   4   1.578  12.150  12.619
   29    HA   GLU   4           HA       GLU   4   4.041  13.513  11.765
   30   1HB   GLU   4          2HB       GLU   4   3.529  11.256  13.641
   31   2HB   GLU   4          3HB       GLU   4   4.947  11.209  12.638
   32   1HG   GLU   4          2HG       GLU   4   5.329  13.612  13.510
   33   2HG   GLU   4          3HG       GLU   4   4.169  13.143  14.753
   34    H    GLN   5           H        GLN   5   5.249  11.495  10.502
   35    HA   GLN   5           HA       GLN   5   3.309   9.958   8.893
   36   1HB   GLN   5          2HB       GLN   5   5.644  11.651   7.968
   37   2HB   GLN   5          3HB       GLN   5   4.906  10.460   6.918
   38   1HG   GLN   5          2HG       GLN   5   3.282  12.730   8.199
   39   2HG   GLN   5          3HG       GLN   5   4.244  12.959   6.760
   40   1HE2  GLN   5          1HE2      GLN   5   3.022   9.736   6.690
   41   2HE2  GLN   5          2HE2      GLN   5   1.677  10.088   5.633
   42    H    LYS   6           H        LYS   6   4.243   7.915   8.250
   43    HA   LYS   6           HA       LYS   6   7.113   7.636   8.451
   44   1HB   LYS   6          2HB       LYS   6   5.264   5.825  10.076
   45   2HB   LYS   6          3HB       LYS   6   6.833   5.294   9.459
   46   1HG   LYS   6          2HG       LYS   6   7.844   7.374  10.529
   47   2HG   LYS   6          3HG       LYS   6   6.350   7.536  11.450
   48   1HD   LYS   6          2HD       LYS   6   6.806   5.691  12.766
   49   2HD   LYS   6          3HD       LYS   6   7.581   4.797  11.446
   50   1HE   LYS   6          2HE       LYS   6   9.565   6.327  11.575
   51   2HE   LYS   6          3HE       LYS   6   8.840   7.107  12.994
   52   1HZ   LYS   6          1HZ       LYS   6   8.949   4.966  14.102
   53   2HZ   LYS   6          2HZ       LYS   6   9.604   4.267  12.760
   54   3HZ   LYS   6          3HZ       LYS   6  10.439   5.423  13.574
   55    H    GLU   7           H        GLU   7   7.878   5.728   7.445
   56    HA   GLU   7           HA       GLU   7   6.431   5.180   4.936
   57   1HB   GLU   7          2HB       GLU   7   9.441   5.224   5.262
   58   2HB   GLU   7          3HB       GLU   7   8.409   5.507   3.869
   59   1HG   GLU   7          2HG       GLU   7   9.309   7.610   4.405
   60   2HG   GLU   7          3HG       GLU   7   7.735   7.711   5.204
   61    H    ILE   8           H        ILE   8   5.602   3.181   5.695
   62    HA   ILE   8           HA       ILE   8   7.448   1.260   6.956
   63    HB   ILE   8           HB       ILE   8   4.557   1.185   6.285
   64   1HG1  ILE   8          2HG1      ILE   8   4.388   0.987   8.885
   65   2HG1  ILE   8          3HG1      ILE   8   6.100   1.415   8.951
   66   1HG2  ILE   8          1HG2      ILE   8   5.315  -0.999   6.154
   67   2HG2  ILE   8          2HG2      ILE   8   6.265  -0.784   7.680
   68   3HG2  ILE   8          3HG2      ILE   8   4.469  -0.792   7.695
   69   1HD1  ILE   8          1HD1      ILE   8   4.324   3.224   9.334
   70   2HD1  ILE   8          2HD1      ILE   8   5.615   3.615   8.182
   71   3HD1  ILE   8          3HD1      ILE   8   4.010   3.107   7.581
   72    H    ALA   9           H        ALA   9   7.476  -0.872   5.932
   73    HA   ALA   9           HA       ALA   9   7.633  -0.827   2.958
   74   1HB   ALA   9          1HB       ALA   9   9.671  -2.077   4.849
   75   2HB   ALA   9          2HB       ALA   9   9.654  -2.214   3.080
   76   3HB   ALA   9          3HB       ALA   9   9.940  -0.639   3.844
   77    H    MET  10           H        MET  10   6.522  -2.581   2.113
   78    HA   MET  10           HA       MET  10   5.886  -4.874   3.870
   79   1HB   MET  10          2HB       MET  10   4.100  -2.705   3.195
   80   2HB   MET  10          3HB       MET  10   3.605  -4.103   2.235
   81   1HG   MET  10          2HG       MET  10   3.473  -5.463   4.122
   82   2HG   MET  10          3HG       MET  10   4.103  -4.238   5.228
   83   1HE   MET  10          1HE       MET  10   2.713  -1.655   4.992
   84   2HE   MET  10          2HE       MET  10   1.200  -1.883   5.903
   85   3HE   MET  10          3HE       MET  10   2.713  -2.590   6.510
   86    H    GLN  11           H        GLN  11   4.988  -6.676   2.555
   87    HA   GLN  11           HA       GLN  11   6.411  -6.847  -0.060
   88   1HB   GLN  11          2HB       GLN  11   5.664  -8.835   2.117
   89   2HB   GLN  11          3HB       GLN  11   5.711  -9.405   0.458
   90   1HG   GLN  11          2HG       GLN  11   7.989  -8.115   2.021
   91   2HG   GLN  11          3HG       GLN  11   7.850  -9.824   1.567
   92   1HE2  GLN  11          1HE2      GLN  11   6.974  -9.658  -1.104
   93   2HE2  GLN  11          2HE2      GLN  11   8.018  -8.602  -2.036
   94    H    VAL  12           H        VAL  12   5.293  -7.602  -1.883
   95    HA   VAL  12           HA       VAL  12   2.337  -7.150  -1.754
   96    HB   VAL  12           HB       VAL  12   4.293  -7.020  -4.092
   97   1HG1  VAL  12          1HG1      VAL  12   1.338  -6.318  -3.831
   98   2HG1  VAL  12          2HG1      VAL  12   2.360  -5.872  -5.213
   99   3HG1  VAL  12          3HG1      VAL  12   2.044  -7.577  -4.875
  100   1HG2  VAL  12          1HG2      VAL  12   4.725  -5.162  -2.561
  101   2HG2  VAL  12          2HG2      VAL  12   3.826  -4.544  -3.948
  102   3HG2  VAL  12          3HG2      VAL  12   2.980  -4.833  -2.419
  103    H    SER  13           H        SER  13   0.904  -8.728  -2.775
  104    HA   SER  13           HA       SER  13   2.100 -10.991  -4.171
  105   1HB   SER  13          2HB       SER  13   0.616 -11.356  -1.533
  106   2HB   SER  13          3HB       SER  13   0.861 -12.662  -2.699
  107    HG   SER  13           HG       SER  13   3.164 -11.286  -2.061
  108    H    GLY  14           H        GLY  14   0.384 -12.388  -5.089
  109   1HA   GLY  14          2HA       GLY  14  -1.555 -12.704  -6.272
  110   2HA   GLY  14          3HA       GLY  14  -2.371 -11.691  -5.072
  111    H    MET  15           H        MET  15  -0.251 -11.499  -8.005
  112    HA   MET  15           HA       MET  15  -1.672  -9.153  -8.993
  113   1HB   MET  15          2HB       MET  15   0.321  -7.758  -9.013
  114   2HB   MET  15          3HB       MET  15  -0.051  -8.259  -7.351
  115   1HG   MET  15          2HG       MET  15   2.240  -8.507  -7.413
  116   2HG   MET  15          3HG       MET  15   1.706 -10.143  -7.776
  117   1HE   MET  15          1HE       MET  15   2.863 -11.449  -9.541
  118   2HE   MET  15          2HE       MET  15   4.271 -10.753 -10.371
  119   3HE   MET  15          3HE       MET  15   4.167 -10.683  -8.593
  120    H    THR  16           H        THR  16  -0.630  -8.468 -11.105
  121    HA   THR  16           HA       THR  16   0.731 -10.736 -12.510
  122    HB   THR  16           HB       THR  16  -0.198  -9.394 -14.588
  123    HG1  THR  16           1HG      THR  16  -2.203  -8.931 -12.630
  124   1HG2  THR  16          1HG2      THR  16  -0.679 -11.744 -14.142
  125   2HG2  THR  16          2HG2      THR  16  -1.886 -11.304 -12.915
  126   3HG2  THR  16          3HG2      THR  16  -2.160 -10.901 -14.627
  127    H    CYS  17           H        CYS  17   0.571  -7.097 -12.169
  128    HA   CYS  17           HA       CYS  17   3.432  -7.054 -12.862
  129   1HB   CYS  17          2HB       CYS  17   3.121  -5.536 -14.720
  130   2HB   CYS  17          3HB       CYS  17   2.121  -6.961 -15.010
  131    H    ALA  18           H        ALA  18   4.146  -4.676 -12.913
  132    HA   ALA  18           HA       ALA  18   3.637  -3.590 -10.293
  133   1HB   ALA  18          1HB       ALA  18   5.203  -2.433 -12.631
  134   2HB   ALA  18          2HB       ALA  18   5.271  -1.891 -10.939
  135   3HB   ALA  18          3HB       ALA  18   5.849  -3.513 -11.375
  136    H    ALA  19           H        ALA  19   2.211  -3.029 -13.466
  137    HA   ALA  19           HA       ALA  19   1.533  -0.280 -13.106
  138   1HB   ALA  19          1HB       ALA  19   1.551  -1.443 -15.306
  139   2HB   ALA  19          2HB       ALA  19   0.082  -2.325 -14.829
  140   3HB   ALA  19          3HB       ALA  19   0.044  -0.563 -14.985
  141    H    CYS  20           H        CYS  20  -0.379  -3.301 -12.491
  142    HA   CYS  20           HA       CYS  20  -2.542  -1.756 -11.340
  143   1HB   CYS  20          2HB       CYS  20  -3.283  -3.994 -10.403
  144   2HB   CYS  20          3HB       CYS  20  -3.251  -3.833 -12.162
  145    H    ALA  21           H        ALA  21   0.308  -3.414 -10.008
  146    HA   ALA  21           HA       ALA  21  -0.116  -2.799  -7.326
  147   1HB   ALA  21          1HB       ALA  21   1.818  -4.103  -8.587
  148   2HB   ALA  21          2HB       ALA  21   2.671  -2.556  -8.404
  149   3HB   ALA  21          3HB       ALA  21   2.045  -3.429  -6.983
  150    H    ALA  22           H        ALA  22   0.877  -0.560  -9.914
  151    HA   ALA  22           HA       ALA  22   1.452   1.656  -8.153
  152   1HB   ALA  22          1HB       ALA  22   1.328   3.010 -10.148
  153   2HB   ALA  22          2HB       ALA  22   2.190   1.506 -10.543
  154   3HB   ALA  22          3HB       ALA  22   0.501   1.728 -11.042
  155    H    ARG  23           H        ARG  23  -1.418   0.642 -10.077
  156    HA   ARG  23           HA       ARG  23  -3.188   2.696  -9.305
  157   1HB   ARG  23          2HB       ARG  23  -3.659  -0.193 -10.101
  158   2HB   ARG  23          3HB       ARG  23  -4.937   0.696  -9.311
  159   1HG   ARG  23          2HG       ARG  23  -5.474   1.006 -11.443
  160   2HG   ARG  23          3HG       ARG  23  -4.689   2.533 -11.048
  161   1HD   ARG  23          2HD       ARG  23  -2.745   1.938 -12.402
  162   2HD   ARG  23          3HD       ARG  23  -3.166   0.237 -12.340
  163    HE   ARG  23           HE       ARG  23  -4.532   0.390 -14.098
  164   1HH1  ARG  23          2HH2      ARG  23  -3.973   3.654 -12.939
  165   2HH1  ARG  23          1HH2      ARG  23  -5.009   4.437 -14.097
  166   1HH2  ARG  23          2HH1      ARG  23  -5.998   1.355 -15.602
  167   2HH2  ARG  23          1HH1      ARG  23  -6.190   3.075 -15.656
  168    H    ILE  24           H        ILE  24  -2.581  -0.437  -7.559
  169    HA   ILE  24           HA       ILE  24  -4.488   0.166  -5.587
  170    HB   ILE  24           HB       ILE  24  -3.709  -1.522  -4.200
  171   1HG1  ILE  24          2HG1      ILE  24  -1.161  -1.248  -5.691
  172   2HG1  ILE  24          3HG1      ILE  24  -1.458  -1.093  -3.947
  173   1HG2  ILE  24          1HG2      ILE  24  -3.985  -3.303  -5.616
  174   2HG2  ILE  24          2HG2      ILE  24  -4.734  -2.001  -6.532
  175   3HG2  ILE  24          3HG2      ILE  24  -3.107  -2.563  -6.967
  176   1HD1  ILE  24          1HD1      ILE  24  -0.245  -3.141  -4.395
  177   2HD1  ILE  24          2HD1      ILE  24  -1.894  -3.534  -3.841
  178   3HD1  ILE  24          3HD1      ILE  24  -1.467  -3.617  -5.577
  179    H    GLU  25           H        GLU  25  -0.919   0.709  -5.210
  180    HA   GLU  25           HA       GLU  25  -1.066   2.135  -2.825
  181   1HB   GLU  25          2HB       GLU  25   0.835   2.065  -5.150
  182   2HB   GLU  25          3HB       GLU  25   0.987   3.427  -4.028
  183   1HG   GLU  25          2HG       GLU  25   2.438   1.486  -3.431
  184   2HG   GLU  25          3HG       GLU  25   1.347   1.973  -2.139
  185    H    LYS  26           H        LYS  26  -1.625   3.434  -6.122
  186    HA   LYS  26           HA       LYS  26  -1.730   6.142  -5.091
  187   1HB   LYS  26          2HB       LYS  26  -2.445   5.040  -7.776
  188   2HB   LYS  26          3HB       LYS  26  -2.919   6.665  -7.277
  189   1HG   LYS  26          2HG       LYS  26  -0.874   7.003  -8.334
  190   2HG   LYS  26          3HG       LYS  26  -0.495   7.143  -6.612
  191   1HD   LYS  26          2HD       LYS  26   0.331   4.743  -6.658
  192   2HD   LYS  26          3HD       LYS  26  -0.173   4.717  -8.339
  193   1HE   LYS  26          2HE       LYS  26   2.041   5.153  -8.710
  194   2HE   LYS  26          3HE       LYS  26   1.494   6.820  -8.536
  195   1HZ   LYS  26          1HZ       LYS  26   3.424   6.419  -7.210
  196   2HZ   LYS  26          2HZ       LYS  26   2.183   6.638  -6.154
  197   3HZ   LYS  26          3HZ       LYS  26   2.741   5.135  -6.453
  198    H    GLY  27           H        GLY  27  -4.196   3.641  -5.757
  199   1HA   GLY  27          2HA       GLY  27  -6.473   5.284  -5.040
  200   2HA   GLY  27          3HA       GLY  27  -6.425   3.525  -5.154
  201    H    LEU  28           H        LEU  28  -4.062   3.427  -3.247
  202    HA   LEU  28           HA       LEU  28  -5.484   3.356  -0.730
  203   1HB   LEU  28          2HB       LEU  28  -3.294   2.085  -1.697
  204   2HB   LEU  28          3HB       LEU  28  -2.479   3.349  -0.777
  205    HG   LEU  28           HG       LEU  28  -4.640   1.472   0.299
  206   1HD1  LEU  28          1HD1      LEU  28  -2.814   0.209   1.343
  207   2HD1  LEU  28          2HD1      LEU  28  -2.658   0.192  -0.420
  208   3HD1  LEU  28          3HD1      LEU  28  -1.612   1.251   0.547
  209   1HD2  LEU  28          1HD2      LEU  28  -4.313   3.612   1.586
  210   2HD2  LEU  28          2HD2      LEU  28  -3.836   2.188   2.503
  211   3HD2  LEU  28          3HD2      LEU  28  -2.589   3.188   1.715
  212    H    LYS  29           H        LYS  29  -3.059   5.466  -2.222
  213    HA   LYS  29           HA       LYS  29  -2.707   7.435  -0.331
  214   1HB   LYS  29          2HB       LYS  29  -1.932   7.079  -2.930
  215   2HB   LYS  29          3HB       LYS  29  -3.140   8.361  -3.159
  216   1HG   LYS  29          2HG       LYS  29  -1.918   9.558  -1.225
  217   2HG   LYS  29          3HG       LYS  29  -0.703   8.287  -1.432
  218   1HD   LYS  29          2HD       LYS  29   0.262   9.714  -3.005
  219   2HD   LYS  29          3HD       LYS  29  -1.020   9.133  -4.051
  220   1HE   LYS  29          2HE       LYS  29  -0.999  11.535  -4.155
  221   2HE   LYS  29          3HE       LYS  29  -2.461  11.073  -3.260
  222   1HZ   LYS  29          1HZ       LYS  29  -1.190  11.580  -1.209
  223   2HZ   LYS  29          2HZ       LYS  29   0.115  11.937  -2.074
  224   3HZ   LYS  29          3HZ       LYS  29  -1.214  12.902  -2.196
  225    H    ARG  30           H        ARG  30  -5.632   6.814  -2.116
  226    HA   ARG  30           HA       ARG  30  -6.764   9.469  -1.614
  227   1HB   ARG  30          2HB       ARG  30  -7.402   7.080  -3.266
  228   2HB   ARG  30          3HB       ARG  30  -8.825   7.875  -2.625
  229   1HG   ARG  30          2HG       ARG  30  -6.560   9.363  -4.001
  230   2HG   ARG  30          3HG       ARG  30  -7.945   8.715  -4.891
  231   1HD   ARG  30          2HD       ARG  30  -9.440  10.245  -4.061
  232   2HD   ARG  30          3HD       ARG  30  -8.636  10.354  -2.487
  233    HE   ARG  30           HE       ARG  30  -7.008  11.495  -4.577
  234   1HH1  ARG  30          2HH2      ARG  30  -9.820  12.149  -2.561
  235   2HH1  ARG  30          1HH2      ARG  30  -9.568  13.864  -2.458
  236   1HH2  ARG  30          2HH1      ARG  30  -6.617  13.782  -4.460
  237   2HH2  ARG  30          1HH1      ARG  30  -7.702  14.809  -3.584
  238    H    MET  31           H        MET  31  -6.257   6.949   0.491
  239    HA   MET  31           HA       MET  31  -8.918   7.113   1.740
  240   1HB   MET  31          2HB       MET  31  -8.511   5.100   2.556
  241   2HB   MET  31          3HB       MET  31  -7.257   5.017   1.326
  242   1HG   MET  31          2HG       MET  31  -5.550   5.588   2.910
  243   2HG   MET  31          3HG       MET  31  -6.753   5.760   4.192
  244   1HE   MET  31          1HE       MET  31  -8.039   2.217   4.894
  245   2HE   MET  31          2HE       MET  31  -8.089   3.931   5.386
  246   3HE   MET  31          3HE       MET  31  -8.779   3.407   3.837
  247    HA   PRO  32           HA       PRO  32  -7.634   9.918   4.976
  248   1HB   PRO  32          2HB       PRO  32  -8.858   8.908   7.223
  249   2HB   PRO  32          3HB       PRO  32  -9.749   9.738   5.914
  250   1HG   PRO  32          2HG       PRO  32  -9.367   6.758   6.297
  251   2HG   PRO  32          3HG       PRO  32 -10.898   7.630   5.994
  252   1HD   PRO  32          2HD       PRO  32  -9.552   6.436   3.990
  253   2HD   PRO  32          3HD       PRO  32 -10.303   8.031   3.712
  254    H    GLY  33           H        GLY  33  -5.725  10.022   6.133
  255   1HA   GLY  33          2HA       GLY  33  -4.224   9.278   7.769
  256   2HA   GLY  33          3HA       GLY  33  -4.711   7.600   7.532
  257    H    VAL  34           H        VAL  34  -4.444   7.575   4.547
  258    HA   VAL  34           HA       VAL  34  -1.477   7.431   4.531
  259    HB   VAL  34           HB       VAL  34  -3.450   6.471   2.456
  260   1HG1  VAL  34          1HG1      VAL  34  -1.220   7.007   1.521
  261   2HG1  VAL  34          2HG1      VAL  34  -0.443   6.067   2.804
  262   3HG1  VAL  34          3HG1      VAL  34  -1.467   5.264   1.592
  263   1HG2  VAL  34          1HG2      VAL  34  -2.172   5.287   4.944
  264   2HG2  VAL  34          2HG2      VAL  34  -3.801   5.061   4.320
  265   3HG2  VAL  34          3HG2      VAL  34  -2.428   4.247   3.554
  266    H    THR  35           H        THR  35  -0.266   9.052   3.857
  267    HA   THR  35           HA       THR  35  -1.567  11.321   2.516
  268    HB   THR  35           HB       THR  35   1.120  10.980   3.737
  269    HG1  THR  35           1HG      THR  35   0.110  12.262   5.336
  270   1HG2  THR  35          1HG2      THR  35  -0.232  13.435   2.547
  271   2HG2  THR  35          2HG2      THR  35   1.186  13.493   3.616
  272   3HG2  THR  35          3HG2      THR  35   1.311  12.703   2.038
  273    H    ASP  36           H        ASP  36   1.302   9.105   1.950
  274    HA   ASP  36           HA       ASP  36   0.924   9.472  -0.916
  275   1HB   ASP  36          2HB       ASP  36   3.364  10.344   0.607
  276   2HB   ASP  36          3HB       ASP  36   3.492   9.695  -1.027
  277    H    ALA  37           H        ALA  37   2.212   7.829  -2.102
  278    HA   ALA  37           HA       ALA  37   2.900   5.417  -0.640
  279   1HB   ALA  37          1HB       ALA  37   0.401   5.362  -0.516
  280   2HB   ALA  37          2HB       ALA  37   0.338   5.453  -2.288
  281   3HB   ALA  37          3HB       ALA  37   1.050   4.037  -1.483
  282    H    ASN  38           H        ASN  38   4.019   3.871  -1.871
  283    HA   ASN  38           HA       ASN  38   4.580   4.535  -4.698
  284   1HB   ASN  38          2HB       ASN  38   7.129   4.360  -3.490
  285   2HB   ASN  38          3HB       ASN  38   6.380   5.751  -4.250
  286   1HD2  ASN  38          1HD2      ASN  38   5.920   4.135  -1.033
  287   2HD2  ASN  38          2HD2      ASN  38   6.224   5.616  -0.129
  288    H    VAL  39           H        VAL  39   4.321   2.537  -5.527
  289    HA   VAL  39           HA       VAL  39   5.023   0.198  -3.950
  290    HB   VAL  39           HB       VAL  39   3.068   0.335  -5.469
  291   1HG1  VAL  39          1HG1      VAL  39   3.340  -0.029  -7.871
  292   2HG1  VAL  39          2HG1      VAL  39   4.088   1.508  -7.412
  293   3HG1  VAL  39          3HG1      VAL  39   5.093   0.080  -7.742
  294   1HG2  VAL  39          1HG2      VAL  39   4.308  -1.806  -4.679
  295   2HG2  VAL  39          2HG2      VAL  39   3.127  -1.895  -5.978
  296   3HG2  VAL  39          3HG2      VAL  39   4.864  -1.903  -6.368
  297    H    ASN  40           H        ASN  40   6.922  -1.078  -4.235
  298    HA   ASN  40           HA       ASN  40   9.010   0.036  -6.063
  299   1HB   ASN  40          2HB       ASN  40   9.316   0.729  -3.673
  300   2HB   ASN  40          3HB       ASN  40   9.403  -0.981  -3.221
  301   1HD2  ASN  40          1HD2      ASN  40  11.574   0.142  -2.430
  302   2HD2  ASN  40          2HD2      ASN  40  12.908   0.004  -3.564
  303    H    LEU  41           H        LEU  41   7.447  -1.688  -7.052
  304    HA   LEU  41           HA       LEU  41   7.897  -4.424  -6.452
  305   1HB   LEU  41          2HB       LEU  41   6.193  -2.882  -8.140
  306   2HB   LEU  41          3HB       LEU  41   7.039  -3.966  -9.220
  307    HG   LEU  41           HG       LEU  41   4.801  -4.690  -8.319
  308   1HD1  LEU  41          1HD1      LEU  41   6.320  -6.279  -9.400
  309   2HD1  LEU  41          2HD1      LEU  41   7.154  -6.573  -7.862
  310   3HD1  LEU  41          3HD1      LEU  41   5.458  -7.060  -8.063
  311   1HD2  LEU  41          1HD2      LEU  41   5.329  -4.023  -5.883
  312   2HD2  LEU  41          2HD2      LEU  41   4.462  -5.537  -6.194
  313   3HD2  LEU  41          3HD2      LEU  41   6.171  -5.578  -5.770
  314    H    ALA  42           H        ALA  42   9.766  -2.157  -8.231
  315    HA   ALA  42           HA       ALA  42  11.488  -3.686  -9.800
  316   1HB   ALA  42          1HB       ALA  42  13.220  -2.077  -9.143
  317   2HB   ALA  42          2HB       ALA  42  11.685  -1.227  -9.448
  318   3HB   ALA  42          3HB       ALA  42  12.232  -1.535  -7.778
  319    H    THR  43           H        THR  43  11.273  -3.513  -6.216
  320    HA   THR  43           HA       THR  43  12.992  -5.928  -6.133
  321    HB   THR  43           HB       THR  43  14.364  -4.078  -5.440
  322    HG1  THR  43           1HG      THR  43  14.283  -6.210  -4.267
  323   1HG2  THR  43          1HG2      THR  43  12.698  -2.493  -4.620
  324   2HG2  THR  43          2HG2      THR  43  12.323  -3.551  -3.241
  325   3HG2  THR  43          3HG2      THR  43  13.924  -2.805  -3.381
  326    H    GLU  44           H        GLU  44  10.251  -5.833  -6.506
  327    HA   GLU  44           HA       GLU  44   8.299  -6.692  -5.772
  328   1HB   GLU  44          2HB       GLU  44  10.371  -8.392  -4.329
  329   2HB   GLU  44          3HB       GLU  44   8.671  -8.844  -4.515
  330   1HG   GLU  44          2HG       GLU  44   8.824  -8.798  -6.942
  331   2HG   GLU  44          3HG       GLU  44  10.501  -8.231  -6.871
  332    H    THR  45           H        THR  45   9.210  -4.360  -4.034
  333    HA   THR  45           HA       THR  45   7.902  -5.083  -1.451
  334    HB   THR  45           HB       THR  45  10.063  -3.046  -2.162
  335    HG1  THR  45           1HG      THR  45  10.718  -5.296  -2.119
  336   1HG2  THR  45          1HG2      THR  45   8.800  -2.253  -0.217
  337   2HG2  THR  45          2HG2      THR  45   8.927  -3.872   0.530
  338   3HG2  THR  45          3HG2      THR  45  10.373  -2.877   0.289
  339    H    VAL  46           H        VAL  46   6.676  -3.246  -0.479
  340    HA   VAL  46           HA       VAL  46   5.905  -1.061  -2.347
  341    HB   VAL  46           HB       VAL  46   3.970  -2.453  -2.347
  342   1HG1  VAL  46          1HG1      VAL  46   2.827  -3.190  -0.255
  343   2HG1  VAL  46          2HG1      VAL  46   4.391  -3.968  -0.483
  344   3HG1  VAL  46          3HG1      VAL  46   4.230  -2.618   0.669
  345   1HG2  VAL  46          1HG2      VAL  46   2.296  -1.107  -1.230
  346   2HG2  VAL  46          2HG2      VAL  46   3.493  -0.335  -0.197
  347   3HG2  VAL  46          3HG2      VAL  46   3.528  -0.042  -1.952
  348    H    ASN  47           H        ASN  47   5.726   1.024  -1.335
  349    HA   ASN  47           HA       ASN  47   6.353   1.068   1.555
  350   1HB   ASN  47          2HB       ASN  47   7.616   2.671  -0.703
  351   2HB   ASN  47          3HB       ASN  47   7.466   3.347   0.924
  352   1HD2  ASN  47          1HD2      ASN  47   8.207   1.728   2.764
  353   2HD2  ASN  47          2HD2      ASN  47   9.843   1.171   2.459
  354    H    VAL  48           H        VAL  48   5.060   2.533   2.693
  355    HA   VAL  48           HA       VAL  48   3.049   4.033   1.126
  356    HB   VAL  48           HB       VAL  48   2.082   1.860   1.467
  357   1HG1  VAL  48          1HG1      VAL  48   2.654   2.181   4.431
  358   2HG1  VAL  48          2HG1      VAL  48   1.584   0.962   3.716
  359   3HG1  VAL  48          3HG1      VAL  48   3.307   0.964   3.329
  360   1HG2  VAL  48          1HG2      VAL  48   0.041   2.552   2.722
  361   2HG2  VAL  48          2HG2      VAL  48   0.879   4.047   3.187
  362   3HG2  VAL  48          3HG2      VAL  48   0.581   3.695   1.483
  363    H    ILE  49           H        ILE  49   2.859   6.024   1.921
  364    HA   ILE  49           HA       ILE  49   4.514   6.655   4.267
  365    HB   ILE  49           HB       ILE  49   3.607   8.543   2.071
  366   1HG1  ILE  49          2HG1      ILE  49   4.822   6.886   0.870
  367   2HG1  ILE  49          3HG1      ILE  49   5.812   8.329   1.047
  368   1HG2  ILE  49          1HG2      ILE  49   4.297   9.659   4.086
  369   2HG2  ILE  49          2HG2      ILE  49   5.793   8.721   4.166
  370   3HG2  ILE  49          3HG2      ILE  49   5.536   9.879   2.844
  371   1HD1  ILE  49          1HD1      ILE  49   7.244   6.437   1.417
  372   2HD1  ILE  49          2HD1      ILE  49   6.993   7.212   2.981
  373   3HD1  ILE  49          3HD1      ILE  49   6.119   5.717   2.580
  374    H    TYR  50           H        TYR  50   3.052   6.600   6.000
  375    HA   TYR  50           HA       TYR  50   0.470   8.092   5.691
  376   1HB   TYR  50          2HB       TYR  50  -0.754   6.344   6.682
  377   2HB   TYR  50          3HB       TYR  50   0.027   5.779   5.239
  378    HD1  TYR  50           HD1      TYR  50   1.239   3.729   5.303
  379    HD2  TYR  50           HD2      TYR  50   0.201   5.681   8.975
  380    HE1  TYR  50           HE1      TYR  50   1.631   1.615   6.545
  381    HE2  TYR  50           HE2      TYR  50   0.824   3.654  10.239
  382    HH   TYR  50           HH       TYR  50   1.642   1.493  10.087
  383    H    ASP  51           H        ASP  51  -0.635   8.453   7.655
  384    HA   ASP  51           HA       ASP  51   1.215   9.400   9.757
  385   1HB   ASP  51          2HB       ASP  51  -0.501  10.926   9.165
  386   2HB   ASP  51          3HB       ASP  51  -1.756   9.703   9.383
  387    HA   PRO  52           HA       PRO  52   0.372   5.374  11.658
  388   1HB   PRO  52          2HB       PRO  52   2.365   5.237  13.470
  389   2HB   PRO  52          3HB       PRO  52   2.679   5.149  11.713
  390   1HG   PRO  52          2HG       PRO  52   2.831   7.619  13.481
  391   2HG   PRO  52          3HG       PRO  52   4.096   6.996  12.379
  392   1HD   PRO  52          2HD       PRO  52   2.342   8.943  11.625
  393   2HD   PRO  52          3HD       PRO  52   2.892   7.683  10.477
  394    H    ALA  53           H        ALA  53  -0.423   8.443  12.859
  395    HA   ALA  53           HA       ALA  53  -1.346   7.445  15.487
  396   1HB   ALA  53          1HB       ALA  53  -2.239   9.690  15.697
  397   2HB   ALA  53          2HB       ALA  53  -0.542   9.806  15.175
  398   3HB   ALA  53          3HB       ALA  53  -1.859  10.049  14.002
  399    H    GLU  54           H        GLU  54  -2.267   7.786  12.100
  400    HA   GLU  54           HA       GLU  54  -5.125   7.657  12.778
  401   1HB   GLU  54          2HB       GLU  54  -3.921   9.514  11.363
  402   2HB   GLU  54          3HB       GLU  54  -4.042   8.363  10.036
  403   1HG   GLU  54          2HG       GLU  54  -6.414   9.292  11.738
  404   2HG   GLU  54          3HG       GLU  54  -5.871  10.127  10.284
  405    H    THR  55           H        THR  55  -2.795   6.475  10.375
  406    HA   THR  55           HA       THR  55  -4.063   3.818  10.324
  407    HB   THR  55           HB       THR  55  -2.231   3.577   8.305
  408    HG1  THR  55           1HG      THR  55  -3.158   6.220   8.248
  409   1HG2  THR  55          1HG2      THR  55  -4.166   4.175   6.839
  410   2HG2  THR  55          2HG2      THR  55  -4.543   3.071   8.185
  411   3HG2  THR  55          3HG2      THR  55  -5.044   4.790   8.270
  412    H    GLY  56           H        GLY  56  -2.062   2.254   9.747
  413   1HA   GLY  56          2HA       GLY  56  -0.337   1.358  11.595
  414   2HA   GLY  56          3HA       GLY  56  -1.756   1.771  12.589
  415    H    THR  57           H        THR  57  -0.637   0.000  10.080
  416    HA   THR  57           HA       THR  57  -1.398  -0.785   8.201
  417    HB   THR  57           HB       THR  57  -1.008  -3.251   8.401
  418    HG1  THR  57           1HG      THR  57  -2.003  -3.598  10.427
  419   1HG2  THR  57          1HG2      THR  57   0.906  -1.607   8.370
  420   2HG2  THR  57          2HG2      THR  57   0.895  -1.612  10.146
  421   3HG2  THR  57          3HG2      THR  57   1.253  -3.102   9.264
  422    H    ALA  58           H        ALA  58  -3.635  -1.511  10.719
  423    HA   ALA  58           HA       ALA  58  -5.722  -2.956   9.816
  424   1HB   ALA  58          1HB       ALA  58  -5.692  -0.107  10.878
  425   2HB   ALA  58          2HB       ALA  58  -7.063  -1.240  11.014
  426   3HB   ALA  58          3HB       ALA  58  -5.522  -1.553  11.867
  427    H    ALA  59           H        ALA  59  -5.078   0.418   8.756
  428    HA   ALA  59           HA       ALA  59  -7.581   0.184   7.189
  429   1HB   ALA  59          1HB       ALA  59  -6.095   2.651   6.729
  430   2HB   ALA  59          2HB       ALA  59  -7.783   2.357   7.147
  431   3HB   ALA  59          3HB       ALA  59  -6.597   2.347   8.432
  432    H    ILE  60           H        ILE  60  -4.140   0.071   6.689
  433    HA   ILE  60           HA       ILE  60  -4.124   0.232   3.834
  434    HB   ILE  60           HB       ILE  60  -2.192  -0.619   5.994
  435   1HG1  ILE  60          2HG1      ILE  60  -0.758   0.936   4.617
  436   2HG1  ILE  60          3HG1      ILE  60  -2.148   1.153   3.539
  437   1HG2  ILE  60          1HG2      ILE  60  -1.847  -2.462   4.449
  438   2HG2  ILE  60          2HG2      ILE  60  -1.772  -1.333   3.073
  439   3HG2  ILE  60          3HG2      ILE  60  -0.525  -1.307   4.338
  440   1HD1  ILE  60          1HD1      ILE  60  -3.364   2.304   5.327
  441   2HD1  ILE  60          2HD1      ILE  60  -2.202   1.733   6.554
  442   3HD1  ILE  60          3HD1      ILE  60  -1.709   2.945   5.367
  443    H    GLN  61           H        GLN  61  -4.275  -2.587   6.091
  444    HA   GLN  61           HA       GLN  61  -4.328  -4.507   3.977
  445   1HB   GLN  61          2HB       GLN  61  -4.763  -4.514   6.873
  446   2HB   GLN  61          3HB       GLN  61  -5.919  -5.536   6.002
  447   1HG   GLN  61          2HG       GLN  61  -4.352  -7.084   6.370
  448   2HG   GLN  61          3HG       GLN  61  -3.824  -6.534   4.783
  449   1HE2  GLN  61          1HE2      GLN  61  -2.456  -4.163   5.410
  450   2HE2  GLN  61          2HE2      GLN  61  -1.074  -4.576   6.416
  451    H    GLU  62           H        GLU  62  -7.004  -2.906   5.803
  452    HA   GLU  62           HA       GLU  62  -9.236  -3.911   4.489
  453   1HB   GLU  62          2HB       GLU  62  -8.500  -1.310   5.795
  454   2HB   GLU  62          3HB       GLU  62  -9.936  -1.284   4.780
  455   1HG   GLU  62          2HG       GLU  62  -9.516  -3.330   6.993
  456   2HG   GLU  62          3HG       GLU  62 -10.338  -1.779   7.225
  457    H    LYS  63           H        LYS  63  -7.399  -0.969   3.431
  458    HA   LYS  63           HA       LYS  63  -8.929  -0.805   1.038
  459   1HB   LYS  63          2HB       LYS  63  -6.613   0.598   2.276
  460   2HB   LYS  63          3HB       LYS  63  -6.705   0.651   0.540
  461   1HG   LYS  63          2HG       LYS  63  -9.079   1.286   2.337
  462   2HG   LYS  63          3HG       LYS  63  -7.914   2.510   1.825
  463   1HD   LYS  63          2HD       LYS  63  -9.493   0.917  -0.225
  464   2HD   LYS  63          3HD       LYS  63 -10.057   2.430   0.510
  465   1HE   LYS  63          2HE       LYS  63  -7.888   3.530  -0.191
  466   2HE   LYS  63          3HE       LYS  63  -7.460   2.049  -1.051
  467   1HZ   LYS  63          1HZ       LYS  63  -9.291   2.412  -2.499
  468   2HZ   LYS  63          2HZ       LYS  63  -9.819   3.711  -1.614
  469   3HZ   LYS  63          3HZ       LYS  63  -8.367   3.787  -2.385
  470    H    ILE  64           H        ILE  64  -5.878  -2.518   1.784
  471    HA   ILE  64           HA       ILE  64  -4.899  -2.939  -0.778
  472    HB   ILE  64           HB       ILE  64  -4.697  -4.149   1.889
  473   1HG1  ILE  64          2HG1      ILE  64  -3.245  -2.337   0.916
  474   2HG1  ILE  64          3HG1      ILE  64  -2.441  -3.729   1.636
  475   1HG2  ILE  64          1HG2      ILE  64  -4.060  -5.843  -0.482
  476   2HG2  ILE  64          2HG2      ILE  64  -3.317  -6.031   1.128
  477   3HG2  ILE  64          3HG2      ILE  64  -5.060  -6.208   0.945
  478   1HD1  ILE  64          1HD1      ILE  64  -2.139  -4.716  -0.628
  479   2HD1  ILE  64          2HD1      ILE  64  -2.838  -3.259  -1.342
  480   3HD1  ILE  64          3HD1      ILE  64  -1.327  -3.154  -0.407
  481    H    GLU  65           H        GLU  65  -7.151  -4.867   1.294
  482    HA   GLU  65           HA       GLU  65  -7.972  -6.809  -0.600
  483   1HB   GLU  65          2HB       GLU  65  -9.339  -5.594   1.843
  484   2HB   GLU  65          3HB       GLU  65 -10.033  -6.928   0.924
  485   1HG   GLU  65          2HG       GLU  65  -7.227  -7.099   2.043
  486   2HG   GLU  65          3HG       GLU  65  -8.648  -7.495   3.013
  487    H    LYS  66           H        LYS  66  -9.606  -3.727   0.348
  488    HA   LYS  66           HA       LYS  66 -11.675  -4.039  -1.524
  489   1HB   LYS  66          2HB       LYS  66 -10.736  -1.918   0.269
  490   2HB   LYS  66          3HB       LYS  66 -11.393  -1.229  -1.215
  491   1HG   LYS  66          2HG       LYS  66 -12.820  -3.363   0.413
  492   2HG   LYS  66          3HG       LYS  66 -13.042  -1.635   0.703
  493   1HD   LYS  66          2HD       LYS  66 -13.944  -1.232  -1.470
  494   2HD   LYS  66          3HD       LYS  66 -13.439  -2.810  -2.087
  495   1HE   LYS  66          2HE       LYS  66 -14.997  -3.948  -0.519
  496   2HE   LYS  66          3HE       LYS  66 -15.549  -2.374   0.080
  497   1HZ   LYS  66          1HZ       LYS  66 -16.350  -1.890  -2.132
  498   2HZ   LYS  66          2HZ       LYS  66 -15.798  -3.335  -2.700
  499   3HZ   LYS  66          3HZ       LYS  66 -17.009  -3.295  -1.590
  500    H    LEU  67           H        LEU  67  -8.485  -2.681  -2.070
  501    HA   LEU  67           HA       LEU  67  -9.020  -1.667  -4.734
  502   1HB   LEU  67          2HB       LEU  67  -6.493  -2.316  -3.203
  503   2HB   LEU  67          3HB       LEU  67  -6.483  -1.664  -4.842
  504    HG   LEU  67           HG       LEU  67  -8.006  -0.221  -2.636
  505   1HD1  LEU  67          1HD1      LEU  67  -5.748  -0.462  -1.765
  506   2HD1  LEU  67          2HD1      LEU  67  -5.066  -0.038  -3.330
  507   3HD1  LEU  67          3HD1      LEU  67  -5.916   1.188  -2.394
  508   1HD2  LEU  67          1HD2      LEU  67  -8.430   0.481  -4.989
  509   2HD2  LEU  67          2HD2      LEU  67  -7.602   1.734  -4.056
  510   3HD2  LEU  67          3HD2      LEU  67  -6.691   0.749  -5.211
  511    H    GLY  68           H        GLY  68  -8.562  -4.830  -3.390
  512   1HA   GLY  68          2HA       GLY  68  -9.065  -6.774  -4.518
  513   2HA   GLY  68          3HA       GLY  68  -8.729  -6.016  -6.078
  514    H    TYR  69           H        TYR  69  -6.626  -6.073  -3.114
  515    HA   TYR  69           HA       TYR  69  -4.639  -7.741  -4.601
  516   1HB   TYR  69          2HB       TYR  69  -4.568  -4.914  -3.998
  517   2HB   TYR  69          3HB       TYR  69  -3.360  -5.707  -3.015
  518    HD1  TYR  69           HD1      TYR  69  -4.686  -5.550  -6.518
  519    HD2  TYR  69           HD2      TYR  69  -1.304  -6.428  -3.992
  520    HE1  TYR  69           HE1      TYR  69  -3.205  -5.398  -8.458
  521    HE2  TYR  69           HE2      TYR  69   0.182  -6.174  -5.920
  522    HH   TYR  69           HH       TYR  69   0.361  -5.709  -8.204
  523    H    HIS  70           H        HIS  70  -2.747  -8.236  -3.054
  524    HA   HIS  70           HA       HIS  70  -3.577  -8.401  -0.235
  525   1HB   HIS  70          2HB       HIS  70  -3.015 -10.695  -2.025
  526   2HB   HIS  70          3HB       HIS  70  -1.967 -10.661  -0.615
  527    HD1  HIS  70           1HD      HIS  70  -4.404  -9.527   1.407
  528    HD2  HIS  70           2HD      HIS  70  -4.178 -12.926  -1.069
  529    HE1  HIS  70           1HE      HIS  70  -5.794 -11.332   2.518
  530    H    VAL  71           H        VAL  71  -1.906  -8.276   1.226
  531    HA   VAL  71           HA       VAL  71   0.754  -7.513   0.213
  532    HB   VAL  71           HB       VAL  71  -0.776  -5.531   0.847
  533   1HG1  VAL  71          1HG1      VAL  71  -1.741  -6.531   2.930
  534   2HG1  VAL  71          2HG1      VAL  71  -0.139  -6.408   3.691
  535   3HG1  VAL  71          3HG1      VAL  71  -0.992  -4.945   3.183
  536   1HG2  VAL  71          1HG2      VAL  71   1.607  -5.288   0.548
  537   2HG2  VAL  71          2HG2      VAL  71   1.022  -4.278   1.871
  538   3HG2  VAL  71          3HG2      VAL  71   1.890  -5.789   2.234
  539    H    VAL  72           H        VAL  72   2.402  -8.025   1.807
  540    HA   VAL  72           HA       VAL  72   1.612  -9.973   3.911
  541    HB   VAL  72           HB       VAL  72   3.961 -10.294   2.112
  542   1HG1  VAL  72          1HG1      VAL  72   3.958 -12.608   3.007
  543   2HG1  VAL  72          2HG1      VAL  72   4.109 -11.426   4.309
  544   3HG1  VAL  72          3HG1      VAL  72   2.546 -12.216   4.008
  545   1HG2  VAL  72          1HG2      VAL  72   2.675 -12.170   1.016
  546   2HG2  VAL  72          2HG2      VAL  72   1.215 -11.590   1.845
  547   3HG2  VAL  72          3HG2      VAL  72   2.035 -10.570   0.639
  548    H    ILE  73           H        ILE  73   2.896  -9.788   5.762
  549    HA   ILE  73           HA       ILE  73   4.664  -7.382   5.859
  550    HB   ILE  73           HB       ILE  73   2.865  -8.443   8.053
  551   1HG1  ILE  73          2HG1      ILE  73   2.043  -5.949   7.765
  552   2HG1  ILE  73          3HG1      ILE  73   2.755  -6.090   6.163
  553   1HG2  ILE  73          1HG2      ILE  73   4.997  -7.422   8.872
  554   2HG2  ILE  73          2HG2      ILE  73   4.659  -5.982   7.893
  555   3HG2  ILE  73          3HG2      ILE  73   3.580  -6.428   9.233
  556   1HD1  ILE  73          1HD1      ILE  73   1.190  -7.931   5.673
  557   2HD1  ILE  73          2HD1      ILE  73   0.617  -7.849   7.367
  558   3HD1  ILE  73          3HD1      ILE  73   0.346  -6.484   6.247
  559    H    GLU  74           H        GLU  74   6.394  -8.859   5.127
  560    HA   GLU  74           HA       GLU  74   7.380 -10.801   6.875
  561   1HB   GLU  74          2HB       GLU  74   8.386  -9.394   4.401
  562   2HB   GLU  74          3HB       GLU  74   9.393 -10.534   5.287
  563   1HG   GLU  74          2HG       GLU  74   6.624 -11.313   4.286
  564   2HG   GLU  74          3HG       GLU  74   8.099 -11.525   3.330
  565    H    GLY  75           H        GLY  75   7.255  -7.658   7.315
  566   1HA   GLY  75          2HA       GLY  75   9.622  -7.519   9.148
  567   2HA   GLY  75          3HA       GLY  75   9.211  -6.160   8.080
  568    H    ARG  76           H        ARG  76   7.514  -8.460  10.219
  569    HA   ARG  76           HA       ARG  76   5.478  -6.500  10.886
  570   1HB   ARG  76          2HB       ARG  76   5.395  -9.217  10.640
  571   2HB   ARG  76          3HB       ARG  76   5.713  -9.090  12.377
  572   1HG   ARG  76          2HG       ARG  76   3.755  -7.234  12.162
  573   2HG   ARG  76          3HG       ARG  76   3.343  -8.202  10.745
  574   1HD   ARG  76          2HD       ARG  76   3.309 -10.245  12.195
  575   2HD   ARG  76          3HD       ARG  76   3.575  -9.230  13.617
  576    HE   ARG  76           HE       ARG  76   1.116  -9.685  12.184
  577   1HH1  ARG  76          2HH2      ARG  76   2.843  -7.169  13.965
  578   2HH1  ARG  76          1HH2      ARG  76   1.434  -6.231  14.344
  579   1HH2  ARG  76          2HH1      ARG  76  -0.775  -8.435  12.600
  580   2HH2  ARG  76          1HH1      ARG  76  -0.684  -6.978  13.532
  Start of MODEL    3
    1   1H    MET   1          H1        MET   1   1.089  18.258  18.805
    2   2H    MET   1          H2        MET   1   2.691  18.715  18.945
    3   3H    MET   1          H3        MET   1   1.551  19.723  18.265
    4    HA   MET   1           HA       MET   1   2.648  18.833  16.446
    5   1HB   MET   1          2HB       MET   1   2.969  16.579  18.237
    6   2HB   MET   1          3HB       MET   1   2.147  15.993  16.794
    7   1HG   MET   1          2HG       MET   1   3.925  16.829  15.367
    8   2HG   MET   1          3HG       MET   1   4.715  17.629  16.743
    9   1HE   MET   1          1HE       MET   1   6.194  15.653  14.669
   10   2HE   MET   1          2HE       MET   1   6.992  16.532  16.001
   11   3HE   MET   1          3HE       MET   1   7.221  14.776  15.824
   12    H    LEU   2           H        LEU   2   1.458  17.701  14.584
   13    HA   LEU   2           HA       LEU   2  -1.508  17.698  15.038
   14   1HB   LEU   2          2HB       LEU   2   0.196  18.398  12.619
   15   2HB   LEU   2          3HB       LEU   2  -1.540  18.091  12.513
   16    HG   LEU   2           HG       LEU   2  -0.438  20.177  14.435
   17   1HD1  LEU   2          1HD1      LEU   2  -0.810  21.873  12.676
   18   2HD1  LEU   2          2HD1      LEU   2   0.474  20.737  12.230
   19   3HD1  LEU   2          3HD1      LEU   2  -1.138  20.582  11.499
   20   1HD2  LEU   2          1HD2      LEU   2  -3.107  19.898  12.972
   21   2HD2  LEU   2          2HD2      LEU   2  -2.835  19.505  14.681
   22   3HD2  LEU   2          3HD2      LEU   2  -2.676  21.175  14.123
   23    H    SER   3           H        SER   3   0.702  16.377  12.552
   24    HA   SER   3           HA       SER   3  -0.022  13.585  13.239
   25   1HB   SER   3          2HB       SER   3  -0.282  15.030  10.555
   26   2HB   SER   3          3HB       SER   3  -0.093  13.278  10.674
   27    HG   SER   3           HG       SER   3  -1.963  13.071  11.655
   28    H    GLU   4           H        GLU   4   1.790  12.236  12.952
   29    HA   GLU   4           HA       GLU   4   4.306  13.410  11.931
   30   1HB   GLU   4          2HB       GLU   4   3.574  11.116  13.675
   31   2HB   GLU   4          3HB       GLU   4   5.004  10.987  12.688
   32   1HG   GLU   4          2HG       GLU   4   5.733  13.165  13.647
   33   2HG   GLU   4          3HG       GLU   4   4.389  13.011  14.780
   34    H    GLN   5           H        GLN   5   5.454  11.523  10.582
   35    HA   GLN   5           HA       GLN   5   3.564  10.017   8.883
   36   1HB   GLN   5          2HB       GLN   5   5.997  11.659   8.115
   37   2HB   GLN   5          3HB       GLN   5   5.272  10.525   6.999
   38   1HG   GLN   5          2HG       GLN   5   3.776  12.898   8.269
   39   2HG   GLN   5          3HG       GLN   5   4.657  12.974   6.769
   40   1HE2  GLN   5          1HE2      GLN   5   3.431   9.865   6.629
   41   2HE2  GLN   5          2HE2      GLN   5   1.939  10.232   5.808
   42    H    LYS   6           H        LYS   6   4.443   7.962   8.375
   43    HA   LYS   6           HA       LYS   6   7.304   7.550   8.751
   44   1HB   LYS   6          2HB       LYS   6   5.304   5.643  10.020
   45   2HB   LYS   6          3HB       LYS   6   7.047   5.385   9.851
   46   1HG   LYS   6          2HG       LYS   6   7.370   7.586  11.162
   47   2HG   LYS   6          3HG       LYS   6   5.643   7.524  11.502
   48   1HD   LYS   6          2HD       LYS   6   6.555   6.544  13.389
   49   2HD   LYS   6          3HD       LYS   6   6.133   5.117  12.415
   50   1HE   LYS   6          2HE       LYS   6   8.536   5.073  11.573
   51   2HE   LYS   6          3HE       LYS   6   8.884   6.481  12.587
   52   1HZ   LYS   6          1HZ       LYS   6   8.066   3.828  13.558
   53   2HZ   LYS   6          2HZ       LYS   6   9.572   4.487  13.646
   54   3HZ   LYS   6          3HZ       LYS   6   8.338   5.149  14.510
   55    H    GLU   7           H        GLU   7   8.096   5.806   7.576
   56    HA   GLU   7           HA       GLU   7   6.599   5.269   5.090
   57   1HB   GLU   7          2HB       GLU   7   9.609   5.169   5.453
   58   2HB   GLU   7          3HB       GLU   7   8.615   5.410   4.018
   59   1HG   GLU   7          2HG       GLU   7   9.721   7.467   4.534
   60   2HG   GLU   7          3HG       GLU   7   8.038   7.721   5.016
   61    H    ILE   8           H        ILE   8   5.661   3.256   5.697
   62    HA   ILE   8           HA       ILE   8   7.344   1.277   7.055
   63    HB   ILE   8           HB       ILE   8   4.522   1.168   6.120
   64   1HG1  ILE   8          2HG1      ILE   8   3.921   1.306   8.567
   65   2HG1  ILE   8          3HG1      ILE   8   5.620   1.549   8.983
   66   1HG2  ILE   8          1HG2      ILE   8   4.381  -0.641   7.772
   67   2HG2  ILE   8          2HG2      ILE   8   5.463  -1.000   6.413
   68   3HG2  ILE   8          3HG2      ILE   8   6.154  -0.470   7.987
   69   1HD1  ILE   8          1HD1      ILE   8   5.600   3.717   8.183
   70   2HD1  ILE   8          2HD1      ILE   8   4.136   3.441   7.186
   71   3HD1  ILE   8          3HD1      ILE   8   4.020   3.538   8.965
   72    H    ALA   9           H        ALA   9   7.432  -0.880   5.988
   73    HA   ALA   9           HA       ALA   9   7.557  -0.827   3.019
   74   1HB   ALA   9          1HB       ALA   9   9.879  -0.534   3.911
   75   2HB   ALA   9          2HB       ALA   9   9.683  -2.025   4.847
   76   3HB   ALA   9          3HB       ALA   9   9.647  -2.082   3.072
   77    H    MET  10           H        MET  10   6.338  -2.545   2.273
   78    HA   MET  10           HA       MET  10   6.199  -5.018   3.921
   79   1HB   MET  10          2HB       MET  10   3.762  -3.778   2.581
   80   2HB   MET  10          3HB       MET  10   3.857  -5.283   3.501
   81   1HG   MET  10          2HG       MET  10   3.064  -4.027   5.170
   82   2HG   MET  10          3HG       MET  10   4.755  -3.654   5.423
   83   1HE   MET  10          1HE       MET  10   1.242  -2.581   4.404
   84   2HE   MET  10          2HE       MET  10   1.422  -0.933   3.775
   85   3HE   MET  10          3HE       MET  10   1.986  -2.296   2.806
   86    H    GLN  11           H        GLN  11   5.178  -6.794   2.484
   87    HA   GLN  11           HA       GLN  11   6.568  -6.709  -0.148
   88   1HB   GLN  11          2HB       GLN  11   5.867  -8.875   1.880
   89   2HB   GLN  11          3HB       GLN  11   5.995  -9.314   0.182
   90   1HG   GLN  11          2HG       GLN  11   8.177  -7.972   1.850
   91   2HG   GLN  11          3HG       GLN  11   8.140  -9.676   1.342
   92   1HE2  GLN  11          1HE2      GLN  11   7.538  -9.819  -1.192
   93   2HE2  GLN  11          2HE2      GLN  11   8.252  -8.584  -2.209
   94    H    VAL  12           H        VAL  12   5.477  -7.334  -2.035
   95    HA   VAL  12           HA       VAL  12   2.507  -7.029  -1.838
   96    HB   VAL  12           HB       VAL  12   4.387  -6.716  -4.214
   97   1HG1  VAL  12          1HG1      VAL  12   1.383  -6.257  -3.916
   98   2HG1  VAL  12          2HG1      VAL  12   2.354  -5.704  -5.293
   99   3HG1  VAL  12          3HG1      VAL  12   2.179  -7.431  -4.993
  100   1HG2  VAL  12          1HG2      VAL  12   3.665  -4.282  -3.942
  101   2HG2  VAL  12          2HG2      VAL  12   2.937  -4.739  -2.399
  102   3HG2  VAL  12          3HG2      VAL  12   4.695  -4.890  -2.642
  103    H    SER  13           H        SER  13   1.139  -8.540  -2.932
  104    HA   SER  13           HA       SER  13   2.371 -10.866  -4.191
  105   1HB   SER  13          2HB       SER  13   2.014 -11.492  -1.749
  106   2HB   SER  13          3HB       SER  13   0.276 -11.214  -2.006
  107    HG   SER  13           HG       SER  13   1.987 -13.168  -3.134
  108    H    GLY  14           H        GLY  14   0.340 -12.232  -4.932
  109   1HA   GLY  14          2HA       GLY  14  -1.222 -12.308  -6.651
  110   2HA   GLY  14          3HA       GLY  14  -2.098 -11.141  -5.644
  111    H    MET  15           H        MET  15   0.819 -11.101  -7.799
  112    HA   MET  15           HA       MET  15  -0.359  -8.881  -9.352
  113   1HB   MET  15          2HB       MET  15   1.603  -7.525  -9.156
  114   2HB   MET  15          3HB       MET  15   1.046  -7.926  -7.522
  115   1HG   MET  15          2HG       MET  15   3.290  -8.271  -7.247
  116   2HG   MET  15          3HG       MET  15   2.823  -9.892  -7.738
  117   1HE   MET  15          1HE       MET  15   6.280  -9.803  -9.386
  118   2HE   MET  15          2HE       MET  15   5.741  -9.389  -7.742
  119   3HE   MET  15          3HE       MET  15   5.056 -10.805  -8.575
  120    H    THR  16           H        THR  16  -0.072  -9.240 -11.477
  121    HA   THR  16           HA       THR  16   2.539 -10.329 -12.381
  122    HB   THR  16           HB       THR  16   0.969 -11.487 -14.247
  123    HG1  THR  16           1HG      THR  16  -0.777 -12.473 -13.078
  124   1HG2  THR  16          1HG2      THR  16   1.289 -13.612 -13.129
  125   2HG2  THR  16          2HG2      THR  16   2.728 -12.612 -12.889
  126   3HG2  THR  16          3HG2      THR  16   1.558 -12.819 -11.569
  127    H    CYS  17           H        CYS  17   0.683  -7.703 -12.422
  128    HA   CYS  17           HA       CYS  17   0.873  -7.098 -15.303
  129   1HB   CYS  17          2HB       CYS  17  -0.498  -5.538 -13.092
  130   2HB   CYS  17          3HB       CYS  17  -0.817  -5.487 -14.830
  131    H    ALA  18           H        ALA  18   2.374  -6.339 -12.274
  132    HA   ALA  18           HA       ALA  18   3.723  -4.764 -11.461
  133   1HB   ALA  18          1HB       ALA  18   4.245  -3.821 -14.315
  134   2HB   ALA  18          2HB       ALA  18   5.181  -3.445 -12.861
  135   3HB   ALA  18          3HB       ALA  18   5.116  -5.111 -13.465
  136    H    ALA  19           H        ALA  19   2.095  -3.118 -14.182
  137    HA   ALA  19           HA       ALA  19   1.838  -0.576 -13.168
  138   1HB   ALA  19          1HB       ALA  19  -0.078  -0.325 -14.716
  139   2HB   ALA  19          2HB       ALA  19   1.255  -1.228 -15.463
  140   3HB   ALA  19          3HB       ALA  19  -0.183  -2.091 -14.879
  141    H    CYS  20           H        CYS  20  -0.604  -3.176 -12.732
  142    HA   CYS  20           HA       CYS  20  -2.484  -1.764 -11.295
  143   1HB   CYS  20          2HB       CYS  20  -1.591  -4.691 -11.104
  144   2HB   CYS  20          3HB       CYS  20  -3.091  -4.122 -10.395
  145    H    ALA  21           H        ALA  21   0.567  -3.044 -10.032
  146    HA   ALA  21           HA       ALA  21  -0.178  -2.840  -7.274
  147   1HB   ALA  21          1HB       ALA  21   2.099  -3.273  -6.824
  148   2HB   ALA  21          2HB       ALA  21   1.713  -4.188  -8.277
  149   3HB   ALA  21          3HB       ALA  21   2.621  -2.667  -8.421
  150    H    ALA  22           H        ALA  22   0.668  -0.441  -9.694
  151    HA   ALA  22           HA       ALA  22   1.363   1.688  -7.815
  152   1HB   ALA  22          1HB       ALA  22   1.170   3.124  -9.757
  153   2HB   ALA  22          2HB       ALA  22   2.055   1.658 -10.240
  154   3HB   ALA  22          3HB       ALA  22   0.344   1.859 -10.684
  155    H    ARG  23           H        ARG  23  -1.473   0.674  -9.736
  156    HA   ARG  23           HA       ARG  23  -3.236   2.773  -9.053
  157   1HB   ARG  23          2HB       ARG  23  -3.704  -0.131  -9.793
  158   2HB   ARG  23          3HB       ARG  23  -5.037   0.984  -9.503
  159   1HG   ARG  23          2HG       ARG  23  -4.694   2.209 -11.379
  160   2HG   ARG  23          3HG       ARG  23  -2.943   2.001 -11.380
  161   1HD   ARG  23          2HD       ARG  23  -2.964   0.104 -12.598
  162   2HD   ARG  23          3HD       ARG  23  -4.435  -0.540 -11.900
  163    HE   ARG  23           HE       ARG  23  -4.138   1.128 -14.274
  164   1HH1  ARG  23          2HH2      ARG  23  -6.377   0.097 -11.765
  165   2HH1  ARG  23          1HH2      ARG  23  -7.811   0.225 -12.734
  166   1HH2  ARG  23          2HH1      ARG  23  -6.025   1.376 -15.603
  167   2HH2  ARG  23          1HH1      ARG  23  -7.597   1.019 -14.969
  168    H    ILE  24           H        ILE  24  -2.744  -0.415  -7.410
  169    HA   ILE  24           HA       ILE  24  -4.684   0.128  -5.452
  170    HB   ILE  24           HB       ILE  24  -3.830  -1.602  -4.081
  171   1HG1  ILE  24          2HG1      ILE  24  -1.407  -1.355  -5.793
  172   2HG1  ILE  24          3HG1      ILE  24  -1.521  -1.175  -4.026
  173   1HG2  ILE  24          1HG2      ILE  24  -5.012  -1.999  -6.362
  174   2HG2  ILE  24          2HG2      ILE  24  -3.422  -2.524  -6.941
  175   3HG2  ILE  24          3HG2      ILE  24  -4.200  -3.351  -5.573
  176   1HD1  ILE  24          1HD1      ILE  24  -0.467  -3.289  -4.484
  177   2HD1  ILE  24          2HD1      ILE  24  -2.106  -3.605  -3.867
  178   3HD1  ILE  24          3HD1      ILE  24  -1.755  -3.731  -5.613
  179    H    GLU  25           H        GLU  25  -1.144   0.725  -5.152
  180    HA   GLU  25           HA       GLU  25  -1.181   1.959  -2.648
  181   1HB   GLU  25          2HB       GLU  25   0.590   2.133  -5.090
  182   2HB   GLU  25          3HB       GLU  25   0.886   3.230  -3.736
  183   1HG   GLU  25          2HG       GLU  25   0.561   0.254  -3.214
  184   2HG   GLU  25          3HG       GLU  25   2.103   0.937  -3.737
  185    H    LYS  26           H        LYS  26  -1.831   3.450  -5.838
  186    HA   LYS  26           HA       LYS  26  -1.955   6.133  -4.677
  187   1HB   LYS  26          2HB       LYS  26  -2.966   5.127  -7.353
  188   2HB   LYS  26          3HB       LYS  26  -2.798   6.826  -6.888
  189   1HG   LYS  26          2HG       LYS  26  -0.486   4.838  -7.033
  190   2HG   LYS  26          3HG       LYS  26  -0.962   5.933  -8.333
  191   1HD   LYS  26          2HD       LYS  26  -0.363   7.878  -6.947
  192   2HD   LYS  26          3HD       LYS  26  -0.106   6.846  -5.536
  193   1HE   LYS  26          2HE       LYS  26   2.040   7.458  -6.465
  194   2HE   LYS  26          3HE       LYS  26   1.779   5.716  -6.543
  195   1HZ   LYS  26          1HZ       LYS  26   1.446   7.585  -8.802
  196   2HZ   LYS  26          2HZ       LYS  26   2.725   6.581  -8.563
  197   3HZ   LYS  26          3HZ       LYS  26   1.239   5.950  -8.867
  198    H    GLY  27           H        GLY  27  -4.470   3.758  -5.672
  199   1HA   GLY  27          2HA       GLY  27  -6.701   5.368  -4.833
  200   2HA   GLY  27          3HA       GLY  27  -6.686   3.610  -5.012
  201    H    LEU  28           H        LEU  28  -4.411   3.293  -3.142
  202    HA   LEU  28           HA       LEU  28  -5.735   3.124  -0.579
  203   1HB   LEU  28          2HB       LEU  28  -4.259   1.524  -1.391
  204   2HB   LEU  28          3HB       LEU  28  -2.915   2.655  -1.478
  205    HG   LEU  28           HG       LEU  28  -4.267   2.161   1.172
  206   1HD1  LEU  28          1HD1      LEU  28  -2.651   0.231   1.432
  207   2HD1  LEU  28          2HD1      LEU  28  -3.991  -0.018   0.300
  208   3HD1  LEU  28          3HD1      LEU  28  -2.354   0.337  -0.310
  209   1HD2  LEU  28          1HD2      LEU  28  -2.127   2.894   1.998
  210   2HD2  LEU  28          2HD2      LEU  28  -1.326   2.536   0.450
  211   3HD2  LEU  28          3HD2      LEU  28  -2.416   3.917   0.600
  212    H    LYS  29           H        LYS  29  -3.128   5.291  -1.886
  213    HA   LYS  29           HA       LYS  29  -2.849   6.959   0.309
  214   1HB   LYS  29          2HB       LYS  29  -1.504   7.068  -1.826
  215   2HB   LYS  29          3HB       LYS  29  -2.856   7.938  -2.556
  216   1HG   LYS  29          2HG       LYS  29  -2.394   9.351  -0.158
  217   2HG   LYS  29          3HG       LYS  29  -0.797   8.853  -0.609
  218   1HD   LYS  29          2HD       LYS  29  -2.657  10.169  -2.636
  219   2HD   LYS  29          3HD       LYS  29  -1.881  11.151  -1.406
  220   1HE   LYS  29          2HE       LYS  29   0.009   9.350  -2.835
  221   2HE   LYS  29          3HE       LYS  29  -0.774  10.531  -3.885
  222   1HZ   LYS  29          1HZ       LYS  29   1.364  11.194  -2.764
  223   2HZ   LYS  29          2HZ       LYS  29   0.141  12.298  -2.638
  224   3HZ   LYS  29          3HZ       LYS  29   0.552  11.342  -1.378
  225    H    ARG  30           H        ARG  30  -5.480   6.973  -2.040
  226    HA   ARG  30           HA       ARG  30  -6.617   9.435  -1.206
  227   1HB   ARG  30          2HB       ARG  30  -7.392   7.151  -2.903
  228   2HB   ARG  30          3HB       ARG  30  -8.779   7.912  -2.157
  229   1HG   ARG  30          2HG       ARG  30  -6.610   9.439  -3.671
  230   2HG   ARG  30          3HG       ARG  30  -8.084   8.801  -4.413
  231   1HD   ARG  30          2HD       ARG  30  -9.467  10.109  -2.798
  232   2HD   ARG  30          3HD       ARG  30  -8.038  10.894  -2.168
  233    HE   ARG  30           HE       ARG  30  -9.426  11.331  -4.709
  234   1HH1  ARG  30          2HH2      ARG  30  -6.375  11.837  -3.020
  235   2HH1  ARG  30          1HH2      ARG  30  -5.885  13.207  -3.968
  236   1HH2  ARG  30          2HH1      ARG  30  -8.793  13.107  -6.028
  237   2HH2  ARG  30          1HH1      ARG  30  -7.291  13.921  -5.749
  238    H    MET  31           H        MET  31  -6.379   6.729   0.828
  239    HA   MET  31           HA       MET  31  -8.887   7.164   2.275
  240   1HB   MET  31          2HB       MET  31  -6.323   5.629   2.666
  241   2HB   MET  31          3HB       MET  31  -7.251   5.964   4.101
  242   1HG   MET  31          2HG       MET  31  -9.299   4.999   3.030
  243   2HG   MET  31          3HG       MET  31  -8.272   4.516   1.676
  244   1HE   MET  31          1HE       MET  31  -5.860   2.010   3.389
  245   2HE   MET  31          2HE       MET  31  -6.148   3.116   2.036
  246   3HE   MET  31          3HE       MET  31  -5.559   3.740   3.599
  247    HA   PRO  32           HA       PRO  32  -7.295  10.274   5.227
  248   1HB   PRO  32          2HB       PRO  32  -8.040   9.222   7.651
  249   2HB   PRO  32          3HB       PRO  32  -9.199   9.990   6.533
  250   1HG   PRO  32          2HG       PRO  32  -8.597   7.033   6.819
  251   2HG   PRO  32          3HG       PRO  32 -10.201   7.823   6.834
  252   1HD   PRO  32          2HD       PRO  32  -9.253   6.699   4.586
  253   2HD   PRO  32          3HD       PRO  32 -10.092   8.254   4.486
  254    H    GLY  33           H        GLY  33  -5.669  10.251   7.064
  255   1HA   GLY  33          2HA       GLY  33  -3.783   9.714   8.061
  256   2HA   GLY  33          3HA       GLY  33  -4.235   8.005   7.819
  257    H    VAL  34           H        VAL  34  -4.105   8.076   4.958
  258    HA   VAL  34           HA       VAL  34  -1.222   7.734   4.688
  259    HB   VAL  34           HB       VAL  34  -3.452   7.355   2.699
  260   1HG1  VAL  34          1HG1      VAL  34  -1.090   7.350   1.739
  261   2HG1  VAL  34          2HG1      VAL  34  -0.583   6.219   3.001
  262   3HG1  VAL  34          3HG1      VAL  34  -1.701   5.687   1.749
  263   1HG2  VAL  34          1HG2      VAL  34  -3.248   4.895   3.364
  264   2HG2  VAL  34          2HG2      VAL  34  -2.351   5.466   4.798
  265   3HG2  VAL  34          3HG2      VAL  34  -4.039   5.943   4.538
  266    H    THR  35           H        THR  35   0.171   9.037   3.602
  267    HA   THR  35           HA       THR  35  -0.946  11.559   2.439
  268    HB   THR  35           HB       THR  35   1.607  11.021   3.855
  269    HG1  THR  35           1HG      THR  35   0.505  12.335   5.426
  270   1HG2  THR  35          1HG2      THR  35   1.827  13.504   3.858
  271   2HG2  THR  35          2HG2      THR  35   1.947  12.817   2.229
  272   3HG2  THR  35          3HG2      THR  35   0.438  13.608   2.754
  273    H    ASP  36           H        ASP  36   1.647   9.041   2.041
  274    HA   ASP  36           HA       ASP  36   1.358   9.374  -0.816
  275   1HB   ASP  36          2HB       ASP  36   3.740  10.461   0.547
  276   2HB   ASP  36          3HB       ASP  36   4.151   9.214  -0.641
  277    H    ALA  37           H        ALA  37   2.626   7.734  -1.981
  278    HA   ALA  37           HA       ALA  37   2.919   5.193  -0.619
  279   1HB   ALA  37          1HB       ALA  37   0.383   5.581  -0.680
  280   2HB   ALA  37          2HB       ALA  37   0.501   5.592  -2.451
  281   3HB   ALA  37          3HB       ALA  37   0.901   4.135  -1.524
  282    H    ASN  38           H        ASN  38   3.864   3.594  -1.955
  283    HA   ASN  38           HA       ASN  38   4.689   4.403  -4.622
  284   1HB   ASN  38          2HB       ASN  38   7.197   4.226  -3.233
  285   2HB   ASN  38          3HB       ASN  38   6.565   5.484  -4.287
  286   1HD2  ASN  38          1HD2      ASN  38   5.886   4.421  -0.879
  287   2HD2  ASN  38          2HD2      ASN  38   6.233   6.011  -0.204
  288    H    VAL  39           H        VAL  39   4.591   2.508  -5.588
  289    HA   VAL  39           HA       VAL  39   5.076   0.078  -4.083
  290    HB   VAL  39           HB       VAL  39   3.140   0.558  -5.604
  291   1HG1  VAL  39          1HG1      VAL  39   4.393   1.420  -7.581
  292   2HG1  VAL  39          2HG1      VAL  39   4.924  -0.248  -7.913
  293   3HG1  VAL  39          3HG1      VAL  39   3.219   0.144  -7.928
  294   1HG2  VAL  39          1HG2      VAL  39   2.727  -1.600  -5.520
  295   2HG2  VAL  39          2HG2      VAL  39   4.089  -2.008  -6.589
  296   3HG2  VAL  39          3HG2      VAL  39   4.330  -1.817  -4.839
  297    H    ASN  40           H        ASN  40   7.203  -0.532  -3.802
  298    HA   ASN  40           HA       ASN  40   9.195   0.166  -5.882
  299   1HB   ASN  40          2HB       ASN  40   9.605   0.673  -3.480
  300   2HB   ASN  40          3HB       ASN  40   9.586  -1.063  -3.133
  301   1HD2  ASN  40          1HD2      ASN  40  11.851  -0.095  -2.355
  302   2HD2  ASN  40          2HD2      ASN  40  13.141  -0.270  -3.534
  303    H    LEU  41           H        LEU  41   7.570  -1.414  -7.034
  304    HA   LEU  41           HA       LEU  41   7.899  -4.232  -6.549
  305   1HB   LEU  41          2HB       LEU  41   6.326  -2.517  -8.295
  306   2HB   LEU  41          3HB       LEU  41   7.016  -3.816  -9.250
  307    HG   LEU  41           HG       LEU  41   4.733  -4.176  -8.246
  308   1HD1  LEU  41          1HD1      LEU  41   5.164  -6.568  -7.699
  309   2HD1  LEU  41          2HD1      LEU  41   5.925  -6.035  -9.211
  310   3HD1  LEU  41          3HD1      LEU  41   6.906  -6.243  -7.750
  311   1HD2  LEU  41          1HD2      LEU  41   4.362  -4.616  -6.039
  312   2HD2  LEU  41          2HD2      LEU  41   6.019  -5.126  -5.692
  313   3HD2  LEU  41          3HD2      LEU  41   5.653  -3.406  -5.850
  314    H    ALA  42           H        ALA  42   9.813  -1.945  -8.239
  315    HA   ALA  42           HA       ALA  42  11.431  -3.468  -9.912
  316   1HB   ALA  42          1HB       ALA  42  13.248  -1.970  -9.241
  317   2HB   ALA  42          2HB       ALA  42  11.742  -1.043  -9.449
  318   3HB   ALA  42          3HB       ALA  42  12.332  -1.455  -7.815
  319    H    THR  43           H        THR  43  11.308  -3.507  -6.313
  320    HA   THR  43           HA       THR  43  12.974  -5.968  -6.443
  321    HB   THR  43           HB       THR  43  14.379  -4.217  -5.570
  322    HG1  THR  43           1HG      THR  43  13.464  -6.130  -3.709
  323   1HG2  THR  43          1HG2      THR  43  13.943  -3.137  -3.421
  324   2HG2  THR  43          2HG2      THR  43  12.661  -2.732  -4.574
  325   3HG2  THR  43          3HG2      THR  43  12.362  -3.929  -3.295
  326    H    GLU  44           H        GLU  44  10.116  -5.627  -6.632
  327    HA   GLU  44           HA       GLU  44   8.229  -6.516  -5.917
  328   1HB   GLU  44          2HB       GLU  44  10.224  -8.401  -5.854
  329   2HB   GLU  44          3HB       GLU  44   9.507  -8.636  -4.265
  330   1HG   GLU  44          2HG       GLU  44   7.286  -8.937  -5.342
  331   2HG   GLU  44          3HG       GLU  44   7.997  -8.572  -6.930
  332    H    THR  45           H        THR  45   9.174  -4.341  -4.130
  333    HA   THR  45           HA       THR  45   7.855  -5.122  -1.562
  334    HB   THR  45           HB       THR  45  10.134  -3.207  -2.221
  335    HG1  THR  45           1HG      THR  45  10.014  -5.796  -1.082
  336   1HG2  THR  45          1HG2      THR  45   8.950  -2.334  -0.280
  337   2HG2  THR  45          2HG2      THR  45   8.978  -3.949   0.486
  338   3HG2  THR  45          3HG2      THR  45  10.486  -3.059   0.206
  339    H    VAL  46           H        VAL  46   6.745  -3.259  -0.473
  340    HA   VAL  46           HA       VAL  46   5.990  -1.017  -2.269
  341    HB   VAL  46           HB       VAL  46   4.122  -2.502  -2.378
  342   1HG1  VAL  46          1HG1      VAL  46   4.403  -3.912  -0.389
  343   2HG1  VAL  46          2HG1      VAL  46   4.103  -2.514   0.671
  344   3HG1  VAL  46          3HG1      VAL  46   2.811  -3.151  -0.359
  345   1HG2  VAL  46          1HG2      VAL  46   3.419  -0.299  -0.411
  346   2HG2  VAL  46          2HG2      VAL  46   3.715  -0.069  -2.149
  347   3HG2  VAL  46          3HG2      VAL  46   2.366  -1.082  -1.602
  348    H    ASN  47           H        ASN  47   5.801   0.991  -1.229
  349    HA   ASN  47           HA       ASN  47   6.442   1.028   1.663
  350   1HB   ASN  47          2HB       ASN  47   7.701   2.594  -0.630
  351   2HB   ASN  47          3HB       ASN  47   7.623   3.271   0.998
  352   1HD2  ASN  47          1HD2      ASN  47   8.363   1.667   2.816
  353   2HD2  ASN  47          2HD2      ASN  47   9.972   1.045   2.475
  354    H    VAL  48           H        VAL  48   5.089   2.459   2.821
  355    HA   VAL  48           HA       VAL  48   3.243   4.109   1.218
  356    HB   VAL  48           HB       VAL  48   2.044   2.059   1.538
  357   1HG1  VAL  48          1HG1      VAL  48   3.115   0.996   3.379
  358   2HG1  VAL  48          2HG1      VAL  48   2.722   2.315   4.490
  359   3HG1  VAL  48          3HG1      VAL  48   1.430   1.297   3.848
  360   1HG2  VAL  48          1HG2      VAL  48   1.072   4.304   3.346
  361   2HG2  VAL  48          2HG2      VAL  48   0.768   4.095   1.615
  362   3HG2  VAL  48          3HG2      VAL  48   0.096   2.940   2.780
  363    H    ILE  49           H        ILE  49   3.067   6.058   2.054
  364    HA   ILE  49           HA       ILE  49   4.678   6.613   4.432
  365    HB   ILE  49           HB       ILE  49   3.800   8.601   2.295
  366   1HG1  ILE  49          2HG1      ILE  49   4.956   7.042   0.985
  367   2HG1  ILE  49          3HG1      ILE  49   6.038   8.397   1.295
  368   1HG2  ILE  49          1HG2      ILE  49   5.763   9.872   3.115
  369   2HG2  ILE  49          2HG2      ILE  49   4.519   9.627   4.347
  370   3HG2  ILE  49          3HG2      ILE  49   5.996   8.657   4.389
  371   1HD1  ILE  49          1HD1      ILE  49   6.173   5.604   2.477
  372   2HD1  ILE  49          2HD1      ILE  49   7.405   6.491   1.569
  373   3HD1  ILE  49          3HD1      ILE  49   6.995   6.984   3.220
  374    H    TYR  50           H        TYR  50   3.227   6.688   6.199
  375    HA   TYR  50           HA       TYR  50   0.740   8.304   5.887
  376   1HB   TYR  50          2HB       TYR  50  -0.655   6.617   6.797
  377   2HB   TYR  50          3HB       TYR  50   0.108   6.008   5.360
  378    HD1  TYR  50           HD1      TYR  50   1.620   4.063   5.479
  379    HD2  TYR  50           HD2      TYR  50  -0.081   5.749   9.041
  380    HE1  TYR  50           HE1      TYR  50   1.939   1.900   6.668
  381    HE2  TYR  50           HE2      TYR  50   0.471   3.688  10.284
  382    HH   TYR  50           HH       TYR  50   1.365   1.556  10.139
  383    H    ASP  51           H        ASP  51  -0.377   8.635   7.854
  384    HA   ASP  51           HA       ASP  51   1.486   9.352  10.030
  385   1HB   ASP  51          2HB       ASP  51  -0.085  11.039   9.423
  386   2HB   ASP  51          3HB       ASP  51  -1.441   9.927   9.580
  387    HA   PRO  52           HA       PRO  52   0.214   5.359  11.774
  388   1HB   PRO  52          2HB       PRO  52   2.029   5.077  13.754
  389   2HB   PRO  52          3HB       PRO  52   2.472   4.952  12.027
  390   1HG   PRO  52          2HG       PRO  52   2.670   7.417  13.791
  391   2HG   PRO  52          3HG       PRO  52   3.967   6.675  12.814
  392   1HD   PRO  52          2HD       PRO  52   2.475   8.748  11.889
  393   2HD   PRO  52          3HD       PRO  52   2.966   7.423  10.786
  394    H    ALA  53           H        ALA  53  -0.451   8.473  12.965
  395    HA   ALA  53           HA       ALA  53  -1.642   7.501  15.491
  396   1HB   ALA  53          1HB       ALA  53  -2.249   9.823  15.779
  397   2HB   ALA  53          2HB       ALA  53  -0.523   9.742  15.357
  398   3HB   ALA  53          3HB       ALA  53  -1.723  10.221  14.135
  399    H    GLU  54           H        GLU  54  -2.318   8.027  12.059
  400    HA   GLU  54           HA       GLU  54  -5.209   8.141  12.638
  401   1HB   GLU  54          2HB       GLU  54  -3.691   9.871  11.067
  402   2HB   GLU  54          3HB       GLU  54  -4.442   8.774   9.900
  403   1HG   GLU  54          2HG       GLU  54  -6.674   9.256  10.919
  404   2HG   GLU  54          3HG       GLU  54  -5.881  10.407  12.009
  405    H    THR  55           H        THR  55  -2.787   6.715  10.451
  406    HA   THR  55           HA       THR  55  -4.415   4.259  10.321
  407    HB   THR  55           HB       THR  55  -2.748   3.657   8.299
  408    HG1  THR  55           1HG      THR  55  -3.058   6.430   8.209
  409   1HG2  THR  55          1HG2      THR  55  -5.141   3.608   8.258
  410   2HG2  THR  55          2HG2      THR  55  -5.240   5.403   8.176
  411   3HG2  THR  55          3HG2      THR  55  -4.525   4.480   6.826
  412    H    GLY  56           H        GLY  56  -2.721   2.435   9.830
  413   1HA   GLY  56          2HA       GLY  56  -0.732   1.660  11.538
  414   2HA   GLY  56          3HA       GLY  56  -2.128   1.983  12.596
  415    H    THR  57           H        THR  57  -1.129   0.418   9.877
  416    HA   THR  57           HA       THR  57  -1.809  -0.432   8.110
  417    HB   THR  57           HB       THR  57  -1.545  -2.949   8.237
  418    HG1  THR  57           1HG      THR  57  -1.327  -2.327  10.997
  419   1HG2  THR  57          1HG2      THR  57   0.549  -1.329   9.762
  420   2HG2  THR  57          2HG2      THR  57   0.777  -2.912   9.004
  421   3HG2  THR  57          3HG2      THR  57   0.442  -1.492   7.996
  422    H    ALA  58           H        ALA  58  -4.090  -1.228  10.610
  423    HA   ALA  58           HA       ALA  58  -6.170  -2.537   9.687
  424   1HB   ALA  58          1HB       ALA  58  -6.056   0.320  10.705
  425   2HB   ALA  58          2HB       ALA  58  -7.538  -0.683  10.725
  426   3HB   ALA  58          3HB       ALA  58  -6.114  -1.141  11.695
  427    H    ALA  59           H        ALA  59  -5.565   0.782   8.497
  428    HA   ALA  59           HA       ALA  59  -8.058   0.493   6.903
  429   1HB   ALA  59          1HB       ALA  59  -7.216   2.686   7.997
  430   2HB   ALA  59          2HB       ALA  59  -6.214   2.821   6.512
  431   3HB   ALA  59          3HB       ALA  59  -7.977   2.724   6.411
  432    H    ILE  60           H        ILE  60  -4.601   0.472   6.456
  433    HA   ILE  60           HA       ILE  60  -4.451   0.376   3.628
  434    HB   ILE  60           HB       ILE  60  -2.639  -0.238   5.945
  435   1HG1  ILE  60          2HG1      ILE  60  -1.155   1.176   4.445
  436   2HG1  ILE  60          3HG1      ILE  60  -2.525   1.246   3.322
  437   1HG2  ILE  60          1HG2      ILE  60  -2.200  -2.250   4.649
  438   2HG2  ILE  60          2HG2      ILE  60  -2.047  -1.292   3.156
  439   3HG2  ILE  60          3HG2      ILE  60  -0.882  -1.099   4.488
  440   1HD1  ILE  60          1HD1      ILE  60  -2.634   2.185   6.236
  441   2HD1  ILE  60          2HD1      ILE  60  -2.193   3.236   4.884
  442   3HD1  ILE  60          3HD1      ILE  60  -3.820   2.538   4.954
  443    H    GLN  61           H        GLN  61  -4.591  -2.354   5.988
  444    HA   GLN  61           HA       GLN  61  -4.591  -4.322   3.932
  445   1HB   GLN  61          2HB       GLN  61  -4.940  -4.327   6.810
  446   2HB   GLN  61          3HB       GLN  61  -6.167  -5.322   6.022
  447   1HG   GLN  61          2HG       GLN  61  -4.620  -6.915   6.272
  448   2HG   GLN  61          3HG       GLN  61  -4.142  -6.357   4.676
  449   1HE2  GLN  61          1HE2      GLN  61  -2.860  -3.854   5.710
  450   2HE2  GLN  61          2HE2      GLN  61  -1.402  -4.401   6.534
  451    H    GLU  62           H        GLU  62  -7.323  -2.720   5.672
  452    HA   GLU  62           HA       GLU  62  -9.504  -3.896   4.450
  453   1HB   GLU  62          2HB       GLU  62  -8.905  -1.182   5.587
  454   2HB   GLU  62          3HB       GLU  62 -10.343  -1.310   4.589
  455   1HG   GLU  62          2HG       GLU  62 -11.195  -3.133   6.019
  456   2HG   GLU  62          3HG       GLU  62  -9.722  -3.049   7.008
  457    H    LYS  63           H        LYS  63  -7.786  -0.983   3.132
  458    HA   LYS  63           HA       LYS  63  -9.358  -1.072   0.747
  459   1HB   LYS  63          2HB       LYS  63  -7.031   0.471   1.810
  460   2HB   LYS  63          3HB       LYS  63  -7.189   0.407   0.087
  461   1HG   LYS  63          2HG       LYS  63  -9.375   1.262   2.027
  462   2HG   LYS  63          3HG       LYS  63  -8.304   2.360   1.145
  463   1HD   LYS  63          2HD       LYS  63 -10.254   0.542  -0.301
  464   2HD   LYS  63          3HD       LYS  63 -10.663   2.154   0.277
  465   1HE   LYS  63          2HE       LYS  63  -8.176   1.796  -1.413
  466   2HE   LYS  63          3HE       LYS  63  -9.749   1.760  -2.211
  467   1HZ   LYS  63          1HZ       LYS  63  -8.936   3.955  -0.433
  468   2HZ   LYS  63          2HZ       LYS  63  -8.611   3.971  -2.019
  469   3HZ   LYS  63          3HZ       LYS  63 -10.184   3.935  -1.513
  470    H    ILE  64           H        ILE  64  -6.131  -2.353   1.580
  471    HA   ILE  64           HA       ILE  64  -5.117  -3.059  -0.872
  472    HB   ILE  64           HB       ILE  64  -4.793  -3.805   1.886
  473   1HG1  ILE  64          2HG1      ILE  64  -3.345  -2.330   0.499
  474   2HG1  ILE  64          3HG1      ILE  64  -2.542  -3.553   1.479
  475   1HG2  ILE  64          1HG2      ILE  64  -3.480  -5.853   1.544
  476   2HG2  ILE  64          2HG2      ILE  64  -5.225  -6.049   1.469
  477   3HG2  ILE  64          3HG2      ILE  64  -4.276  -6.039  -0.037
  478   1HD1  ILE  64          1HD1      ILE  64  -1.538  -3.445  -0.740
  479   2HD1  ILE  64          2HD1      ILE  64  -2.303  -5.023  -0.471
  480   3HD1  ILE  64          3HD1      ILE  64  -3.104  -3.818  -1.498
  481    H    GLU  65           H        GLU  65  -7.278  -4.949   1.311
  482    HA   GLU  65           HA       GLU  65  -7.913  -7.120  -0.393
  483   1HB   GLU  65          2HB       GLU  65  -9.274  -5.797   1.981
  484   2HB   GLU  65          3HB       GLU  65 -10.030  -7.155   1.144
  485   1HG   GLU  65          2HG       GLU  65  -7.170  -7.407   2.071
  486   2HG   GLU  65          3HG       GLU  65  -8.504  -7.610   3.213
  487    H    LYS  66           H        LYS  66  -9.878  -4.154   0.268
  488    HA   LYS  66           HA       LYS  66 -11.912  -4.808  -1.585
  489   1HB   LYS  66          2HB       LYS  66 -11.087  -2.378  -0.084
  490   2HB   LYS  66          3HB       LYS  66 -11.881  -2.029  -1.617
  491   1HG   LYS  66          2HG       LYS  66 -13.554  -2.100   0.056
  492   2HG   LYS  66          3HG       LYS  66 -13.763  -3.497  -1.019
  493   1HD   LYS  66          2HD       LYS  66 -12.456  -4.878   0.723
  494   2HD   LYS  66          3HD       LYS  66 -12.552  -3.490   1.801
  495   1HE   LYS  66          2HE       LYS  66 -14.880  -5.078   0.584
  496   2HE   LYS  66          3HE       LYS  66 -14.320  -5.173   2.258
  497   1HZ   LYS  66          1HZ       LYS  66 -16.250  -3.792   2.063
  498   2HZ   LYS  66          2HZ       LYS  66 -14.971  -2.874   2.542
  499   3HZ   LYS  66          3HZ       LYS  66 -15.511  -2.798   0.986
  500    H    LEU  67           H        LEU  67  -8.828  -3.248  -2.221
  501    HA   LEU  67           HA       LEU  67  -9.408  -2.446  -4.928
  502   1HB   LEU  67          2HB       LEU  67  -6.855  -2.848  -3.354
  503   2HB   LEU  67          3HB       LEU  67  -6.871  -2.280  -5.023
  504    HG   LEU  67           HG       LEU  67  -8.539  -0.842  -2.925
  505   1HD1  LEU  67          1HD1      LEU  67  -6.258  -0.925  -2.010
  506   2HD1  LEU  67          2HD1      LEU  67  -5.610  -0.392  -3.556
  507   3HD1  LEU  67          3HD1      LEU  67  -6.611   0.707  -2.610
  508   1HD2  LEU  67          1HD2      LEU  67  -8.934  -0.270  -5.309
  509   2HD2  LEU  67          2HD2      LEU  67  -8.184   1.075  -4.441
  510   3HD2  LEU  67          3HD2      LEU  67  -7.204   0.061  -5.517
  511    H    GLY  68           H        GLY  68  -8.791  -5.528  -3.490
  512   1HA   GLY  68          2HA       GLY  68  -9.011  -7.561  -4.551
  513   2HA   GLY  68          3HA       GLY  68  -8.741  -6.819  -6.136
  514    H    TYR  69           H        TYR  69  -6.799  -6.633  -3.085
  515    HA   TYR  69           HA       TYR  69  -4.537  -8.062  -4.384
  516   1HB   TYR  69          2HB       TYR  69  -4.790  -5.178  -3.911
  517   2HB   TYR  69          3HB       TYR  69  -3.474  -5.846  -2.970
  518    HD1  TYR  69           HD1      TYR  69  -4.865  -5.611  -6.428
  519    HD2  TYR  69           HD2      TYR  69  -1.455  -6.641  -3.999
  520    HE1  TYR  69           HE1      TYR  69  -3.437  -5.556  -8.416
  521    HE2  TYR  69           HE2      TYR  69  -0.024  -6.563  -5.969
  522    HH   TYR  69           HH       TYR  69   0.097  -6.168  -8.248
  523    H    HIS  70           H        HIS  70  -2.748  -8.347  -2.699
  524    HA   HIS  70           HA       HIS  70  -3.670  -8.301   0.091
  525   1HB   HIS  70          2HB       HIS  70  -4.226 -10.566  -0.964
  526   2HB   HIS  70          3HB       HIS  70  -2.486 -10.848  -1.053
  527    HD1  HIS  70           1HD      HIS  70  -1.573  -9.917   1.865
  528    HD2  HIS  70           2HD      HIS  70  -5.127 -12.004   0.957
  529    HE1  HIS  70           1HE      HIS  70  -2.294 -11.076   3.985
  530    H    VAL  71           H        VAL  71  -2.046  -7.500   1.289
  531    HA   VAL  71           HA       VAL  71   0.705  -7.368   0.172
  532    HB   VAL  71           HB       VAL  71  -0.556  -5.277   0.882
  533   1HG1  VAL  71          1HG1      VAL  71   0.062  -6.217   3.710
  534   2HG1  VAL  71          2HG1      VAL  71  -0.658  -4.677   3.218
  535   3HG1  VAL  71          3HG1      VAL  71  -1.564  -6.182   2.999
  536   1HG2  VAL  71          1HG2      VAL  71   1.390  -4.241   1.877
  537   2HG2  VAL  71          2HG2      VAL  71   2.102  -5.836   2.196
  538   3HG2  VAL  71          3HG2      VAL  71   1.829  -5.284   0.524
  539    H    VAL  72           H        VAL  72   2.466  -8.033   1.591
  540    HA   VAL  72           HA       VAL  72   1.712 -10.013   3.687
  541    HB   VAL  72           HB       VAL  72   4.000 -10.181   1.795
  542   1HG1  VAL  72          1HG1      VAL  72   4.468 -11.286   3.922
  543   2HG1  VAL  72          2HG1      VAL  72   2.908 -12.134   3.865
  544   3HG1  VAL  72          3HG1      VAL  72   4.178 -12.513   2.687
  545   1HG2  VAL  72          1HG2      VAL  72   1.361 -11.732   1.821
  546   2HG2  VAL  72          2HG2      VAL  72   1.882 -10.598   0.556
  547   3HG2  VAL  72          3HG2      VAL  72   2.751 -12.119   0.787
  548    H    ILE  73           H        ILE  73   2.964  -9.962   5.507
  549    HA   ILE  73           HA       ILE  73   4.364  -7.358   5.928
  550    HB   ILE  73           HB       ILE  73   3.087  -9.062   8.052
  551   1HG1  ILE  73          2HG1      ILE  73   1.304  -8.368   6.545
  552   2HG1  ILE  73          3HG1      ILE  73   1.276  -7.438   8.035
  553   1HG2  ILE  73          1HG2      ILE  73   4.783  -7.560   8.932
  554   2HG2  ILE  73          2HG2      ILE  73   4.238  -6.240   7.904
  555   3HG2  ILE  73          3HG2      ILE  73   3.218  -6.809   9.250
  556   1HD1  ILE  73          1HD1      ILE  73   2.308  -5.505   6.896
  557   2HD1  ILE  73          2HD1      ILE  73   2.321  -6.420   5.366
  558   3HD1  ILE  73          3HD1      ILE  73   0.788  -6.003   6.143
  559    H    GLU  74           H        GLU  74   6.084  -8.691   4.785
  560    HA   GLU  74           HA       GLU  74   7.320 -10.753   6.122
  561   1HB   GLU  74          2HB       GLU  74   7.600  -9.588   3.648
  562   2HB   GLU  74          3HB       GLU  74   9.211  -9.436   4.382
  563   1HG   GLU  74          2HG       GLU  74   9.193 -11.512   3.209
  564   2HG   GLU  74          3HG       GLU  74   8.994 -11.962   4.909
  565    H    GLY  75           H        GLY  75   7.431  -7.641   6.907
  566   1HA   GLY  75          2HA       GLY  75  10.046  -7.240   8.071
  567   2HA   GLY  75          3HA       GLY  75   8.580  -6.314   8.439
  568    H    ARG  76           H        ARG  76   6.987  -8.650   9.203
  569    HA   ARG  76           HA       ARG  76   6.316  -9.723  10.989
  570   1HB   ARG  76          2HB       ARG  76   8.040 -11.184  10.160
  571   2HB   ARG  76          3HB       ARG  76   9.277 -10.363  11.099
  572   1HG   ARG  76          2HG       ARG  76   8.711 -12.518  12.026
  573   2HG   ARG  76          3HG       ARG  76   8.416 -11.220  13.171
  574   1HD   ARG  76          2HD       ARG  76   6.026 -11.914  11.524
  575   2HD   ARG  76          3HD       ARG  76   6.673 -13.272  12.468
  576    HE   ARG  76           HE       ARG  76   6.363 -10.688  13.860
  577   1HH1  ARG  76          2HH2      ARG  76   4.561 -13.507  12.898
  578   2HH1  ARG  76          1HH2      ARG  76   3.737 -13.785  14.405
  579   1HH2  ARG  76          2HH1      ARG  76   5.435 -11.072  16.005
  580   2HH2  ARG  76          1HH1      ARG  76   4.236 -12.311  16.236
  Start of MODEL    4
    1   1H    MET   1          H1        MET   1   1.109  14.436  18.632
    2   2H    MET   1          H2        MET   1   0.773  14.707  20.227
    3   3H    MET   1          H3        MET   1  -0.427  14.788  19.093
    4    HA   MET   1           HA       MET   1   0.153  16.975  19.746
    5   1HB   MET   1          2HB       MET   1   2.935  15.994  19.046
    6   2HB   MET   1          3HB       MET   1   2.514  17.699  18.819
    7   1HG   MET   1          2HG       MET   1   1.859  17.942  21.130
    8   2HG   MET   1          3HG       MET   1   2.231  16.242  21.467
    9   1HE   MET   1          1HE       MET   1   3.327  19.027  22.927
   10   2HE   MET   1          2HE       MET   1   3.581  17.377  23.553
   11   3HE   MET   1          3HE       MET   1   4.968  18.467  23.316
   12    H    LEU   2           H        LEU   2   2.152  16.095  16.904
   13    HA   LEU   2           HA       LEU   2   0.069  17.249  15.117
   14   1HB   LEU   2          2HB       LEU   2   2.467  18.324  15.417
   15   2HB   LEU   2          3HB       LEU   2   3.029  16.900  14.541
   16    HG   LEU   2           HG       LEU   2   1.356  17.594  12.680
   17   1HD1  LEU   2          1HD1      LEU   2  -0.014  19.196  14.027
   18   2HD1  LEU   2          2HD1      LEU   2   1.430  20.193  14.298
   19   3HD1  LEU   2          3HD1      LEU   2   0.764  20.011  12.665
   20   1HD2  LEU   2          1HD2      LEU   2   2.937  19.283  11.795
   21   2HD2  LEU   2          2HD2      LEU   2   3.693  19.414  13.397
   22   3HD2  LEU   2          3HD2      LEU   2   3.783  17.890  12.488
   23    H    SER   3           H        SER   3  -0.276  15.994  13.100
   24    HA   SER   3           HA       SER   3  -0.066  13.182  13.296
   25   1HB   SER   3          2HB       SER   3  -0.312  14.755  10.707
   26   2HB   SER   3          3HB       SER   3  -1.014  13.187  11.134
   27    HG   SER   3           HG       SER   3  -2.608  14.742  11.366
   28    H    GLU   4           H        GLU   4   2.027  12.375  13.588
   29    HA   GLU   4           HA       GLU   4   4.307  13.335  12.055
   30   1HB   GLU   4          2HB       GLU   4   3.790  11.276  14.117
   31   2HB   GLU   4          3HB       GLU   4   5.099  10.932  13.009
   32   1HG   GLU   4          2HG       GLU   4   6.020  13.160  13.523
   33   2HG   GLU   4          3HG       GLU   4   4.782  13.302  14.781
   34    H    GLN   5           H        GLN   5   5.542  11.403  10.840
   35    HA   GLN   5           HA       GLN   5   3.640   9.939   9.107
   36   1HB   GLN   5          2HB       GLN   5   6.049  11.589   8.286
   37   2HB   GLN   5          3HB       GLN   5   5.285  10.441   7.201
   38   1HG   GLN   5          2HG       GLN   5   3.589  12.624   8.501
   39   2HG   GLN   5          3HG       GLN   5   4.657  13.007   7.162
   40   1HE2  GLN   5          1HE2      GLN   5   3.189   9.755   7.113
   41   2HE2  GLN   5          2HE2      GLN   5   2.118  10.169   5.791
   42    H    LYS   6           H        LYS   6   4.544   7.917   8.297
   43    HA   LYS   6           HA       LYS   6   7.314   7.313   8.925
   44   1HB   LYS   6          2HB       LYS   6   6.269   6.542  10.907
   45   2HB   LYS   6          3HB       LYS   6   4.964   5.734  10.003
   46   1HG   LYS   6          2HG       LYS   6   6.356   4.034   9.252
   47   2HG   LYS   6          3HG       LYS   6   7.853   4.898   9.675
   48   1HD   LYS   6          2HD       LYS   6   5.945   4.354  11.916
   49   2HD   LYS   6          3HD       LYS   6   6.830   2.962  11.261
   50   1HE   LYS   6          2HE       LYS   6   8.966   3.920  11.682
   51   2HE   LYS   6          3HE       LYS   6   8.303   5.535  11.972
   52   1HZ   LYS   6          1HZ       LYS   6   8.957   4.385  13.982
   53   2HZ   LYS   6          2HZ       LYS   6   7.368   4.800  13.992
   54   3HZ   LYS   6          3HZ       LYS   6   7.810   3.231  13.733
   55    H    GLU   7           H        GLU   7   7.931   5.404   7.760
   56    HA   GLU   7           HA       GLU   7   6.526   4.999   5.177
   57   1HB   GLU   7          2HB       GLU   7   9.532   4.767   5.414
   58   2HB   GLU   7          3HB       GLU   7   8.515   5.117   4.033
   59   1HG   GLU   7          2HG       GLU   7   9.686   7.110   4.498
   60   2HG   GLU   7          3HG       GLU   7   8.086   7.420   5.200
   61    H    ILE   8           H        ILE   8   5.595   2.965   5.693
   62    HA   ILE   8           HA       ILE   8   7.269   0.961   7.066
   63    HB   ILE   8           HB       ILE   8   4.493   0.916   6.033
   64   1HG1  ILE   8          2HG1      ILE   8   4.590   2.567   7.838
   65   2HG1  ILE   8          3HG1      ILE   8   3.615   1.138   8.215
   66   1HG2  ILE   8          1HG2      ILE   8   6.088  -0.996   7.633
   67   2HG2  ILE   8          2HG2      ILE   8   4.291  -1.043   7.588
   68   3HG2  ILE   8          3HG2      ILE   8   5.217  -1.228   6.089
   69   1HD1  ILE   8          1HD1      ILE   8   5.046   1.760  10.094
   70   2HD1  ILE   8          2HD1      ILE   8   5.387   0.136   9.451
   71   3HD1  ILE   8          3HD1      ILE   8   6.476   1.489   9.052
   72    H    ALA   9           H        ALA   9   7.366  -1.165   5.904
   73    HA   ALA   9           HA       ALA   9   7.542  -0.982   2.962
   74   1HB   ALA   9          1HB       ALA   9   9.771  -2.102   4.704
   75   2HB   ALA   9          2HB       ALA   9   9.710  -2.077   2.933
   76   3HB   ALA   9          3HB       ALA   9   9.846  -0.557   3.844
   77    H    MET  10           H        MET  10   6.427  -2.760   2.166
   78    HA   MET  10           HA       MET  10   6.247  -5.237   3.838
   79   1HB   MET  10          2HB       MET  10   3.882  -3.866   2.529
   80   2HB   MET  10          3HB       MET  10   3.868  -5.414   3.368
   81   1HG   MET  10          2HG       MET  10   4.016  -4.512   5.455
   82   2HG   MET  10          3HG       MET  10   4.770  -3.023   4.923
   83   1HE   MET  10          1HE       MET  10   1.900  -0.813   3.644
   84   2HE   MET  10          2HE       MET  10   3.635  -0.929   4.007
   85   3HE   MET  10          3HE       MET  10   2.946  -1.827   2.635
   86    H    GLN  11           H        GLN  11   5.103  -6.970   2.398
   87    HA   GLN  11           HA       GLN  11   6.394  -6.964  -0.297
   88   1HB   GLN  11          2HB       GLN  11   5.760  -9.079   1.827
   89   2HB   GLN  11          3HB       GLN  11   5.876  -9.558   0.141
   90   1HG   GLN  11          2HG       GLN  11   8.052  -8.209   1.810
   91   2HG   GLN  11          3HG       GLN  11   8.028  -9.904   1.287
   92   1HE2  GLN  11          1HE2      GLN  11   7.263  -9.838  -1.334
   93   2HE2  GLN  11          2HE2      GLN  11   8.087  -8.601  -2.258
   94    H    VAL  12           H        VAL  12   5.104  -7.905  -2.075
   95    HA   VAL  12           HA       VAL  12   2.155  -7.915  -1.544
   96    HB   VAL  12           HB       VAL  12   1.958  -7.244  -3.953
   97   1HG1  VAL  12          1HG1      VAL  12   3.216  -5.202  -2.098
   98   2HG1  VAL  12          2HG1      VAL  12   2.238  -4.842  -3.531
   99   3HG1  VAL  12          3HG1      VAL  12   1.497  -5.650  -2.136
  100   1HG2  VAL  12          1HG2      VAL  12   3.722  -6.215  -5.098
  101   2HG2  VAL  12          2HG2      VAL  12   4.796  -6.215  -3.680
  102   3HG2  VAL  12          3HG2      VAL  12   4.403  -7.738  -4.513
  103    H    SER  13           H        SER  13   0.955  -9.210  -3.117
  104    HA   SER  13           HA       SER  13   2.425 -11.483  -4.324
  105   1HB   SER  13          2HB       SER  13   0.027 -11.717  -2.448
  106   2HB   SER  13          3HB       SER  13   0.760 -13.052  -3.363
  107    HG   SER  13           HG       SER  13   1.558 -12.926  -1.203
  108    H    GLY  14           H        GLY  14   0.811 -12.714  -5.789
  109   1HA   GLY  14          2HA       GLY  14  -0.992 -12.855  -7.209
  110   2HA   GLY  14          3HA       GLY  14  -1.669 -11.378  -6.517
  111    H    MET  15           H        MET  15   0.374  -9.569  -6.993
  112    HA   MET  15           HA       MET  15  -0.211  -8.413  -9.296
  113   1HB   MET  15          2HB       MET  15   1.791  -7.158  -9.248
  114   2HB   MET  15          3HB       MET  15   1.216  -7.414  -7.589
  115   1HG   MET  15          2HG       MET  15   3.575  -8.816  -8.900
  116   2HG   MET  15          3HG       MET  15   3.636  -7.521  -7.730
  117   1HE   MET  15          1HE       MET  15   3.991 -11.174  -8.205
  118   2HE   MET  15          2HE       MET  15   5.307 -10.196  -7.503
  119   3HE   MET  15          3HE       MET  15   4.549 -11.490  -6.548
  120    H    THR  16           H        THR  16  -0.216  -8.890 -11.360
  121    HA   THR  16           HA       THR  16   2.159 -10.165 -12.612
  122    HB   THR  16           HB       THR  16   0.123 -11.293 -14.015
  123    HG1  THR  16           1HG      THR  16  -0.710 -11.364 -11.289
  124   1HG2  THR  16          1HG2      THR  16   0.557 -13.363 -12.738
  125   2HG2  THR  16          2HG2      THR  16   2.070 -12.498 -13.068
  126   3HG2  THR  16          3HG2      THR  16   1.343 -12.427 -11.445
  127    H    CYS  17           H        CYS  17   0.617  -7.431 -12.435
  128    HA   CYS  17           HA       CYS  17   0.689  -6.792 -15.341
  129   1HB   CYS  17          2HB       CYS  17  -0.502  -5.155 -13.080
  130   2HB   CYS  17          3HB       CYS  17  -0.824  -5.035 -14.819
  131    H    ALA  18           H        ALA  18   2.170  -6.167 -12.232
  132    HA   ALA  18           HA       ALA  18   3.589  -4.690 -11.373
  133   1HB   ALA  18          1HB       ALA  18   5.216  -3.497 -12.680
  134   2HB   ALA  18          2HB       ALA  18   5.070  -5.154 -13.290
  135   3HB   ALA  18          3HB       ALA  18   4.345  -3.806 -14.190
  136    H    ALA  19           H        ALA  19   2.137  -3.029 -14.190
  137    HA   ALA  19           HA       ALA  19   1.835  -0.465 -13.289
  138   1HB   ALA  19          1HB       ALA  19   1.219  -1.241 -15.537
  139   2HB   ALA  19          2HB       ALA  19  -0.192  -2.095 -14.884
  140   3HB   ALA  19          3HB       ALA  19  -0.116  -0.322 -14.812
  141    H    CYS  20           H        CYS  20  -0.699  -2.986 -12.800
  142    HA   CYS  20           HA       CYS  20  -2.432  -1.442 -11.282
  143   1HB   CYS  20          2HB       CYS  20  -1.857  -4.442 -11.267
  144   2HB   CYS  20          3HB       CYS  20  -3.235  -3.753 -10.415
  145    H    ALA  21           H        ALA  21   0.577  -2.915 -10.154
  146    HA   ALA  21           HA       ALA  21  -0.081  -2.814  -7.359
  147   1HB   ALA  21          1HB       ALA  21   2.695  -2.586  -8.548
  148   2HB   ALA  21          2HB       ALA  21   2.183  -3.285  -6.992
  149   3HB   ALA  21          3HB       ALA  21   1.801  -4.123  -8.492
  150    H    ALA  22           H        ALA  22   0.810  -0.368  -9.772
  151    HA   ALA  22           HA       ALA  22   1.435   1.691  -7.780
  152   1HB   ALA  22          1HB       ALA  22   1.326   3.223  -9.637
  153   2HB   ALA  22          2HB       ALA  22   2.253   1.794 -10.144
  154   3HB   ALA  22          3HB       ALA  22   0.569   2.007 -10.681
  155    H    ARG  23           H        ARG  23  -1.346   0.700  -9.816
  156    HA   ARG  23           HA       ARG  23  -3.120   2.755  -9.061
  157   1HB   ARG  23          2HB       ARG  23  -3.826  -0.126  -9.775
  158   2HB   ARG  23          3HB       ARG  23  -4.953   1.220  -9.623
  159   1HG   ARG  23          2HG       ARG  23  -3.579   2.461 -11.377
  160   2HG   ARG  23          3HG       ARG  23  -2.740   0.937 -11.701
  161   1HD   ARG  23          2HD       ARG  23  -5.741   1.451 -11.827
  162   2HD   ARG  23          3HD       ARG  23  -4.672   1.352 -13.236
  163    HE   ARG  23           HE       ARG  23  -4.174  -1.055 -12.212
  164   1HH1  ARG  23          2HH2      ARG  23  -7.300   0.524 -12.724
  165   2HH1  ARG  23          1HH2      ARG  23  -8.173  -0.963 -12.918
  166   1HH2  ARG  23          2HH1      ARG  23  -5.252  -2.980 -12.600
  167   2HH2  ARG  23          1HH1      ARG  23  -6.989  -3.030 -12.783
  168    H    ILE  24           H        ILE  24  -2.591  -0.452  -7.459
  169    HA   ILE  24           HA       ILE  24  -4.561   0.056  -5.492
  170    HB   ILE  24           HB       ILE  24  -3.731  -1.669  -4.151
  171   1HG1  ILE  24          2HG1      ILE  24  -1.247  -1.330  -5.750
  172   2HG1  ILE  24          3HG1      ILE  24  -1.456  -1.222  -3.984
  173   1HG2  ILE  24          1HG2      ILE  24  -4.836  -2.073  -6.468
  174   2HG2  ILE  24          2HG2      ILE  24  -3.226  -2.597  -6.990
  175   3HG2  ILE  24          3HG2      ILE  24  -4.045  -3.415  -5.645
  176   1HD1  ILE  24          1HD1      ILE  24  -0.263  -3.250  -4.549
  177   2HD1  ILE  24          2HD1      ILE  24  -1.875  -3.649  -3.902
  178   3HD1  ILE  24          3HD1      ILE  24  -1.556  -3.709  -5.664
  179    H    GLU  25           H        GLU  25  -0.985   0.633  -5.134
  180    HA   GLU  25           HA       GLU  25  -1.160   1.920  -2.678
  181   1HB   GLU  25          2HB       GLU  25   0.783   1.933  -4.940
  182   2HB   GLU  25          3HB       GLU  25   0.881   3.324  -3.848
  183   1HG   GLU  25          2HG       GLU  25   2.343   1.421  -3.161
  184   2HG   GLU  25          3HG       GLU  25   1.195   1.902  -1.908
  185    H    LYS  26           H        LYS  26  -1.800   3.398  -5.863
  186    HA   LYS  26           HA       LYS  26  -2.033   6.066  -4.658
  187   1HB   LYS  26          2HB       LYS  26  -3.024   5.103  -7.354
  188   2HB   LYS  26          3HB       LYS  26  -2.862   6.787  -6.838
  189   1HG   LYS  26          2HG       LYS  26  -0.568   4.805  -7.147
  190   2HG   LYS  26          3HG       LYS  26  -1.043   6.023  -8.329
  191   1HD   LYS  26          2HD       LYS  26  -0.358   7.815  -6.786
  192   2HD   LYS  26          3HD       LYS  26  -0.115   6.653  -5.478
  193   1HE   LYS  26          2HE       LYS  26   2.038   7.268  -6.378
  194   2HE   LYS  26          3HE       LYS  26   1.710   5.551  -6.616
  195   1HZ   LYS  26          1HZ       LYS  26   1.431   7.640  -8.681
  196   2HZ   LYS  26          2HZ       LYS  26   2.663   6.558  -8.562
  197   3HZ   LYS  26          3HZ       LYS  26   1.146   6.031  -8.901
  198    H    GLY  27           H        GLY  27  -4.383   3.557  -5.648
  199   1HA   GLY  27          2HA       GLY  27  -6.732   5.040  -4.890
  200   2HA   GLY  27          3HA       GLY  27  -6.594   3.288  -5.131
  201    H    LEU  28           H        LEU  28  -4.380   3.128  -3.152
  202    HA   LEU  28           HA       LEU  28  -5.760   2.795  -0.604
  203   1HB   LEU  28          2HB       LEU  28  -4.095   1.310  -1.394
  204   2HB   LEU  28          3HB       LEU  28  -2.885   2.579  -1.451
  205    HG   LEU  28           HG       LEU  28  -4.260   1.769   1.126
  206   1HD1  LEU  28          1HD1      LEU  28  -3.291  -0.201   0.116
  207   2HD1  LEU  28          2HD1      LEU  28  -1.764   0.656  -0.198
  208   3HD1  LEU  28          3HD1      LEU  28  -2.267   0.303   1.467
  209   1HD2  LEU  28          1HD2      LEU  28  -2.067   2.702   2.035
  210   2HD2  LEU  28          2HD2      LEU  28  -1.685   3.258   0.402
  211   3HD2  LEU  28          3HD2      LEU  28  -3.094   3.899   1.277
  212    H    LYS  29           H        LYS  29  -3.196   4.952  -1.821
  213    HA   LYS  29           HA       LYS  29  -2.891   6.663   0.285
  214   1HB   LYS  29          2HB       LYS  29  -1.682   6.442  -2.001
  215   2HB   LYS  29          3HB       LYS  29  -2.867   7.591  -2.601
  216   1HG   LYS  29          2HG       LYS  29  -1.694   8.656  -0.168
  217   2HG   LYS  29          3HG       LYS  29  -0.435   7.882  -1.097
  218   1HD   LYS  29          2HD       LYS  29  -0.457  10.144  -1.966
  219   2HD   LYS  29          3HD       LYS  29  -1.215   9.140  -3.174
  220   1HE   LYS  29          2HE       LYS  29  -2.304  11.294  -2.683
  221   2HE   LYS  29          3HE       LYS  29  -3.406   9.909  -2.493
  222   1HZ   LYS  29          1HZ       LYS  29  -1.974  11.128  -0.225
  223   2HZ   LYS  29          2HZ       LYS  29  -3.480  11.639  -0.670
  224   3HZ   LYS  29          3HZ       LYS  29  -3.270  10.096  -0.154
  225    H    ARG  30           H        ARG  30  -5.678   6.491  -1.715
  226    HA   ARG  30           HA       ARG  30  -6.681   9.168  -1.308
  227   1HB   ARG  30          2HB       ARG  30  -7.349   6.826  -2.838
  228   2HB   ARG  30          3HB       ARG  30  -8.770   7.227  -1.887
  229   1HG   ARG  30          2HG       ARG  30  -7.228   9.196  -3.649
  230   2HG   ARG  30          3HG       ARG  30  -8.618   8.235  -4.177
  231   1HD   ARG  30          2HD       ARG  30  -9.964   9.247  -2.299
  232   2HD   ARG  30          3HD       ARG  30  -8.622  10.376  -2.007
  233    HE   ARG  30           HE       ARG  30  -9.168  10.531  -4.742
  234   1HH1  ARG  30          2HH2      ARG  30 -10.864  11.217  -1.738
  235   2HH1  ARG  30          1HH2      ARG  30 -12.029  12.299  -2.437
  236   1HH2  ARG  30          2HH1      ARG  30 -10.702  11.952  -5.735
  237   2HH2  ARG  30          1HH1      ARG  30 -11.909  12.742  -4.778
  238    H    MET  31           H        MET  31  -6.513   6.427   0.808
  239    HA   MET  31           HA       MET  31  -8.962   6.818   2.240
  240   1HB   MET  31          2HB       MET  31  -8.039   5.193   3.788
  241   2HB   MET  31          3HB       MET  31  -7.515   4.766   2.167
  242   1HG   MET  31          2HG       MET  31  -5.302   5.798   2.631
  243   2HG   MET  31          3HG       MET  31  -5.829   6.268   4.226
  244   1HE   MET  31          1HE       MET  31  -5.524   1.839   3.208
  245   2HE   MET  31          2HE       MET  31  -7.084   2.658   3.368
  246   3HE   MET  31          3HE       MET  31  -5.953   3.092   2.032
  247    HA   PRO  32           HA       PRO  32  -7.696  10.117   5.101
  248   1HB   PRO  32          2HB       PRO  32  -8.706   9.268   7.512
  249   2HB   PRO  32          3HB       PRO  32  -9.723   9.930   6.204
  250   1HG   PRO  32          2HG       PRO  32  -9.169   7.020   6.831
  251   2HG   PRO  32          3HG       PRO  32 -10.760   7.794   6.572
  252   1HD   PRO  32          2HD       PRO  32  -9.529   6.477   4.585
  253   2HD   PRO  32          3HD       PRO  32 -10.358   8.009   4.227
  254    H    GLY  33           H        GLY  33  -5.734  10.419   6.173
  255   1HA   GLY  33          2HA       GLY  33  -4.162   9.912   7.728
  256   2HA   GLY  33          3HA       GLY  33  -4.421   8.172   7.552
  257    H    VAL  34           H        VAL  34  -4.148   7.750   4.824
  258    HA   VAL  34           HA       VAL  34  -1.266   7.861   4.693
  259    HB   VAL  34           HB       VAL  34  -3.225   6.889   2.612
  260   1HG1  VAL  34          1HG1      VAL  34  -0.205   6.490   2.941
  261   2HG1  VAL  34          2HG1      VAL  34  -1.222   5.618   1.777
  262   3HG1  VAL  34          3HG1      VAL  34  -0.988   7.360   1.623
  263   1HG2  VAL  34          1HG2      VAL  34  -2.692   4.665   3.505
  264   2HG2  VAL  34          2HG2      VAL  34  -1.610   5.347   4.706
  265   3HG2  VAL  34          3HG2      VAL  34  -3.326   5.688   4.819
  266    H    THR  35           H        THR  35  -0.126   9.609   4.145
  267    HA   THR  35           HA       THR  35  -1.360  11.649   2.464
  268    HB   THR  35           HB       THR  35   0.579  11.690   4.494
  269    HG1  THR  35           1HG      THR  35  -0.191  13.797   2.792
  270   1HG2  THR  35          1HG2      THR  35   1.758  12.735   1.872
  271   2HG2  THR  35          2HG2      THR  35   2.336  13.126   3.492
  272   3HG2  THR  35          3HG2      THR  35   2.434  11.456   2.918
  273    H    ASP  36           H        ASP  36   1.400   9.255   2.109
  274    HA   ASP  36           HA       ASP  36   1.087   9.495  -0.792
  275   1HB   ASP  36          2HB       ASP  36   3.504  10.394   0.720
  276   2HB   ASP  36          3HB       ASP  36   3.735   9.479  -0.771
  277    H    ALA  37           H        ALA  37   1.967   7.810  -1.940
  278    HA   ALA  37           HA       ALA  37   3.007   5.484  -0.460
  279   1HB   ALA  37          1HB       ALA  37   1.202   3.970  -1.015
  280   2HB   ALA  37          2HB       ALA  37   0.488   5.380  -0.211
  281   3HB   ALA  37          3HB       ALA  37   0.384   5.221  -1.976
  282    H    ASN  38           H        ASN  38   3.927   3.775  -1.761
  283    HA   ASN  38           HA       ASN  38   4.364   4.374  -4.608
  284   1HB   ASN  38          2HB       ASN  38   6.990   4.210  -3.544
  285   2HB   ASN  38          3HB       ASN  38   6.213   5.574  -4.325
  286   1HD2  ASN  38          1HD2      ASN  38   5.838   4.139  -0.992
  287   2HD2  ASN  38          2HD2      ASN  38   6.292   5.644  -0.197
  288    H    VAL  39           H        VAL  39   4.568   2.442  -5.594
  289    HA   VAL  39           HA       VAL  39   5.008   0.059  -3.961
  290    HB   VAL  39           HB       VAL  39   3.074   0.438  -5.474
  291   1HG1  VAL  39          1HG1      VAL  39   3.223   0.050  -7.836
  292   2HG1  VAL  39          2HG1      VAL  39   4.320   1.379  -7.454
  293   3HG1  VAL  39          3HG1      VAL  39   4.939  -0.257  -7.783
  294   1HG2  VAL  39          1HG2      VAL  39   2.752  -1.740  -5.457
  295   2HG2  VAL  39          2HG2      VAL  39   4.117  -2.048  -6.542
  296   3HG2  VAL  39          3HG2      VAL  39   4.373  -1.906  -4.784
  297    H    ASN  40           H        ASN  40   7.142  -0.639  -3.717
  298    HA   ASN  40           HA       ASN  40   9.137   0.211  -5.743
  299   1HB   ASN  40          2HB       ASN  40   9.521   0.708  -3.341
  300   2HB   ASN  40          3HB       ASN  40   9.574  -1.030  -3.013
  301   1HD2  ASN  40          1HD2      ASN  40  11.805   0.104  -2.253
  302   2HD2  ASN  40          2HD2      ASN  40  13.092  -0.034  -3.441
  303    H    LEU  41           H        LEU  41   7.623  -1.362  -6.953
  304    HA   LEU  41           HA       LEU  41   7.927  -4.179  -6.534
  305   1HB   LEU  41          2HB       LEU  41   6.431  -2.411  -8.257
  306   2HB   LEU  41          3HB       LEU  41   7.201  -3.600  -9.282
  307    HG   LEU  41           HG       LEU  41   4.887  -4.090  -8.430
  308   1HD1  LEU  41          1HD1      LEU  41   6.407  -6.469  -7.497
  309   2HD1  LEU  41          2HD1      LEU  41   5.225  -6.280  -8.797
  310   3HD1  LEU  41          3HD1      LEU  41   6.912  -5.841  -9.068
  311   1HD2  LEU  41          1HD2      LEU  41   5.939  -5.130  -5.818
  312   2HD2  LEU  41          2HD2      LEU  41   5.729  -3.395  -5.963
  313   3HD2  LEU  41          3HD2      LEU  41   4.353  -4.469  -6.263
  314    H    ALA  42           H        ALA  42   9.968  -1.888  -8.066
  315    HA   ALA  42           HA       ALA  42  11.644  -3.410  -9.695
  316   1HB   ALA  42          1HB       ALA  42  12.498  -1.471  -7.512
  317   2HB   ALA  42          2HB       ALA  42  13.440  -1.946  -8.934
  318   3HB   ALA  42          3HB       ALA  42  11.953  -0.984  -9.141
  319    H    THR  43           H        THR  43  11.293  -3.508  -6.126
  320    HA   THR  43           HA       THR  43  12.956  -5.976  -6.147
  321    HB   THR  43           HB       THR  43  14.357  -4.316  -5.174
  322    HG1  THR  43           1HG      THR  43  13.108  -5.942  -3.239
  323   1HG2  THR  43          1HG2      THR  43  11.987  -3.554  -3.424
  324   2HG2  THR  43          2HG2      THR  43  13.664  -3.072  -3.098
  325   3HG2  THR  43          3HG2      THR  43  12.870  -2.544  -4.589
  326    H    GLU  44           H        GLU  44  10.154  -5.732  -6.596
  327    HA   GLU  44           HA       GLU  44   8.131  -6.481  -5.915
  328   1HB   GLU  44          2HB       GLU  44  10.016  -8.488  -4.599
  329   2HB   GLU  44          3HB       GLU  44   8.281  -8.739  -4.828
  330   1HG   GLU  44          2HG       GLU  44   8.519  -8.452  -7.273
  331   2HG   GLU  44          3HG       GLU  44  10.273  -8.281  -7.075
  332    H    THR  45           H        THR  45   9.227  -4.360  -4.006
  333    HA   THR  45           HA       THR  45   7.878  -5.196  -1.493
  334    HB   THR  45           HB       THR  45   9.930  -2.990  -1.914
  335    HG1  THR  45           1HG      THR  45  10.537  -5.473  -2.270
  336   1HG2  THR  45          1HG2      THR  45  10.396  -3.386   0.469
  337   2HG2  THR  45          2HG2      THR  45   8.692  -2.948   0.240
  338   3HG2  THR  45          3HG2      THR  45   9.155  -4.655   0.497
  339    H    VAL  46           H        VAL  46   6.706  -3.337  -0.416
  340    HA   VAL  46           HA       VAL  46   5.899  -1.111  -2.232
  341    HB   VAL  46           HB       VAL  46   4.074  -2.618  -2.378
  342   1HG1  VAL  46          1HG1      VAL  46   4.188  -2.820   0.655
  343   2HG1  VAL  46          2HG1      VAL  46   2.869  -3.451  -0.347
  344   3HG1  VAL  46          3HG1      VAL  46   4.489  -4.141  -0.499
  345   1HG2  VAL  46          1HG2      VAL  46   2.269  -1.414  -1.317
  346   2HG2  VAL  46          2HG2      VAL  46   3.364  -0.567  -0.231
  347   3HG2  VAL  46          3HG2      VAL  46   3.459  -0.267  -1.984
  348    H    ASN  47           H        ASN  47   5.564   0.912  -1.188
  349    HA   ASN  47           HA       ASN  47   6.229   0.995   1.697
  350   1HB   ASN  47          2HB       ASN  47   7.409   2.616  -0.604
  351   2HB   ASN  47          3HB       ASN  47   7.435   3.183   1.070
  352   1HD2  ASN  47          1HD2      ASN  47   8.323   1.480   2.718
  353   2HD2  ASN  47          2HD2      ASN  47   9.865   0.815   2.195
  354    H    VAL  48           H        VAL  48   4.935   2.462   2.839
  355    HA   VAL  48           HA       VAL  48   3.013   4.082   1.269
  356    HB   VAL  48           HB       VAL  48   2.256   2.284   3.595
  357   1HG1  VAL  48          1HG1      VAL  48   0.575   4.000   1.716
  358   2HG1  VAL  48          2HG1      VAL  48  -0.013   3.033   3.076
  359   3HG1  VAL  48          3HG1      VAL  48   0.991   4.459   3.376
  360   1HG2  VAL  48          1HG2      VAL  48   2.589   0.877   1.622
  361   2HG2  VAL  48          2HG2      VAL  48   0.860   1.075   1.928
  362   3HG2  VAL  48          3HG2      VAL  48   1.635   1.998   0.626
  363    H    ILE  49           H        ILE  49   3.084   6.111   2.019
  364    HA   ILE  49           HA       ILE  49   4.775   6.644   4.361
  365    HB   ILE  49           HB       ILE  49   3.964   8.577   2.154
  366   1HG1  ILE  49          2HG1      ILE  49   5.104   6.906   0.952
  367   2HG1  ILE  49          3HG1      ILE  49   6.201   8.262   1.182
  368   1HG2  ILE  49          1HG2      ILE  49   5.932   9.844   2.951
  369   2HG2  ILE  49          2HG2      ILE  49   4.691   9.655   4.195
  370   3HG2  ILE  49          3HG2      ILE  49   6.154   8.662   4.260
  371   1HD1  ILE  49          1HD1      ILE  49   7.460   6.239   1.523
  372   2HD1  ILE  49          2HD1      ILE  49   7.259   7.014   3.098
  373   3HD1  ILE  49          3HD1      ILE  49   6.272   5.600   2.670
  374    H    TYR  50           H        TYR  50   3.312   6.700   6.097
  375    HA   TYR  50           HA       TYR  50   0.788   8.276   5.761
  376   1HB   TYR  50          2HB       TYR  50  -0.580   6.541   6.513
  377   2HB   TYR  50          3HB       TYR  50   0.382   5.928   5.189
  378    HD1  TYR  50           HD1      TYR  50   1.696   3.919   5.476
  379    HD2  TYR  50           HD2      TYR  50  -0.057   5.865   8.895
  380    HE1  TYR  50           HE1      TYR  50   1.894   1.838   6.794
  381    HE2  TYR  50           HE2      TYR  50   0.576   3.959  10.307
  382    HH   TYR  50           HH       TYR  50   1.389   1.781  10.315
  383    H    ASP  51           H        ASP  51  -0.458   8.279   7.854
  384    HA   ASP  51           HA       ASP  51   1.445   9.317   9.818
  385   1HB   ASP  51          2HB       ASP  51  -0.429  10.546  10.685
  386   2HB   ASP  51          3HB       ASP  51  -0.197  10.818   8.959
  387    HA   PRO  52           HA       PRO  52   0.353   5.609  12.221
  388   1HB   PRO  52          2HB       PRO  52   2.258   5.705  14.146
  389   2HB   PRO  52          3HB       PRO  52   2.583   5.208  12.461
  390   1HG   PRO  52          2HG       PRO  52   2.978   7.963  13.669
  391   2HG   PRO  52          3HG       PRO  52   4.173   7.005  12.744
  392   1HD   PRO  52          2HD       PRO  52   2.649   8.920  11.590
  393   2HD   PRO  52          3HD       PRO  52   3.027   7.415  10.697
  394    H    ALA  53           H        ALA  53  -0.602   8.667  12.661
  395    HA   ALA  53           HA       ALA  53  -1.554   8.377  15.448
  396   1HB   ALA  53          1HB       ALA  53  -0.420  10.502  14.909
  397   2HB   ALA  53          2HB       ALA  53  -1.533  10.755  13.543
  398   3HB   ALA  53          3HB       ALA  53  -2.155  10.744  15.207
  399    H    GLU  54           H        GLU  54  -2.478   8.366  11.981
  400    HA   GLU  54           HA       GLU  54  -5.315   8.124  12.827
  401   1HB   GLU  54          2HB       GLU  54  -4.600  10.247  11.469
  402   2HB   GLU  54          3HB       GLU  54  -4.609   9.137  10.087
  403   1HG   GLU  54          2HG       GLU  54  -6.956   8.584  10.509
  404   2HG   GLU  54          3HG       GLU  54  -6.954   9.601  11.964
  405    H    THR  55           H        THR  55  -2.976   7.254  10.196
  406    HA   THR  55           HA       THR  55  -4.204   4.595  10.188
  407    HB   THR  55           HB       THR  55  -2.515   4.230   8.160
  408    HG1  THR  55           1HG      THR  55  -2.695   6.998   8.441
  409   1HG2  THR  55          1HG2      THR  55  -4.911   3.854   8.247
  410   2HG2  THR  55          2HG2      THR  55  -5.228   5.615   8.140
  411   3HG2  THR  55          3HG2      THR  55  -4.457   4.756   6.784
  412    H    GLY  56           H        GLY  56  -2.347   2.963   9.635
  413   1HA   GLY  56          2HA       GLY  56  -0.578   2.034  11.453
  414   2HA   GLY  56          3HA       GLY  56  -1.982   2.443  12.463
  415    H    THR  57           H        THR  57  -0.943   0.727   9.846
  416    HA   THR  57           HA       THR  57  -1.715  -0.177   8.080
  417    HB   THR  57           HB       THR  57  -1.294  -2.650   8.364
  418    HG1  THR  57           1HG      THR  57  -2.094  -2.921  10.470
  419   1HG2  THR  57          1HG2      THR  57   0.579  -1.008   8.053
  420   2HG2  THR  57          2HG2      THR  57   0.707  -0.876   9.825
  421   3HG2  THR  57          3HG2      THR  57   1.020  -2.422   9.029
  422    H    ALA  58           H        ALA  58  -3.935  -0.783  10.634
  423    HA   ALA  58           HA       ALA  58  -6.000  -2.252   9.848
  424   1HB   ALA  58          1HB       ALA  58  -5.897  -0.662  11.727
  425   2HB   ALA  58          2HB       ALA  58  -5.943   0.688  10.591
  426   3HB   ALA  58          3HB       ALA  58  -7.374  -0.369  10.764
  427    H    ALA  59           H        ALA  59  -5.371   0.949   8.395
  428    HA   ALA  59           HA       ALA  59  -7.883   0.587   6.826
  429   1HB   ALA  59          1HB       ALA  59  -7.263   2.819   7.742
  430   2HB   ALA  59          2HB       ALA  59  -5.875   2.823   6.621
  431   3HB   ALA  59          3HB       ALA  59  -7.532   2.808   5.986
  432    H    ILE  60           H        ILE  60  -4.432   0.529   6.393
  433    HA   ILE  60           HA       ILE  60  -4.190   0.213   3.580
  434    HB   ILE  60           HB       ILE  60  -2.543  -0.286   6.026
  435   1HG1  ILE  60          2HG1      ILE  60  -1.890   1.098   3.471
  436   2HG1  ILE  60          3HG1      ILE  60  -3.032   1.875   4.557
  437   1HG2  ILE  60          1HG2      ILE  60  -0.638  -1.008   4.663
  438   2HG2  ILE  60          2HG2      ILE  60  -1.896  -2.240   4.748
  439   3HG2  ILE  60          3HG2      ILE  60  -1.718  -1.266   3.270
  440   1HD1  ILE  60          1HD1      ILE  60  -0.159   1.192   5.286
  441   2HD1  ILE  60          2HD1      ILE  60  -0.900   2.802   5.128
  442   3HD1  ILE  60          3HD1      ILE  60  -1.395   1.740   6.445
  443    H    GLN  61           H        GLN  61  -4.433  -2.367   6.119
  444    HA   GLN  61           HA       GLN  61  -4.413  -4.421   4.121
  445   1HB   GLN  61          2HB       GLN  61  -4.784  -4.286   7.016
  446   2HB   GLN  61          3HB       GLN  61  -5.960  -5.360   6.253
  447   1HG   GLN  61          2HG       GLN  61  -4.381  -6.899   6.581
  448   2HG   GLN  61          3HG       GLN  61  -3.840  -6.366   4.995
  449   1HE2  GLN  61          1HE2      GLN  61  -2.619  -3.848   5.851
  450   2HE2  GLN  61          2HE2      GLN  61  -1.218  -4.291   6.823
  451    H    GLU  62           H        GLU  62  -7.130  -2.715   5.790
  452    HA   GLU  62           HA       GLU  62  -9.305  -3.984   4.592
  453   1HB   GLU  62          2HB       GLU  62  -8.751  -1.218   5.674
  454   2HB   GLU  62          3HB       GLU  62 -10.197  -1.419   4.703
  455   1HG   GLU  62          2HG       GLU  62 -10.840  -3.366   6.206
  456   2HG   GLU  62          3HG       GLU  62  -9.505  -2.874   7.270
  457    H    LYS  63           H        LYS  63  -7.682  -1.019   3.308
  458    HA   LYS  63           HA       LYS  63  -9.218  -1.061   0.913
  459   1HB   LYS  63          2HB       LYS  63  -6.897   0.436   2.040
  460   2HB   LYS  63          3HB       LYS  63  -7.127   0.501   0.332
  461   1HG   LYS  63          2HG       LYS  63  -9.362   1.078   2.354
  462   2HG   LYS  63          3HG       LYS  63  -8.321   2.338   1.707
  463   1HD   LYS  63          2HD       LYS  63 -10.267   0.728   0.036
  464   2HD   LYS  63          3HD       LYS  63 -10.381   2.414   0.564
  465   1HE   LYS  63          2HE       LYS  63  -7.943   2.563  -0.551
  466   2HE   LYS  63          3HE       LYS  63  -8.522   1.181  -1.489
  467   1HZ   LYS  63          1HZ       LYS  63 -10.231   2.587  -2.359
  468   2HZ   LYS  63          2HZ       LYS  63  -9.877   3.791  -1.273
  469   3HZ   LYS  63          3HZ       LYS  63  -8.784   3.415  -2.419
  470    H    ILE  64           H        ILE  64  -6.042  -2.517   1.768
  471    HA   ILE  64           HA       ILE  64  -5.017  -3.078  -0.722
  472    HB   ILE  64           HB       ILE  64  -4.848  -4.141   2.001
  473   1HG1  ILE  64          2HG1      ILE  64  -3.383  -2.393   0.920
  474   2HG1  ILE  64          3HG1      ILE  64  -2.589  -3.721   1.754
  475   1HG2  ILE  64          1HG2      ILE  64  -5.177  -6.256   1.203
  476   2HG2  ILE  64          2HG2      ILE  64  -4.172  -5.969  -0.243
  477   3HG2  ILE  64          3HG2      ILE  64  -3.441  -6.049   1.381
  478   1HD1  ILE  64          1HD1      ILE  64  -1.455  -3.270  -0.336
  479   2HD1  ILE  64          2HD1      ILE  64  -2.212  -4.874  -0.399
  480   3HD1  ILE  64          3HD1      ILE  64  -2.952  -3.518  -1.264
  481    H    GLU  65           H        GLU  65  -7.238  -5.036   1.374
  482    HA   GLU  65           HA       GLU  65  -7.968  -7.040  -0.504
  483   1HB   GLU  65          2HB       GLU  65  -9.279  -5.900   1.985
  484   2HB   GLU  65          3HB       GLU  65 -10.078  -7.146   1.022
  485   1HG   GLU  65          2HG       GLU  65  -7.221  -7.652   1.819
  486   2HG   GLU  65          3HG       GLU  65  -8.483  -7.777   3.051
  487    H    LYS  66           H        LYS  66  -9.730  -4.004   0.378
  488    HA   LYS  66           HA       LYS  66 -11.776  -4.431  -1.507
  489   1HB   LYS  66          2HB       LYS  66 -10.990  -2.290   0.265
  490   2HB   LYS  66          3HB       LYS  66 -11.450  -1.578  -1.272
  491   1HG   LYS  66          2HG       LYS  66 -13.087  -3.536   0.388
  492   2HG   LYS  66          3HG       LYS  66 -13.304  -1.794   0.386
  493   1HD   LYS  66          2HD       LYS  66 -13.853  -3.670  -1.981
  494   2HD   LYS  66          3HD       LYS  66 -15.013  -2.919  -0.905
  495   1HE   LYS  66          2HE       LYS  66 -15.202  -1.434  -2.605
  496   2HE   LYS  66          3HE       LYS  66 -13.906  -0.635  -1.711
  497   1HZ   LYS  66          1HZ       LYS  66 -13.349  -0.751  -4.020
  498   2HZ   LYS  66          2HZ       LYS  66 -12.373  -1.872  -3.293
  499   3HZ   LYS  66          3HZ       LYS  66 -13.670  -2.360  -4.103
  500    H    LEU  67           H        LEU  67  -8.565  -3.154  -2.109
  501    HA   LEU  67           HA       LEU  67  -9.140  -2.145  -4.779
  502   1HB   LEU  67          2HB       LEU  67  -6.595  -2.733  -3.253
  503   2HB   LEU  67          3HB       LEU  67  -6.602  -2.111  -4.903
  504    HG   LEU  67           HG       LEU  67  -8.203  -0.684  -2.761
  505   1HD1  LEU  67          1HD1      LEU  67  -5.902  -0.926  -1.854
  506   2HD1  LEU  67          2HD1      LEU  67  -5.264  -0.233  -3.341
  507   3HD1  LEU  67          3HD1      LEU  67  -6.280   0.751  -2.280
  508   1HD2  LEU  67          1HD2      LEU  67  -7.715   1.289  -4.181
  509   2HD2  LEU  67          2HD2      LEU  67  -6.853   0.246  -5.328
  510   3HD2  LEU  67          3HD2      LEU  67  -8.594   0.035  -5.069
  511    H    GLY  68           H        GLY  68  -8.700  -5.281  -3.408
  512   1HA   GLY  68          2HA       GLY  68  -8.985  -7.292  -4.492
  513   2HA   GLY  68          3HA       GLY  68  -8.713  -6.538  -6.070
  514    H    TYR  69           H        TYR  69  -6.660  -6.297  -3.084
  515    HA   TYR  69           HA       TYR  69  -4.529  -7.889  -4.428
  516   1HB   TYR  69          2HB       TYR  69  -4.584  -5.029  -3.946
  517   2HB   TYR  69          3HB       TYR  69  -3.363  -5.750  -2.921
  518    HD1  TYR  69           HD1      TYR  69  -1.272  -6.463  -3.850
  519    HD2  TYR  69           HD2      TYR  69  -4.640  -5.718  -6.435
  520    HE1  TYR  69           HE1      TYR  69   0.234  -6.246  -5.752
  521    HE2  TYR  69           HE2      TYR  69  -3.156  -5.587  -8.354
  522    HH   TYR  69           HH       TYR  69  -0.957  -5.322  -9.021
  523    H    HIS  70           H        HIS  70  -2.691  -8.180  -2.734
  524    HA   HIS  70           HA       HIS  70  -3.633  -8.262   0.024
  525   1HB   HIS  70          2HB       HIS  70  -3.907 -10.569  -1.423
  526   2HB   HIS  70          3HB       HIS  70  -2.248 -10.765  -0.866
  527    HD1  HIS  70           1HD      HIS  70  -4.883 -12.480   0.050
  528    HD2  HIS  70           2HD      HIS  70  -3.042  -9.336   2.157
  529    HE1  HIS  70           1HE      HIS  70  -5.504 -12.770   2.506
  530    H    VAL  71           H        VAL  71  -1.904  -7.871   1.416
  531    HA   VAL  71           HA       VAL  71   0.797  -7.578   0.230
  532    HB   VAL  71           HB       VAL  71  -0.366  -5.434   0.614
  533   1HG1  VAL  71          1HG1      VAL  71  -0.065  -6.046   3.601
  534   2HG1  VAL  71          2HG1      VAL  71  -0.707  -4.569   2.878
  535   3HG1  VAL  71          3HG1      VAL  71  -1.622  -6.082   2.752
  536   1HG2  VAL  71          1HG2      VAL  71   1.458  -4.318   1.847
  537   2HG2  VAL  71          2HG2      VAL  71   2.104  -5.932   2.227
  538   3HG2  VAL  71          3HG2      VAL  71   1.967  -5.383   0.534
  539    H    VAL  72           H        VAL  72   2.400  -8.549   1.364
  540    HA   VAL  72           HA       VAL  72   1.686 -10.253   3.681
  541    HB   VAL  72           HB       VAL  72   3.986 -10.451   1.804
  542   1HG1  VAL  72          1HG1      VAL  72   2.963 -12.351   3.955
  543   2HG1  VAL  72          2HG1      VAL  72   4.225 -12.751   2.772
  544   3HG1  VAL  72          3HG1      VAL  72   4.513 -11.479   3.961
  545   1HG2  VAL  72          1HG2      VAL  72   2.768 -12.460   0.893
  546   2HG2  VAL  72          2HG2      VAL  72   1.372 -12.032   1.904
  547   3HG2  VAL  72          3HG2      VAL  72   1.890 -10.956   0.589
  548    H    ILE  73           H        ILE  73   2.909 -10.144   5.500
  549    HA   ILE  73           HA       ILE  73   4.400  -7.590   5.923
  550    HB   ILE  73           HB       ILE  73   3.193  -9.384   8.007
  551   1HG1  ILE  73          2HG1      ILE  73   1.319  -8.666   6.722
  552   2HG1  ILE  73          3HG1      ILE  73   1.416  -7.664   8.165
  553   1HG2  ILE  73          1HG2      ILE  73   5.095  -7.692   8.551
  554   2HG2  ILE  73          2HG2      ILE  73   3.911  -6.435   8.228
  555   3HG2  ILE  73          3HG2      ILE  73   3.609  -7.621   9.515
  556   1HD1  ILE  73          1HD1      ILE  73   0.774  -6.342   6.224
  557   2HD1  ILE  73          2HD1      ILE  73   2.337  -5.786   6.824
  558   3HD1  ILE  73          3HD1      ILE  73   2.247  -6.791   5.361
  559    H    GLU  74           H        GLU  74   6.134  -8.860   4.686
  560    HA   GLU  74           HA       GLU  74   7.917 -10.130   6.537
  561   1HB   GLU  74          2HB       GLU  74   7.105 -10.806   3.754
  562   2HB   GLU  74          3HB       GLU  74   8.794 -11.015   4.194
  563   1HG   GLU  74          2HG       GLU  74   6.603 -12.229   5.909
  564   2HG   GLU  74          3HG       GLU  74   7.267 -13.070   4.497
  565    H    GLY  75           H        GLY  75   7.323  -7.330   5.252
  566   1HA   GLY  75          2HA       GLY  75   9.908  -6.688   3.984
  567   2HA   GLY  75          3HA       GLY  75   8.535  -5.609   4.180
  568    H    ARG  76           H        ARG  76   8.043  -5.613   6.898
  569    HA   ARG  76           HA       ARG  76  10.420  -4.974   8.429
  570   1HB   ARG  76          2HB       ARG  76  10.066  -3.115   6.705
  571   2HB   ARG  76          3HB       ARG  76   8.505  -2.791   7.452
  572   1HG   ARG  76          2HG       ARG  76  11.270  -2.509   8.738
  573   2HG   ARG  76          3HG       ARG  76  10.292  -1.220   8.042
  574   1HD   ARG  76          2HD       ARG  76   9.685  -0.888  10.200
  575   2HD   ARG  76          3HD       ARG  76   8.457  -2.101   9.754
  576    HE   ARG  76           HE       ARG  76  10.699  -3.517  10.648
  577   1HH1  ARG  76          2HH2      ARG  76   7.925  -1.794  11.782
  578   2HH1  ARG  76          1HH2      ARG  76   7.958  -2.429  13.400
  579   1HH2  ARG  76          2HH1      ARG  76  10.919  -4.305  12.786
  580   2HH2  ARG  76          1HH1      ARG  76   9.735  -3.904  13.990
  Start of MODEL    5
    1   1H    MET   1          H1        MET   1   4.571  19.511  12.163
    2   2H    MET   1          H2        MET   1   4.359  21.018  11.471
    3   3H    MET   1          H3        MET   1   4.419  20.810  13.133
    4    HA   MET   1           HA       MET   1   2.151  21.037  12.658
    5   1HB   MET   1          2HB       MET   1   2.931  19.263  10.334
    6   2HB   MET   1          3HB       MET   1   1.289  19.155  10.957
    7   1HG   MET   1          2HG       MET   1   1.361  20.647   9.115
    8   2HG   MET   1          3HG       MET   1   0.890  21.532  10.558
    9   1HE   MET   1          1HE       MET   1   3.442  24.316  10.764
   10   2HE   MET   1          2HE       MET   1   1.764  23.797  11.016
   11   3HE   MET   1          3HE       MET   1   3.085  23.050  11.950
   12    H    LEU   2           H        LEU   2   0.428  19.263  13.062
   13    HA   LEU   2           HA       LEU   2   1.463  17.172  14.887
   14   1HB   LEU   2          2HB       LEU   2  -0.828  16.764  15.442
   15   2HB   LEU   2          3HB       LEU   2  -0.472  18.461  15.711
   16    HG   LEU   2           HG       LEU   2  -1.704  17.717  13.044
   17   1HD1  LEU   2          1HD1      LEU   2  -3.258  17.751  15.654
   18   2HD1  LEU   2          2HD1      LEU   2  -3.954  17.688  14.019
   19   3HD1  LEU   2          3HD1      LEU   2  -2.979  16.337  14.612
   20   1HD2  LEU   2          1HD2      LEU   2  -2.943  19.810  13.404
   21   2HD2  LEU   2          2HD2      LEU   2  -2.221  19.991  15.013
   22   3HD2  LEU   2          3HD2      LEU   2  -1.213  20.116  13.560
   23    H    SER   3           H        SER   3   0.263  14.997  14.450
   24    HA   SER   3           HA       SER   3  -0.117  13.208  13.127
   25   1HB   SER   3          2HB       SER   3   0.050  14.582  10.470
   26   2HB   SER   3          3HB       SER   3  -0.995  13.284  11.030
   27    HG   SER   3           HG       SER   3  -1.164  16.052  11.510
   28    H    GLU   4           H        GLU   4   1.903  12.321  13.762
   29    HA   GLU   4           HA       GLU   4   4.387  13.078  12.452
   30   1HB   GLU   4          2HB       GLU   4   3.502  10.845  14.217
   31   2HB   GLU   4          3HB       GLU   4   5.143  11.063  13.673
   32   1HG   GLU   4          2HG       GLU   4   5.585  12.746  15.080
   33   2HG   GLU   4          3HG       GLU   4   3.961  13.428  14.985
   34    H    GLN   5           H        GLN   5   5.420  11.545  10.981
   35    HA   GLN   5           HA       GLN   5   3.520   9.786   9.492
   36   1HB   GLN   5          2HB       GLN   5   5.613  11.681   8.388
   37   2HB   GLN   5          3HB       GLN   5   4.829  10.414   7.469
   38   1HG   GLN   5          2HG       GLN   5   2.725  11.860   8.786
   39   2HG   GLN   5          3HG       GLN   5   3.831  13.080   8.172
   40   1HE2  GLN   5          1HE2      GLN   5   2.850   9.853   6.924
   41   2HE2  GLN   5          2HE2      GLN   5   2.258  10.429   5.379
   42    H    LYS   6           H        LYS   6   4.362   7.900   8.612
   43    HA   LYS   6           HA       LYS   6   7.212   7.470   8.760
   44   1HB   LYS   6          2HB       LYS   6   5.314   5.600  10.229
   45   2HB   LYS   6          3HB       LYS   6   6.912   5.120   9.670
   46   1HG   LYS   6          2HG       LYS   6   7.678   7.362  10.969
   47   2HG   LYS   6          3HG       LYS   6   6.168   7.073  11.823
   48   1HD   LYS   6          2HD       LYS   6   7.618   5.888  13.146
   49   2HD   LYS   6          3HD       LYS   6   7.169   4.586  12.049
   50   1HE   LYS   6          2HE       LYS   6   9.666   6.383  11.929
   51   2HE   LYS   6          3HE       LYS   6   9.623   4.695  12.447
   52   1HZ   LYS   6          1HZ       LYS   6  10.432   4.864  10.213
   53   2HZ   LYS   6          2HZ       LYS   6   8.963   4.137  10.134
   54   3HZ   LYS   6          3HZ       LYS   6   9.173   5.703   9.690
   55    H    GLU   7           H        GLU   7   7.932   5.696   7.686
   56    HA   GLU   7           HA       GLU   7   6.594   5.154   5.129
   57   1HB   GLU   7          2HB       GLU   7   9.507   4.614   5.435
   58   2HB   GLU   7          3HB       GLU   7   8.625   5.468   4.197
   59   1HG   GLU   7          2HG       GLU   7  10.063   7.042   5.073
   60   2HG   GLU   7          3HG       GLU   7   8.561   7.467   5.893
   61    H    ILE   8           H        ILE   8   5.576   3.095   5.506
   62    HA   ILE   8           HA       ILE   8   7.071   1.085   7.037
   63    HB   ILE   8           HB       ILE   8   4.466   0.806   5.655
   64   1HG1  ILE   8          2HG1      ILE   8   3.972   2.743   6.899
   65   2HG1  ILE   8          3HG1      ILE   8   3.239   1.309   7.638
   66   1HG2  ILE   8          1HG2      ILE   8   4.137  -0.778   7.606
   67   2HG2  ILE   8          2HG2      ILE   8   5.385  -1.217   6.419
   68   3HG2  ILE   8          3HG2      ILE   8   5.856  -0.470   7.969
   69   1HD1  ILE   8          1HD1      ILE   8   5.825   2.535   8.533
   70   2HD1  ILE   8          2HD1      ILE   8   4.231   2.786   9.307
   71   3HD1  ILE   8          3HD1      ILE   8   4.967   1.158   9.267
   72    H    ALA   9           H        ALA   9   7.459  -1.010   5.913
   73    HA   ALA   9           HA       ALA   9   7.571  -0.884   2.953
   74   1HB   ALA   9          1HB       ALA   9   9.635  -2.206   3.020
   75   2HB   ALA   9          2HB       ALA   9   9.893  -0.656   3.848
   76   3HB   ALA   9          3HB       ALA   9   9.657  -2.135   4.794
   77    H    MET  10           H        MET  10   6.600  -2.748   2.071
   78    HA   MET  10           HA       MET  10   6.351  -5.145   3.785
   79   1HB   MET  10          2HB       MET  10   3.918  -3.891   2.447
   80   2HB   MET  10          3HB       MET  10   4.000  -5.430   3.313
   81   1HG   MET  10          2HG       MET  10   4.500  -4.254   5.405
   82   2HG   MET  10          3HG       MET  10   4.323  -2.699   4.565
   83   1HE   MET  10          1HE       MET  10   2.735  -3.560   7.215
   84   2HE   MET  10          2HE       MET  10   2.524  -1.971   6.427
   85   3HE   MET  10          3HE       MET  10   1.102  -2.958   6.832
   86    H    GLN  11           H        GLN  11   5.450  -6.970   2.461
   87    HA   GLN  11           HA       GLN  11   6.717  -6.998  -0.216
   88   1HB   GLN  11          2HB       GLN  11   5.928  -9.056   1.886
   89   2HB   GLN  11          3HB       GLN  11   5.898  -9.567   0.209
   90   1HG   GLN  11          2HG       GLN  11   8.289  -8.456   1.735
   91   2HG   GLN  11          3HG       GLN  11   8.049 -10.135   1.203
   92   1HE2  GLN  11          1HE2      GLN  11   7.063  -9.741  -1.421
   93   2HE2  GLN  11          2HE2      GLN  11   8.098  -8.652  -2.323
   94    H    VAL  12           H        VAL  12   5.551  -7.869  -2.030
   95    HA   VAL  12           HA       VAL  12   2.600  -7.352  -1.878
   96    HB   VAL  12           HB       VAL  12   4.594  -7.083  -4.166
   97   1HG1  VAL  12          1HG1      VAL  12   2.592  -6.071  -5.348
   98   2HG1  VAL  12          2HG1      VAL  12   2.471  -7.811  -5.092
   99   3HG1  VAL  12          3HG1      VAL  12   1.577  -6.693  -4.035
  100   1HG2  VAL  12          1HG2      VAL  12   4.760  -5.248  -2.512
  101   2HG2  VAL  12          2HG2      VAL  12   4.010  -4.670  -4.002
  102   3HG2  VAL  12          3HG2      VAL  12   2.999  -5.013  -2.587
  103    H    SER  13           H        SER  13   1.172  -8.940  -2.535
  104    HA   SER  13           HA       SER  13   2.170 -11.219  -4.139
  105   1HB   SER  13          2HB       SER  13   0.518 -11.369  -1.577
  106   2HB   SER  13          3HB       SER  13   0.743 -12.720  -2.707
  107    HG   SER  13           HG       SER  13   2.277 -12.787  -1.015
  108    H    GLY  14           H        GLY  14   0.329 -12.386  -5.132
  109   1HA   GLY  14          2HA       GLY  14  -1.643 -12.511  -6.293
  110   2HA   GLY  14          3HA       GLY  14  -2.340 -11.392  -5.112
  111    H    MET  15           H        MET  15  -0.207 -11.494  -8.038
  112    HA   MET  15           HA       MET  15  -1.380  -9.017  -9.060
  113   1HB   MET  15          2HB       MET  15   0.740  -7.867  -9.163
  114   2HB   MET  15          3HB       MET  15   0.446  -8.342  -7.475
  115   1HG   MET  15          2HG       MET  15   2.654  -8.939  -7.674
  116   2HG   MET  15          3HG       MET  15   1.916 -10.452  -8.193
  117   1HE   MET  15          1HE       MET  15   4.774 -10.340  -8.830
  118   2HE   MET  15          2HE       MET  15   3.699 -11.520  -9.628
  119   3HE   MET  15          3HE       MET  15   4.870 -10.590 -10.592
  120    H    THR  16           H        THR  16  -0.843  -8.692 -11.306
  121    HA   THR  16           HA       THR  16   0.458 -10.976 -12.711
  122    HB   THR  16           HB       THR  16  -0.620  -9.528 -14.689
  123    HG1  THR  16           1HG      THR  16  -2.649  -8.704 -13.865
  124   1HG2  THR  16          1HG2      THR  16  -1.149 -11.868 -14.231
  125   2HG2  THR  16          2HG2      THR  16  -2.186 -11.405 -12.864
  126   3HG2  THR  16          3HG2      THR  16  -2.641 -10.963 -14.529
  127    H    CYS  17           H        CYS  17   0.296  -7.341 -12.758
  128    HA   CYS  17           HA       CYS  17   3.068  -7.363 -13.863
  129   1HB   CYS  17          2HB       CYS  17   2.411  -5.612 -15.405
  130   2HB   CYS  17          3HB       CYS  17   1.390  -7.040 -15.638
  131    H    ALA  18           H        ALA  18   4.284  -5.475 -13.559
  132    HA   ALA  18           HA       ALA  18   3.987  -4.276 -10.924
  133   1HB   ALA  18          1HB       ALA  18   5.978  -3.775 -13.182
  134   2HB   ALA  18          2HB       ALA  18   6.133  -3.198 -11.512
  135   3HB   ALA  18          3HB       ALA  18   6.183  -4.939 -11.861
  136    H    ALA  19           H        ALA  19   1.701  -3.582 -12.108
  137    HA   ALA  19           HA       ALA  19   1.952  -0.671 -12.570
  138   1HB   ALA  19          1HB       ALA  19   0.718  -2.466 -14.691
  139   2HB   ALA  19          2HB       ALA  19   0.765  -0.693 -14.693
  140   3HB   ALA  19          3HB       ALA  19   2.273  -1.619 -14.821
  141    H    CYS  20           H        CYS  20  -0.426  -3.451 -12.565
  142    HA   CYS  20           HA       CYS  20  -2.569  -1.803 -11.564
  143   1HB   CYS  20          2HB       CYS  20  -3.462  -3.974 -10.634
  144   2HB   CYS  20          3HB       CYS  20  -3.237  -3.903 -12.389
  145    H    ALA  21           H        ALA  21   0.036  -3.617  -9.990
  146    HA   ALA  21           HA       ALA  21  -0.318  -3.023  -7.350
  147   1HB   ALA  21          1HB       ALA  21   2.403  -2.733  -8.654
  148   2HB   ALA  21          2HB       ALA  21   1.973  -3.406  -7.060
  149   3HB   ALA  21          3HB       ALA  21   1.603  -4.305  -8.530
  150    H    ALA  22           H        ALA  22   0.319  -0.560  -9.816
  151    HA   ALA  22           HA       ALA  22   1.203   1.454  -7.878
  152   1HB   ALA  22          1HB       ALA  22   1.827   1.579 -10.287
  153   2HB   ALA  22          2HB       ALA  22   0.112   1.836 -10.690
  154   3HB   ALA  22          3HB       ALA  22   0.972   3.018  -9.695
  155    H    ARG  23           H        ARG  23  -1.851   0.375  -9.439
  156    HA   ARG  23           HA       ARG  23  -3.353   2.699  -8.611
  157   1HB   ARG  23          2HB       ARG  23  -4.163  -0.039  -9.684
  158   2HB   ARG  23          3HB       ARG  23  -5.335   1.010  -8.897
  159   1HG   ARG  23          2HG       ARG  23  -5.664   1.745 -11.000
  160   2HG   ARG  23          3HG       ARG  23  -4.456   2.896 -10.480
  161   1HD   ARG  23          2HD       ARG  23  -3.442   2.347 -12.401
  162   2HD   ARG  23          3HD       ARG  23  -2.818   0.937 -11.519
  163    HE   ARG  23           HE       ARG  23  -5.289   0.110 -12.440
  164   1HH1  ARG  23          2HH2      ARG  23  -2.325   1.233 -13.942
  165   2HH1  ARG  23          1HH2      ARG  23  -2.758   0.780 -15.564
  166   1HH2  ARG  23          2HH1      ARG  23  -5.941  -0.505 -14.583
  167   2HH2  ARG  23          1HH1      ARG  23  -4.857  -0.296 -15.916
  168    H    ILE  24           H        ILE  24  -2.660  -0.452  -7.072
  169    HA   ILE  24           HA       ILE  24  -4.535  -0.042  -5.009
  170    HB   ILE  24           HB       ILE  24  -3.597  -1.715  -3.750
  171   1HG1  ILE  24          2HG1      ILE  24  -1.101  -1.223  -5.272
  172   2HG1  ILE  24          3HG1      ILE  24  -1.361  -1.137  -3.518
  173   1HG2  ILE  24          1HG2      ILE  24  -3.713  -3.456  -5.285
  174   2HG2  ILE  24          2HG2      ILE  24  -4.599  -2.179  -6.109
  175   3HG2  ILE  24          3HG2      ILE  24  -2.934  -2.546  -6.598
  176   1HD1  ILE  24          1HD1      ILE  24  -1.224  -3.629  -5.244
  177   2HD1  ILE  24          2HD1      ILE  24  -0.070  -3.121  -4.009
  178   3HD1  ILE  24          3HD1      ILE  24  -1.703  -3.637  -3.528
  179    H    GLU  25           H        GLU  25  -1.053   0.743  -4.952
  180    HA   GLU  25           HA       GLU  25  -1.049   2.110  -2.503
  181   1HB   GLU  25          2HB       GLU  25   0.667   2.283  -5.001
  182   2HB   GLU  25          3HB       GLU  25   0.961   3.360  -3.620
  183   1HG   GLU  25          2HG       GLU  25   0.780   0.345  -3.254
  184   2HG   GLU  25          3HG       GLU  25   2.286   1.200  -3.617
  185    H    LYS  26           H        LYS  26  -1.728   3.397  -5.773
  186    HA   LYS  26           HA       LYS  26  -1.821   6.145  -4.820
  187   1HB   LYS  26          2HB       LYS  26  -2.588   4.782  -7.405
  188   2HB   LYS  26          3HB       LYS  26  -3.144   6.420  -7.060
  189   1HG   LYS  26          2HG       LYS  26  -1.121   6.593  -8.317
  190   2HG   LYS  26          3HG       LYS  26  -0.833   7.192  -6.676
  191   1HD   LYS  26          2HD       LYS  26   0.306   5.085  -6.094
  192   2HD   LYS  26          3HD       LYS  26  -0.028   4.474  -7.734
  193   1HE   LYS  26          2HE       LYS  26   1.326   6.202  -8.756
  194   2HE   LYS  26          3HE       LYS  26   1.559   7.018  -7.199
  195   1HZ   LYS  26          1HZ       LYS  26   2.798   5.166  -6.427
  196   2HZ   LYS  26          2HZ       LYS  26   2.549   4.321  -7.827
  197   3HZ   LYS  26          3HZ       LYS  26   3.452   5.696  -7.839
  198    H    GLY  27           H        GLY  27  -4.330   3.673  -5.497
  199   1HA   GLY  27          2HA       GLY  27  -6.553   5.320  -4.705
  200   2HA   GLY  27          3HA       GLY  27  -6.533   3.558  -4.861
  201    H    LEU  28           H        LEU  28  -4.183   3.382  -2.926
  202    HA   LEU  28           HA       LEU  28  -5.623   3.455  -0.389
  203   1HB   LEU  28          2HB       LEU  28  -4.132   1.670  -0.901
  204   2HB   LEU  28          3HB       LEU  28  -2.776   2.760  -1.145
  205    HG   LEU  28           HG       LEU  28  -2.886   1.375   0.974
  206   1HD1  LEU  28          1HD1      LEU  28  -1.851   3.144   2.316
  207   2HD1  LEU  28          2HD1      LEU  28  -1.277   3.167   0.639
  208   3HD1  LEU  28          3HD1      LEU  28  -2.456   4.362   1.201
  209   1HD2  LEU  28          1HD2      LEU  28  -4.838   3.520   1.902
  210   2HD2  LEU  28          2HD2      LEU  28  -5.226   1.817   1.605
  211   3HD2  LEU  28          3HD2      LEU  28  -4.101   2.280   2.889
  212    H    LYS  29           H        LYS  29  -3.098   5.400  -1.961
  213    HA   LYS  29           HA       LYS  29  -2.507   7.169   0.071
  214   1HB   LYS  29          2HB       LYS  29  -1.554   6.843  -2.370
  215   2HB   LYS  29          3HB       LYS  29  -2.713   8.094  -2.795
  216   1HG   LYS  29          2HG       LYS  29  -1.372   9.094  -0.486
  217   2HG   LYS  29          3HG       LYS  29  -0.177   8.155  -1.340
  218   1HD   LYS  29          2HD       LYS  29   0.018  10.400  -2.253
  219   2HD   LYS  29          3HD       LYS  29  -0.744   9.406  -3.475
  220   1HE   LYS  29          2HE       LYS  29  -1.718  11.656  -3.147
  221   2HE   LYS  29          3HE       LYS  29  -2.923  10.366  -2.946
  222   1HZ   LYS  29          1HZ       LYS  29  -2.919  12.199  -1.216
  223   2HZ   LYS  29          2HZ       LYS  29  -2.904  10.657  -0.634
  224   3HZ   LYS  29          3HZ       LYS  29  -1.512  11.549  -0.650
  225    H    ARG  30           H        ARG  30  -5.451   6.917  -1.564
  226    HA   ARG  30           HA       ARG  30  -6.431   9.645  -1.119
  227   1HB   ARG  30          2HB       ARG  30  -7.095   7.283  -2.723
  228   2HB   ARG  30          3HB       ARG  30  -8.520   7.807  -1.863
  229   1HG   ARG  30          2HG       ARG  30  -6.826   9.874  -3.305
  230   2HG   ARG  30          3HG       ARG  30  -7.824   8.769  -4.254
  231   1HD   ARG  30          2HD       ARG  30  -9.829   9.398  -3.107
  232   2HD   ARG  30          3HD       ARG  30  -8.941  10.439  -1.966
  233    HE   ARG  30           HE       ARG  30  -8.245  11.449  -4.428
  234   1HH1  ARG  30          2HH2      ARG  30 -11.324  10.865  -2.811
  235   2HH1  ARG  30          1HH2      ARG  30 -12.187  12.130  -3.628
  236   1HH2  ARG  30          2HH1      ARG  30  -9.337  13.195  -5.488
  237   2HH2  ARG  30          1HH1      ARG  30 -11.009  13.505  -5.165
  238    H    MET  31           H        MET  31  -6.005   6.958   0.934
  239    HA   MET  31           HA       MET  31  -8.528   7.188   2.335
  240   1HB   MET  31          2HB       MET  31  -5.896   5.780   2.967
  241   2HB   MET  31          3HB       MET  31  -7.288   5.696   4.034
  242   1HG   MET  31          2HG       MET  31  -7.282   4.832   1.133
  243   2HG   MET  31          3HG       MET  31  -7.117   3.764   2.527
  244   1HE   MET  31          1HE       MET  31  -9.225   4.421   4.624
  245   2HE   MET  31          2HE       MET  31 -10.688   3.621   4.012
  246   3HE   MET  31          3HE       MET  31  -9.118   2.804   3.892
  247    HA   PRO  32           HA       PRO  32  -7.450  10.395   5.245
  248   1HB   PRO  32          2HB       PRO  32  -8.584   9.437   7.576
  249   2HB   PRO  32          3HB       PRO  32  -9.522  10.166   6.241
  250   1HG   PRO  32          2HG       PRO  32  -9.017   7.223   6.749
  251   2HG   PRO  32          3HG       PRO  32 -10.584   8.021   6.420
  252   1HD   PRO  32          2HD       PRO  32  -9.231   6.800   4.453
  253   2HD   PRO  32          3HD       PRO  32 -10.003   8.368   4.121
  254    H    GLY  33           H        GLY  33  -5.590  10.714   6.406
  255   1HA   GLY  33          2HA       GLY  33  -3.898  10.231   7.915
  256   2HA   GLY  33          3HA       GLY  33  -4.387   8.534   7.964
  257    H    VAL  34           H        VAL  34  -4.214   8.953   4.659
  258    HA   VAL  34           HA       VAL  34  -1.314   8.246   4.692
  259    HB   VAL  34           HB       VAL  34  -3.329   7.651   2.522
  260   1HG1  VAL  34          1HG1      VAL  34  -1.008   7.860   1.753
  261   2HG1  VAL  34          2HG1      VAL  34  -0.421   6.871   3.092
  262   3HG1  VAL  34          3HG1      VAL  34  -1.402   6.141   1.826
  263   1HG2  VAL  34          1HG2      VAL  34  -3.928   6.355   4.530
  264   2HG2  VAL  34          2HG2      VAL  34  -3.170   5.306   3.329
  265   3HG2  VAL  34          3HG2      VAL  34  -2.239   5.850   4.738
  266    H    THR  35           H        THR  35   0.074   9.724   3.975
  267    HA   THR  35           HA       THR  35  -0.972  12.041   2.456
  268    HB   THR  35           HB       THR  35   0.989  11.722   4.471
  269    HG1  THR  35           1HG      THR  35   0.723  13.812   4.604
  270   1HG2  THR  35          1HG2      THR  35   2.790  11.519   2.855
  271   2HG2  THR  35          2HG2      THR  35   2.138  12.869   1.881
  272   3HG2  THR  35          3HG2      THR  35   2.799  13.165   3.488
  273    H    ASP  36           H        ASP  36   1.661   9.489   2.111
  274    HA   ASP  36           HA       ASP  36   1.314   9.697  -0.783
  275   1HB   ASP  36          2HB       ASP  36   3.768  10.571   0.697
  276   2HB   ASP  36          3HB       ASP  36   3.967   9.647  -0.794
  277    H    ALA  37           H        ALA  37   2.242   8.000  -1.932
  278    HA   ALA  37           HA       ALA  37   2.977   5.563  -0.468
  279   1HB   ALA  37          1HB       ALA  37   0.386   5.648  -2.073
  280   2HB   ALA  37          2HB       ALA  37   0.977   4.298  -1.095
  281   3HB   ALA  37          3HB       ALA  37   0.429   5.772  -0.300
  282    H    ASN  38           H        ASN  38   3.761   3.795  -1.801
  283    HA   ASN  38           HA       ASN  38   4.335   4.477  -4.569
  284   1HB   ASN  38          2HB       ASN  38   6.959   4.293  -3.474
  285   2HB   ASN  38          3HB       ASN  38   6.223   5.580  -4.410
  286   1HD2  ASN  38          1HD2      ASN  38   5.929   4.470  -0.964
  287   2HD2  ASN  38          2HD2      ASN  38   6.376   6.043  -0.309
  288    H    VAL  39           H        VAL  39   4.111   2.534  -5.454
  289    HA   VAL  39           HA       VAL  39   4.858   0.157  -3.964
  290    HB   VAL  39           HB       VAL  39   2.890   0.397  -5.563
  291   1HG1  VAL  39          1HG1      VAL  39   4.890  -0.267  -7.735
  292   2HG1  VAL  39          2HG1      VAL  39   3.144  -0.095  -7.862
  293   3HG1  VAL  39          3HG1      VAL  39   4.134   1.331  -7.516
  294   1HG2  VAL  39          1HG2      VAL  39   4.791  -1.843  -5.179
  295   2HG2  VAL  39          2HG2      VAL  39   3.075  -1.704  -4.763
  296   3HG2  VAL  39          3HG2      VAL  39   3.559  -2.050  -6.436
  297    H    ASN  40           H        ASN  40   6.941  -0.661  -3.881
  298    HA   ASN  40           HA       ASN  40   8.943   0.312  -5.873
  299   1HB   ASN  40          2HB       ASN  40   9.424   0.811  -3.504
  300   2HB   ASN  40          3HB       ASN  40   9.349  -0.915  -3.126
  301   1HD2  ASN  40          1HD2      ASN  40  11.653  -0.172  -2.363
  302   2HD2  ASN  40          2HD2      ASN  40  12.925  -0.357  -3.561
  303    H    LEU  41           H        LEU  41   7.330  -1.237  -7.033
  304    HA   LEU  41           HA       LEU  41   7.549  -4.038  -6.536
  305   1HB   LEU  41          2HB       LEU  41   5.875  -2.396  -8.016
  306   2HB   LEU  41          3HB       LEU  41   6.771  -3.214  -9.284
  307    HG   LEU  41           HG       LEU  41   4.599  -4.238  -8.637
  308   1HD1  LEU  41          1HD1      LEU  41   5.291  -6.567  -8.575
  309   2HD1  LEU  41          2HD1      LEU  41   6.361  -5.666  -9.666
  310   3HD1  LEU  41          3HD1      LEU  41   6.922  -6.122  -8.050
  311   1HD2  LEU  41          1HD2      LEU  41   5.226  -3.773  -6.045
  312   2HD2  LEU  41          2HD2      LEU  41   4.013  -4.934  -6.597
  313   3HD2  LEU  41          3HD2      LEU  41   5.635  -5.484  -6.142
  314    H    ALA  42           H        ALA  42   9.611  -1.838  -8.188
  315    HA   ALA  42           HA       ALA  42  11.120  -3.384  -9.939
  316   1HB   ALA  42          1HB       ALA  42  11.539  -0.979  -9.391
  317   2HB   ALA  42          2HB       ALA  42  12.152  -1.492  -7.793
  318   3HB   ALA  42          3HB       ALA  42  13.007  -1.982  -9.265
  319    H    THR  43           H        THR  43  10.932  -3.619  -6.385
  320    HA   THR  43           HA       THR  43  12.581  -6.073  -6.586
  321    HB   THR  43           HB       THR  43  14.087  -4.430  -5.706
  322    HG1  THR  43           1HG      THR  43  13.018  -6.180  -3.782
  323   1HG2  THR  43          1HG2      THR  43  12.589  -2.698  -4.920
  324   2HG2  THR  43          2HG2      THR  43  11.934  -3.763  -3.660
  325   3HG2  THR  43          3HG2      THR  43  13.621  -3.217  -3.581
  326    H    GLU  44           H        GLU  44   9.761  -5.780  -6.767
  327    HA   GLU  44           HA       GLU  44   7.798  -6.523  -5.925
  328   1HB   GLU  44          2HB       GLU  44   9.764  -8.513  -4.716
  329   2HB   GLU  44          3HB       GLU  44   8.014  -8.736  -4.759
  330   1HG   GLU  44          2HG       GLU  44   8.879  -9.945  -6.590
  331   2HG   GLU  44          3HG       GLU  44   8.030  -8.540  -7.244
  332    H    THR  45           H        THR  45   8.929  -4.331  -4.238
  333    HA   THR  45           HA       THR  45   7.766  -5.042  -1.591
  334    HB   THR  45           HB       THR  45   9.919  -3.044  -2.404
  335    HG1  THR  45           1HG      THR  45  11.306  -4.561  -1.507
  336   1HG2  THR  45          1HG2      THR  45   8.789  -2.339  -0.322
  337   2HG2  THR  45          2HG2      THR  45   9.004  -3.985   0.339
  338   3HG2  THR  45          3HG2      THR  45  10.411  -2.953   0.021
  339    H    VAL  46           H        VAL  46   6.608  -3.252  -0.520
  340    HA   VAL  46           HA       VAL  46   5.774  -1.004  -2.282
  341    HB   VAL  46           HB       VAL  46   3.948  -2.571  -2.338
  342   1HG1  VAL  46          1HG1      VAL  46   4.304  -3.923  -0.334
  343   2HG1  VAL  46          2HG1      VAL  46   4.005  -2.503   0.702
  344   3HG1  VAL  46          3HG1      VAL  46   2.698  -3.184  -0.281
  345   1HG2  VAL  46          1HG2      VAL  46   2.176  -1.160  -1.561
  346   2HG2  VAL  46          2HG2      VAL  46   3.230  -0.353  -0.384
  347   3HG2  VAL  46          3HG2      VAL  46   3.504  -0.125  -2.123
  348    H    ASN  47           H        ASN  47   5.551   1.029  -1.215
  349    HA   ASN  47           HA       ASN  47   6.361   1.066   1.628
  350   1HB   ASN  47          2HB       ASN  47   7.633   2.490  -0.750
  351   2HB   ASN  47          3HB       ASN  47   7.644   3.229   0.850
  352   1HD2  ASN  47          1HD2      ASN  47   8.347   1.621   2.707
  353   2HD2  ASN  47          2HD2      ASN  47   9.922   0.940   2.348
  354    H    VAL  48           H        VAL  48   5.123   2.604   2.808
  355    HA   VAL  48           HA       VAL  48   3.297   4.290   1.219
  356    HB   VAL  48           HB       VAL  48   2.048   2.284   1.585
  357   1HG1  VAL  48          1HG1      VAL  48   1.514   1.439   3.845
  358   2HG1  VAL  48          2HG1      VAL  48   3.207   1.216   3.401
  359   3HG1  VAL  48          3HG1      VAL  48   2.756   2.499   4.534
  360   1HG2  VAL  48          1HG2      VAL  48   0.227   3.273   3.076
  361   2HG2  VAL  48          2HG2      VAL  48   1.270   4.692   3.255
  362   3HG2  VAL  48          3HG2      VAL  48   0.730   4.205   1.652
  363    H    ILE  49           H        ILE  49   3.229   6.272   2.051
  364    HA   ILE  49           HA       ILE  49   4.822   6.765   4.455
  365    HB   ILE  49           HB       ILE  49   4.096   8.762   2.270
  366   1HG1  ILE  49          2HG1      ILE  49   5.263   7.081   1.080
  367   2HG1  ILE  49          3HG1      ILE  49   6.296   8.486   1.297
  368   1HG2  ILE  49          1HG2      ILE  49   6.023  10.009   3.147
  369   2HG2  ILE  49          2HG2      ILE  49   4.774   9.763   4.374
  370   3HG2  ILE  49          3HG2      ILE  49   6.248   8.782   4.415
  371   1HD1  ILE  49          1HD1      ILE  49   7.488   7.313   3.158
  372   2HD1  ILE  49          2HD1      ILE  49   6.493   5.869   2.849
  373   3HD1  ILE  49          3HD1      ILE  49   7.604   6.466   1.608
  374    H    TYR  50           H        TYR  50   3.183   6.677   6.066
  375    HA   TYR  50           HA       TYR  50   0.752   8.379   5.691
  376   1HB   TYR  50          2HB       TYR  50  -0.727   6.720   6.495
  377   2HB   TYR  50          3HB       TYR  50   0.122   6.073   5.120
  378    HD1  TYR  50           HD1      TYR  50   1.171   3.960   5.295
  379    HD2  TYR  50           HD2      TYR  50  -0.193   5.958   8.835
  380    HE1  TYR  50           HE1      TYR  50   1.353   1.856   6.565
  381    HE2  TYR  50           HE2      TYR  50   0.423   3.986  10.183
  382    HH   TYR  50           HH       TYR  50   1.260   1.835  10.138
  383    H    ASP  51           H        ASP  51  -0.433   8.523   7.740
  384    HA   ASP  51           HA       ASP  51   1.450   9.338   9.826
  385   1HB   ASP  51          2HB       ASP  51  -1.476   9.997   9.395
  386   2HB   ASP  51          3HB       ASP  51  -0.404  10.679  10.634
  387    HA   PRO  52           HA       PRO  52  -0.197   5.534  11.704
  388   1HB   PRO  52          2HB       PRO  52   1.735   4.935  13.533
  389   2HB   PRO  52          3HB       PRO  52   1.924   4.654  11.789
  390   1HG   PRO  52          2HG       PRO  52   2.831   7.091  13.359
  391   2HG   PRO  52          3HG       PRO  52   3.817   6.082  12.259
  392   1HD   PRO  52          2HD       PRO  52   2.698   8.364  11.404
  393   2HD   PRO  52          3HD       PRO  52   2.673   6.929  10.342
  394    H    ALA  53           H        ALA  53  -0.609   8.552  12.745
  395    HA   ALA  53           HA       ALA  53  -1.552   7.923  15.464
  396   1HB   ALA  53          1HB       ALA  53  -1.786  10.383  13.677
  397   2HB   ALA  53          2HB       ALA  53  -2.376  10.247  15.345
  398   3HB   ALA  53          3HB       ALA  53  -0.631  10.171  15.015
  399    H    GLU  54           H        GLU  54  -2.473   8.013  12.035
  400    HA   GLU  54           HA       GLU  54  -5.333   7.909  12.770
  401   1HB   GLU  54          2HB       GLU  54  -3.832   9.651  10.973
  402   2HB   GLU  54          3HB       GLU  54  -5.010   8.699  10.058
  403   1HG   GLU  54          2HG       GLU  54  -6.037  10.763  10.735
  404   2HG   GLU  54          3HG       GLU  54  -6.824   9.405  11.554
  405    H    THR  55           H        THR  55  -3.080   6.946  10.098
  406    HA   THR  55           HA       THR  55  -4.525   4.452   9.878
  407    HB   THR  55           HB       THR  55  -2.634   4.110   7.912
  408    HG1  THR  55           1HG      THR  55  -3.630   6.436   7.278
  409   1HG2  THR  55          1HG2      THR  55  -4.609   4.602   6.503
  410   2HG2  THR  55          2HG2      THR  55  -5.063   3.626   7.922
  411   3HG2  THR  55          3HG2      THR  55  -5.449   5.368   7.883
  412    H    GLY  56           H        GLY  56  -2.830   2.689   9.226
  413   1HA   GLY  56          2HA       GLY  56  -0.768   1.982  10.978
  414   2HA   GLY  56          3HA       GLY  56  -2.344   1.440  11.623
  415    H    THR  57           H        THR  57  -2.130  -0.753  10.989
  416    HA   THR  57           HA       THR  57  -1.466  -1.599   8.269
  417    HB   THR  57           HB       THR  57  -2.062  -3.823   9.406
  418    HG1  THR  57           1HG      THR  57  -2.355  -3.679  11.653
  419   1HG2  THR  57          1HG2      THR  57   0.288  -2.947   9.290
  420   2HG2  THR  57          2HG2      THR  57   0.036  -2.032  10.785
  421   3HG2  THR  57          3HG2      THR  57   0.003  -3.806  10.815
  422    H    ALA  58           H        ALA  58  -4.144  -1.132  10.483
  423    HA   ALA  58           HA       ALA  58  -6.219  -2.425   9.527
  424   1HB   ALA  58          1HB       ALA  58  -7.691  -0.648  10.398
  425   2HB   ALA  58          2HB       ALA  58  -6.322  -0.960  11.480
  426   3HB   ALA  58          3HB       ALA  58  -6.315   0.473  10.432
  427    H    ALA  59           H        ALA  59  -5.487   0.792   8.221
  428    HA   ALA  59           HA       ALA  59  -7.870   0.516   6.467
  429   1HB   ALA  59          1HB       ALA  59  -7.102   2.766   7.329
  430   2HB   ALA  59          2HB       ALA  59  -5.751   2.626   6.144
  431   3HB   ALA  59          3HB       ALA  59  -7.421   2.653   5.587
  432    H    ILE  60           H        ILE  60  -4.371   0.310   6.234
  433    HA   ILE  60           HA       ILE  60  -4.120   0.075   3.436
  434    HB   ILE  60           HB       ILE  60  -2.430  -0.532   5.860
  435   1HG1  ILE  60          2HG1      ILE  60  -0.827   0.781   4.373
  436   2HG1  ILE  60          3HG1      ILE  60  -2.168   0.979   3.236
  437   1HG2  ILE  60          1HG2      ILE  60  -1.727  -1.615   3.113
  438   2HG2  ILE  60          2HG2      ILE  60  -0.632  -1.481   4.510
  439   3HG2  ILE  60          3HG2      ILE  60  -2.007  -2.572   4.593
  440   1HD1  ILE  60          1HD1      ILE  60  -1.812   2.962   4.708
  441   2HD1  ILE  60          2HD1      ILE  60  -3.352   2.221   5.180
  442   3HD1  ILE  60          3HD1      ILE  60  -1.878   1.948   6.142
  443    H    GLN  61           H        GLN  61  -4.462  -2.558   5.890
  444    HA   GLN  61           HA       GLN  61  -4.430  -4.552   3.849
  445   1HB   GLN  61          2HB       GLN  61  -4.735  -4.490   6.733
  446   2HB   GLN  61          3HB       GLN  61  -5.931  -5.554   6.000
  447   1HG   GLN  61          2HG       GLN  61  -4.451  -7.173   5.919
  448   2HG   GLN  61          3HG       GLN  61  -3.567  -6.310   4.673
  449   1HE2  GLN  61          1HE2      GLN  61  -2.418  -4.170   6.102
  450   2HE2  GLN  61          2HE2      GLN  61  -1.288  -4.874   7.255
  451    H    GLU  62           H        GLU  62  -7.156  -2.892   5.539
  452    HA   GLU  62           HA       GLU  62  -9.365  -4.151   4.363
  453   1HB   GLU  62          2HB       GLU  62  -8.706  -1.368   5.338
  454   2HB   GLU  62          3HB       GLU  62 -10.198  -1.561   4.445
  455   1HG   GLU  62          2HG       GLU  62  -9.524  -3.364   6.800
  456   2HG   GLU  62          3HG       GLU  62 -10.298  -1.786   6.999
  457    H    LYS  63           H        LYS  63  -7.604  -1.271   3.100
  458    HA   LYS  63           HA       LYS  63  -9.103  -1.207   0.693
  459   1HB   LYS  63          2HB       LYS  63  -6.728   0.161   1.890
  460   2HB   LYS  63          3HB       LYS  63  -6.963   0.308   0.186
  461   1HG   LYS  63          2HG       LYS  63  -9.290   0.725   2.105
  462   2HG   LYS  63          3HG       LYS  63  -8.141   2.014   1.800
  463   1HD   LYS  63          2HD       LYS  63  -9.569   0.615  -0.495
  464   2HD   LYS  63          3HD       LYS  63 -10.281   2.001   0.359
  465   1HE   LYS  63          2HE       LYS  63  -8.629   3.502  -0.331
  466   2HE   LYS  63          3HE       LYS  63  -7.441   2.242  -0.659
  467   1HZ   LYS  63          1HZ       LYS  63  -8.559   1.667  -2.613
  468   2HZ   LYS  63          2HZ       LYS  63  -9.811   2.712  -2.312
  469   3HZ   LYS  63          3HZ       LYS  63  -8.285   3.303  -2.555
  470    H    ILE  64           H        ILE  64  -5.987  -2.728   1.563
  471    HA   ILE  64           HA       ILE  64  -4.959  -3.235  -0.935
  472    HB   ILE  64           HB       ILE  64  -4.752  -4.288   1.780
  473   1HG1  ILE  64          2HG1      ILE  64  -3.356  -2.474   0.710
  474   2HG1  ILE  64          3HG1      ILE  64  -2.502  -3.770   1.546
  475   1HG2  ILE  64          1HG2      ILE  64  -3.298  -6.126   1.252
  476   2HG2  ILE  64          2HG2      ILE  64  -4.999  -6.425   0.934
  477   3HG2  ILE  64          3HG2      ILE  64  -3.900  -6.095  -0.429
  478   1HD1  ILE  64          1HD1      ILE  64  -1.397  -3.233  -0.548
  479   2HD1  ILE  64          2HD1      ILE  64  -2.044  -4.884  -0.609
  480   3HD1  ILE  64          3HD1      ILE  64  -2.881  -3.580  -1.466
  481    H    GLU  65           H        GLU  65  -7.138  -5.214   1.171
  482    HA   GLU  65           HA       GLU  65  -7.813  -7.271  -0.661
  483   1HB   GLU  65          2HB       GLU  65  -9.159  -6.090   1.794
  484   2HB   GLU  65          3HB       GLU  65  -9.916  -7.389   0.872
  485   1HG   GLU  65          2HG       GLU  65  -7.058  -7.691   1.800
  486   2HG   GLU  65          3HG       GLU  65  -8.408  -8.002   2.901
  487    H    LYS  66           H        LYS  66  -9.717  -4.314   0.183
  488    HA   LYS  66           HA       LYS  66 -11.774  -4.725  -1.698
  489   1HB   LYS  66          2HB       LYS  66 -10.643  -2.367  -0.245
  490   2HB   LYS  66          3HB       LYS  66 -11.722  -2.020  -1.584
  491   1HG   LYS  66          2HG       LYS  66 -12.645  -4.142   0.327
  492   2HG   LYS  66          3HG       LYS  66 -12.552  -2.526   1.004
  493   1HD   LYS  66          2HD       LYS  66 -13.911  -3.040  -1.674
  494   2HD   LYS  66          3HD       LYS  66 -14.780  -3.248  -0.143
  495   1HE   LYS  66          2HE       LYS  66 -14.458  -0.952   0.507
  496   2HE   LYS  66          3HE       LYS  66 -13.319  -0.643  -0.806
  497   1HZ   LYS  66          1HZ       LYS  66 -15.481   0.240  -1.272
  498   2HZ   LYS  66          2HZ       LYS  66 -15.090  -0.916  -2.373
  499   3HZ   LYS  66          3HZ       LYS  66 -16.173  -1.247  -1.176
  500    H    LEU  67           H        LEU  67  -8.609  -3.246  -2.287
  501    HA   LEU  67           HA       LEU  67  -9.217  -2.421  -5.007
  502   1HB   LEU  67          2HB       LEU  67  -6.696  -2.663  -3.346
  503   2HB   LEU  67          3HB       LEU  67  -6.632  -2.264  -5.057
  504    HG   LEU  67           HG       LEU  67  -8.506  -0.653  -3.328
  505   1HD1  LEU  67          1HD1      LEU  67  -5.515  -0.578  -3.161
  506   2HD1  LEU  67          2HD1      LEU  67  -6.382   0.971  -3.180
  507   3HD1  LEU  67          3HD1      LEU  67  -6.726  -0.242  -1.944
  508   1HD2  LEU  67          1HD2      LEU  67  -6.756   0.029  -5.737
  509   2HD2  LEU  67          2HD2      LEU  67  -8.481  -0.367  -5.800
  510   3HD2  LEU  67          3HD2      LEU  67  -7.943   1.099  -4.970
  511    H    GLY  68           H        GLY  68  -8.497  -5.469  -3.538
  512   1HA   GLY  68          2HA       GLY  68  -8.720  -7.498  -4.600
  513   2HA   GLY  68          3HA       GLY  68  -8.474  -6.753  -6.183
  514    H    TYR  69           H        TYR  69  -6.459  -6.584  -3.168
  515    HA   TYR  69           HA       TYR  69  -4.240  -8.022  -4.550
  516   1HB   TYR  69          2HB       TYR  69  -4.491  -5.170  -3.969
  517   2HB   TYR  69          3HB       TYR  69  -3.184  -5.849  -3.028
  518    HD1  TYR  69           HD1      TYR  69  -1.143  -6.597  -4.047
  519    HD2  TYR  69           HD2      TYR  69  -4.536  -5.570  -6.501
  520    HE1  TYR  69           HE1      TYR  69   0.316  -6.451  -6.017
  521    HE2  TYR  69           HE2      TYR  69  -3.070  -5.438  -8.475
  522    HH   TYR  69           HH       TYR  69   0.445  -6.069  -8.291
  523    H    HIS  70           H        HIS  70  -2.410  -8.393  -2.916
  524    HA   HIS  70           HA       HIS  70  -3.340  -8.539  -0.105
  525   1HB   HIS  70          2HB       HIS  70  -3.788 -10.708  -1.248
  526   2HB   HIS  70          3HB       HIS  70  -2.058 -10.874  -1.562
  527    HD1  HIS  70           1HD      HIS  70  -1.376  -9.804   1.642
  528    HD2  HIS  70           2HD      HIS  70  -3.843 -12.920   0.224
  529    HE1  HIS  70           1HE      HIS  70  -1.577 -11.471   3.513
  530    H    VAL  71           H        VAL  71  -1.871  -7.442   1.038
  531    HA   VAL  71           HA       VAL  71   0.945  -7.259   0.137
  532    HB   VAL  71           HB       VAL  71  -0.406  -5.213   0.803
  533   1HG1  VAL  71          1HG1      VAL  71  -0.676  -4.663   3.139
  534   2HG1  VAL  71          2HG1      VAL  71  -1.528  -6.188   2.844
  535   3HG1  VAL  71          3HG1      VAL  71   0.053  -6.190   3.654
  536   1HG2  VAL  71          1HG2      VAL  71   2.000  -5.197   0.616
  537   2HG2  VAL  71          2HG2      VAL  71   1.464  -4.166   1.954
  538   3HG2  VAL  71          3HG2      VAL  71   2.143  -5.780   2.288
  539    H    VAL  72           H        VAL  72   2.633  -8.010   1.582
  540    HA   VAL  72           HA       VAL  72   1.757  -9.906   3.719
  541    HB   VAL  72           HB       VAL  72   4.014 -10.294   1.824
  542   1HG1  VAL  72          1HG1      VAL  72   2.839 -12.108   3.971
  543   2HG1  VAL  72          2HG1      VAL  72   4.081 -12.594   2.801
  544   3HG1  VAL  72          3HG1      VAL  72   4.448 -11.349   3.993
  545   1HG2  VAL  72          1HG2      VAL  72   1.260 -11.615   1.925
  546   2HG2  VAL  72          2HG2      VAL  72   1.922 -10.646   0.588
  547   3HG2  VAL  72          3HG2      VAL  72   2.622 -12.228   0.969
  548    H    ILE  73           H        ILE  73   3.020  -9.897   5.528
  549    HA   ILE  73           HA       ILE  73   4.791  -7.511   5.836
  550    HB   ILE  73           HB       ILE  73   2.982  -8.812   7.880
  551   1HG1  ILE  73          2HG1      ILE  73   2.228  -6.241   7.829
  552   2HG1  ILE  73          3HG1      ILE  73   2.904  -6.299   6.201
  553   1HG2  ILE  73          1HG2      ILE  73   4.823  -6.403   8.131
  554   2HG2  ILE  73          2HG2      ILE  73   3.657  -6.986   9.344
  555   3HG2  ILE  73          3HG2      ILE  73   5.077  -7.956   8.959
  556   1HD1  ILE  73          1HD1      ILE  73   1.317  -8.090   5.630
  557   2HD1  ILE  73          2HD1      ILE  73   0.771  -8.136   7.330
  558   3HD1  ILE  73          3HD1      ILE  73   0.462  -6.700   6.323
  559    H    GLU  74           H        GLU  74   6.485  -8.896   4.918
  560    HA   GLU  74           HA       GLU  74   7.524 -11.037   6.395
  561   1HB   GLU  74          2HB       GLU  74   8.220  -9.547   3.948
  562   2HB   GLU  74          3HB       GLU  74   9.536 -10.403   4.752
  563   1HG   GLU  74          2HG       GLU  74   6.954 -11.868   4.161
  564   2HG   GLU  74          3HG       GLU  74   8.253 -11.730   2.964
  565    H    GLY  75           H        GLY  75   7.496  -8.037   7.377
  566   1HA   GLY  75          2HA       GLY  75   8.679  -6.813   8.976
  567   2HA   GLY  75          3HA       GLY  75   9.467  -8.340   9.405
  568    H    ARG  76           H        ARG  76   9.575  -5.578   7.110
  569    HA   ARG  76           HA       ARG  76  12.467  -5.674   6.869
  570   1HB   ARG  76          2HB       ARG  76  10.667  -6.537   4.725
  571   2HB   ARG  76          3HB       ARG  76  11.223  -4.916   4.357
  572   1HG   ARG  76          2HG       ARG  76  12.726  -6.301   3.275
  573   2HG   ARG  76          3HG       ARG  76  13.612  -5.733   4.693
  574   1HD   ARG  76          2HD       ARG  76  12.121  -8.408   4.495
  575   2HD   ARG  76          3HD       ARG  76  13.823  -8.253   4.108
  576    HE   ARG  76           HE       ARG  76  12.508  -8.161   6.757
  577   1HH1  ARG  76          2HH2      ARG  76  15.485  -7.407   5.045
  578   2HH1  ARG  76          1HH2      ARG  76  16.504  -7.480   6.451
  579   1HH2  ARG  76          2HH1      ARG  76  13.701  -8.158   8.583
  580   2HH2  ARG  76          1HH1      ARG  76  15.444  -7.968   8.583
  Start of MODEL    6
    1   1H    MET   1          H1        MET   1  -3.931  17.454  17.783
    2   2H    MET   1          H2        MET   1  -3.592  17.746  19.394
    3   3H    MET   1          H3        MET   1  -3.211  18.848  18.210
    4    HA   MET   1           HA       MET   1  -1.192  17.802  18.657
    5   1HB   MET   1          2HB       MET   1  -2.780  15.209  18.314
    6   2HB   MET   1          3HB       MET   1  -1.020  15.325  18.401
    7   1HG   MET   1          2HG       MET   1  -1.287  16.428  20.684
    8   2HG   MET   1          3HG       MET   1  -3.010  16.040  20.587
    9   1HE   MET   1          1HE       MET   1   0.616  14.695  20.960
   10   2HE   MET   1          2HE       MET   1   0.367  12.940  21.079
   11   3HE   MET   1          3HE       MET   1   0.144  13.754  19.521
   12    H    LEU   2           H        LEU   2   0.206  16.831  16.840
   13    HA   LEU   2           HA       LEU   2  -1.091  17.296  14.203
   14   1HB   LEU   2          2HB       LEU   2   1.338  18.335  15.337
   15   2HB   LEU   2          3HB       LEU   2   1.834  17.134  14.171
   16    HG   LEU   2           HG       LEU   2  -0.242  18.767  12.933
   17   1HD1  LEU   2          1HD1      LEU   2   0.835  20.953  13.012
   18   2HD1  LEU   2          2HD1      LEU   2   0.349  20.451  14.641
   19   3HD1  LEU   2          3HD1      LEU   2   2.056  20.345  14.151
   20   1HD2  LEU   2          1HD2      LEU   2   2.752  18.586  12.427
   21   2HD2  LEU   2          2HD2      LEU   2   1.511  17.519  11.730
   22   3HD2  LEU   2          3HD2      LEU   2   1.527  19.245  11.323
   23    H    SER   3           H        SER   3  -0.380  15.885  12.478
   24    HA   SER   3           HA       SER   3  -0.062  13.088  13.337
   25   1HB   SER   3          2HB       SER   3  -0.578  14.250  10.563
   26   2HB   SER   3          3HB       SER   3  -0.828  12.608  11.108
   27    HG   SER   3           HG       SER   3  -2.449  13.355  12.526
   28    H    GLU   4           H        GLU   4   2.104  12.554  13.643
   29    HA   GLU   4           HA       GLU   4   4.207  13.483  11.825
   30   1HB   GLU   4          2HB       GLU   4   4.037  11.697  14.182
   31   2HB   GLU   4          3HB       GLU   4   5.238  11.289  12.988
   32   1HG   GLU   4          2HG       GLU   4   5.967  13.722  13.163
   33   2HG   GLU   4          3HG       GLU   4   5.022  13.731  14.660
   34    H    GLN   5           H        GLN   5   5.396  11.735  10.614
   35    HA   GLN   5           HA       GLN   5   3.515   9.865   9.251
   36   1HB   GLN   5          2HB       GLN   5   5.609  11.672   8.018
   37   2HB   GLN   5          3HB       GLN   5   4.778  10.374   7.192
   38   1HG   GLN   5          2HG       GLN   5   2.733  12.000   8.418
   39   2HG   GLN   5          3HG       GLN   5   3.884  13.108   7.670
   40   1HE2  GLN   5          1HE2      GLN   5   2.681   9.840   6.866
   41   2HE2  GLN   5          2HE2      GLN   5   2.078  10.231   5.268
   42    H    LYS   6           H        LYS   6   4.453   7.952   8.388
   43    HA   LYS   6           HA       LYS   6   7.337   7.629   8.644
   44   1HB   LYS   6          2HB       LYS   6   5.389   5.657   9.833
   45   2HB   LYS   6          3HB       LYS   6   7.013   5.184   9.424
   46   1HG   LYS   6          2HG       LYS   6   6.713   7.524  11.310
   47   2HG   LYS   6          3HG       LYS   6   6.372   5.906  11.899
   48   1HD   LYS   6          2HD       LYS   6   8.685   6.576  12.370
   49   2HD   LYS   6          3HD       LYS   6   8.568   5.099  11.389
   50   1HE   LYS   6          2HE       LYS   6   9.035   6.276   9.386
   51   2HE   LYS   6          3HE       LYS   6   9.006   7.878  10.177
   52   1HZ   LYS   6          1HZ       LYS   6  11.001   5.743  10.523
   53   2HZ   LYS   6          2HZ       LYS   6  11.160   7.140   9.676
   54   3HZ   LYS   6          3HZ       LYS   6  11.010   7.194  11.324
   55    H    GLU   7           H        GLU   7   8.179   6.022   7.359
   56    HA   GLU   7           HA       GLU   7   6.642   5.377   4.911
   57   1HB   GLU   7          2HB       GLU   7   9.618   4.978   5.020
   58   2HB   GLU   7          3HB       GLU   7   8.571   5.512   3.734
   59   1HG   GLU   7          2HG       GLU   7   9.896   7.360   4.224
   60   2HG   GLU   7          3HG       GLU   7   8.446   7.755   5.160
   61    H    ILE   8           H        ILE   8   5.646   3.357   5.478
   62    HA   ILE   8           HA       ILE   8   7.304   1.380   6.872
   63    HB   ILE   8           HB       ILE   8   4.525   1.174   5.883
   64   1HG1  ILE   8          2HG1      ILE   8   4.304   3.091   7.214
   65   2HG1  ILE   8          3HG1      ILE   8   3.718   1.698   8.141
   66   1HG2  ILE   8          1HG2      ILE   8   6.167  -0.189   7.969
   67   2HG2  ILE   8          2HG2      ILE   8   4.401  -0.447   7.799
   68   3HG2  ILE   8          3HG2      ILE   8   5.498  -0.899   6.480
   69   1HD1  ILE   8          1HD1      ILE   8   5.072   3.114   9.547
   70   2HD1  ILE   8          2HD1      ILE   8   5.853   1.533   9.286
   71   3HD1  ILE   8          3HD1      ILE   8   6.428   2.961   8.398
   72    H    ALA   9           H        ALA   9   7.453  -0.792   5.854
   73    HA   ALA   9           HA       ALA   9   7.526  -0.813   2.892
   74   1HB   ALA   9          1HB       ALA   9   9.737  -1.853   4.722
   75   2HB   ALA   9          2HB       ALA   9   9.695  -1.932   2.948
   76   3HB   ALA   9          3HB       ALA   9   9.849  -0.364   3.769
   77    H    MET  10           H        MET  10   6.766  -2.817   2.095
   78    HA   MET  10           HA       MET  10   6.710  -5.170   3.798
   79   1HB   MET  10          2HB       MET  10   4.230  -5.429   3.783
   80   2HB   MET  10          3HB       MET  10   4.813  -4.089   4.757
   81   1HG   MET  10          2HG       MET  10   4.310  -2.627   2.611
   82   2HG   MET  10          3HG       MET  10   3.352  -4.046   2.142
   83   1HE   MET  10          1HE       MET  10   2.436  -1.173   5.625
   84   2HE   MET  10          2HE       MET  10   3.783  -2.326   5.748
   85   3HE   MET  10          3HE       MET  10   3.823  -1.033   4.517
   86    H    GLN  11           H        GLN  11   5.263  -6.930   2.525
   87    HA   GLN  11           HA       GLN  11   6.332  -6.959  -0.262
   88   1HB   GLN  11          2HB       GLN  11   5.609  -9.134   1.769
   89   2HB   GLN  11          3HB       GLN  11   5.817  -9.485   0.064
   90   1HG   GLN  11          2HG       GLN  11   7.912  -8.338   1.966
   91   2HG   GLN  11          3HG       GLN  11   7.848  -9.999   1.346
   92   1HE2  GLN  11          1HE2      GLN  11   7.374  -9.854  -1.295
   93   2HE2  GLN  11          2HE2      GLN  11   8.321  -8.633  -2.108
   94    H    VAL  12           H        VAL  12   4.906  -8.054  -1.864
   95    HA   VAL  12           HA       VAL  12   2.003  -7.895  -1.249
   96    HB   VAL  12           HB       VAL  12   1.931  -7.117  -3.796
   97   1HG1  VAL  12          1HG1      VAL  12   0.794  -5.917  -2.087
   98   2HG1  VAL  12          2HG1      VAL  12   2.312  -5.367  -1.367
   99   3HG1  VAL  12          3HG1      VAL  12   1.799  -4.734  -2.948
  100   1HG2  VAL  12          1HG2      VAL  12   4.501  -5.773  -2.849
  101   2HG2  VAL  12          2HG2      VAL  12   4.410  -7.058  -4.081
  102   3HG2  VAL  12          3HG2      VAL  12   3.616  -5.493  -4.347
  103    H    SER  13           H        SER  13   0.657  -9.168  -2.621
  104    HA   SER  13           HA       SER  13   1.967 -11.210  -4.288
  105   1HB   SER  13          2HB       SER  13   0.290 -11.834  -1.813
  106   2HB   SER  13          3HB       SER  13   0.668 -13.016  -3.082
  107    HG   SER  13           HG       SER  13   2.182 -13.145  -1.386
  108    H    GLY  14           H        GLY  14   0.307 -12.468  -5.463
  109   1HA   GLY  14          2HA       GLY  14  -1.632 -12.682  -6.687
  110   2HA   GLY  14          3HA       GLY  14  -2.454 -11.628  -5.524
  111    H    MET  15           H        MET  15  -0.002 -11.511  -8.191
  112    HA   MET  15           HA       MET  15  -1.278  -9.113  -9.286
  113   1HB   MET  15          2HB       MET  15   0.793  -7.856  -9.335
  114   2HB   MET  15          3HB       MET  15   0.344  -8.269  -7.669
  115   1HG   MET  15          2HG       MET  15   2.652  -8.467  -7.773
  116   2HG   MET  15          3HG       MET  15   2.063 -10.127  -7.750
  117   1HE   MET  15          1HE       MET  15   5.462 -10.088  -9.811
  118   2HE   MET  15          2HE       MET  15   5.052  -8.951  -8.511
  119   3HE   MET  15          3HE       MET  15   4.654 -10.676  -8.336
  120    H    THR  16           H        THR  16  -0.353  -8.586 -11.421
  121    HA   THR  16           HA       THR  16   0.953 -10.896 -12.808
  122    HB   THR  16           HB       THR  16  -0.092  -9.638 -14.881
  123    HG1  THR  16           1HG      THR  16  -2.099  -9.127 -12.965
  124   1HG2  THR  16          1HG2      THR  16  -2.098 -11.102 -14.743
  125   2HG2  THR  16          2HG2      THR  16  -0.591 -11.946 -14.352
  126   3HG2  THR  16          3HG2      THR  16  -1.695 -11.470 -13.047
  127    H    CYS  17           H        CYS  17   0.405  -7.382 -13.458
  128    HA   CYS  17           HA       CYS  17   3.287  -7.245 -14.174
  129   1HB   CYS  17          2HB       CYS  17   2.755  -5.548 -15.691
  130   2HB   CYS  17          3HB       CYS  17   1.556  -6.824 -15.930
  131    H    ALA  18           H        ALA  18   4.554  -5.483 -13.655
  132    HA   ALA  18           HA       ALA  18   4.163  -4.346 -11.007
  133   1HB   ALA  18          1HB       ALA  18   6.300  -3.897 -13.138
  134   2HB   ALA  18          2HB       ALA  18   6.380  -3.337 -11.459
  135   3HB   ALA  18          3HB       ALA  18   6.376  -5.076 -11.814
  136    H    ALA  19           H        ALA  19   1.993  -3.507 -12.270
  137    HA   ALA  19           HA       ALA  19   2.408  -0.583 -12.540
  138   1HB   ALA  19          1HB       ALA  19   2.558  -1.507 -14.866
  139   2HB   ALA  19          2HB       ALA  19   0.897  -2.115 -14.686
  140   3HB   ALA  19          3HB       ALA  19   1.213  -0.375 -14.611
  141    H    CYS  20           H        CYS  20  -0.096  -3.239 -12.632
  142    HA   CYS  20           HA       CYS  20  -2.170  -1.623 -11.561
  143   1HB   CYS  20          2HB       CYS  20  -1.716  -4.609 -11.104
  144   2HB   CYS  20          3HB       CYS  20  -3.229  -3.710 -10.874
  145    H    ALA  21           H        ALA  21   0.451  -3.399  -9.981
  146    HA   ALA  21           HA       ALA  21  -0.107  -2.994  -7.303
  147   1HB   ALA  21          1HB       ALA  21   1.891  -4.187  -8.409
  148   2HB   ALA  21          2HB       ALA  21   2.649  -2.590  -8.514
  149   3HB   ALA  21          3HB       ALA  21   2.208  -3.278  -6.929
  150    H    ALA  22           H        ALA  22   0.683  -0.469  -9.684
  151    HA   ALA  22           HA       ALA  22   1.386   1.524  -7.664
  152   1HB   ALA  22          1HB       ALA  22   2.063   1.518 -10.158
  153   2HB   ALA  22          2HB       ALA  22   0.410   2.087 -10.480
  154   3HB   ALA  22          3HB       ALA  22   1.495   3.043  -9.451
  155    H    ARG  23           H        ARG  23  -1.480   0.486  -9.515
  156    HA   ARG  23           HA       ARG  23  -3.176   2.691  -8.878
  157   1HB   ARG  23          2HB       ARG  23  -3.872  -0.189  -9.598
  158   2HB   ARG  23          3HB       ARG  23  -5.025   1.143  -9.509
  159   1HG   ARG  23          2HG       ARG  23  -3.925   2.356 -11.278
  160   2HG   ARG  23          3HG       ARG  23  -2.564   1.219 -11.311
  161   1HD   ARG  23          2HD       ARG  23  -4.149  -0.605 -11.982
  162   2HD   ARG  23          3HD       ARG  23  -5.440   0.584 -12.071
  163    HE   ARG  23           HE       ARG  23  -4.177   1.814 -13.760
  164   1HH1  ARG  23          2HH2      ARG  23  -3.313  -1.688 -13.463
  165   2HH1  ARG  23          1HH2      ARG  23  -2.561  -1.722 -14.990
  166   1HH2  ARG  23          2HH1      ARG  23  -3.114   1.703 -15.756
  167   2HH2  ARG  23          1HH1      ARG  23  -2.456   0.206 -16.326
  168    H    ILE  24           H        ILE  24  -2.600  -0.476  -7.270
  169    HA   ILE  24           HA       ILE  24  -4.562  -0.036  -5.288
  170    HB   ILE  24           HB       ILE  24  -3.772  -1.756  -4.015
  171   1HG1  ILE  24          2HG1      ILE  24  -1.170  -1.345  -5.372
  172   2HG1  ILE  24          3HG1      ILE  24  -1.535  -1.242  -3.633
  173   1HG2  ILE  24          1HG2      ILE  24  -2.968  -2.561  -6.836
  174   2HG2  ILE  24          2HG2      ILE  24  -3.831  -3.484  -5.591
  175   3HG2  ILE  24          3HG2      ILE  24  -4.650  -2.169  -6.418
  176   1HD1  ILE  24          1HD1      ILE  24  -1.361  -3.713  -5.354
  177   2HD1  ILE  24          2HD1      ILE  24  -0.242  -3.230  -4.077
  178   3HD1  ILE  24          3HD1      ILE  24  -1.900  -3.713  -3.645
  179    H    GLU  25           H        GLU  25  -1.012   0.585  -4.938
  180    HA   GLU  25           HA       GLU  25  -1.177   1.959  -2.531
  181   1HB   GLU  25          2HB       GLU  25   0.763   1.851  -4.791
  182   2HB   GLU  25          3HB       GLU  25   0.855   3.319  -3.802
  183   1HG   GLU  25          2HG       GLU  25   2.338   1.508  -2.959
  184   2HG   GLU  25          3HG       GLU  25   1.145   2.036  -1.767
  185    H    LYS  26           H        LYS  26  -1.928   3.281  -5.766
  186    HA   LYS  26           HA       LYS  26  -1.994   5.994  -4.704
  187   1HB   LYS  26          2HB       LYS  26  -2.740   4.882  -7.383
  188   2HB   LYS  26          3HB       LYS  26  -3.242   6.497  -6.879
  189   1HG   LYS  26          2HG       LYS  26  -1.212   6.843  -8.003
  190   2HG   LYS  26          3HG       LYS  26  -0.840   7.053  -6.284
  191   1HD   LYS  26          2HD       LYS  26   0.089   4.704  -6.248
  192   2HD   LYS  26          3HD       LYS  26  -0.421   4.579  -7.930
  193   1HE   LYS  26          2HE       LYS  26   1.940   4.941  -7.934
  194   2HE   LYS  26          3HE       LYS  26   1.168   6.401  -8.552
  195   1HZ   LYS  26          1HZ       LYS  26   2.186   6.056  -5.763
  196   2HZ   LYS  26          2HZ       LYS  26   2.924   6.876  -6.980
  197   3HZ   LYS  26          3HZ       LYS  26   1.497   7.408  -6.383
  198    H    GLY  27           H        GLY  27  -4.534   3.584  -5.561
  199   1HA   GLY  27          2HA       GLY  27  -6.787   5.167  -4.756
  200   2HA   GLY  27          3HA       GLY  27  -6.707   3.399  -4.857
  201    H    LEU  28           H        LEU  28  -4.528   3.055  -3.053
  202    HA   LEU  28           HA       LEU  28  -5.795   2.970  -0.447
  203   1HB   LEU  28          2HB       LEU  28  -4.242   1.363  -1.259
  204   2HB   LEU  28          3HB       LEU  28  -2.960   2.566  -1.374
  205    HG   LEU  28           HG       LEU  28  -4.300   1.881   1.266
  206   1HD1  LEU  28          1HD1      LEU  28  -3.544  -0.182   0.328
  207   2HD1  LEU  28          2HD1      LEU  28  -1.998   0.532  -0.178
  208   3HD1  LEU  28          3HD1      LEU  28  -2.346   0.295   1.542
  209   1HD2  LEU  28          1HD2      LEU  28  -1.614   3.104   0.427
  210   2HD2  LEU  28          2HD2      LEU  28  -2.955   3.930   1.248
  211   3HD2  LEU  28          3HD2      LEU  28  -2.042   2.694   2.095
  212    H    LYS  29           H        LYS  29  -3.217   5.016  -1.880
  213    HA   LYS  29           HA       LYS  29  -2.827   6.725   0.267
  214   1HB   LYS  29          2HB       LYS  29  -1.506   6.458  -1.869
  215   2HB   LYS  29          3HB       LYS  29  -2.671   7.513  -2.664
  216   1HG   LYS  29          2HG       LYS  29  -1.656   8.744  -0.193
  217   2HG   LYS  29          3HG       LYS  29  -0.368   8.049  -1.138
  218   1HD   LYS  29          2HD       LYS  29  -0.510  10.280  -2.002
  219   2HD   LYS  29          3HD       LYS  29  -1.233   9.240  -3.205
  220   1HE   LYS  29          2HE       LYS  29  -2.434  11.327  -2.754
  221   2HE   LYS  29          3HE       LYS  29  -3.458   9.899  -2.475
  222   1HZ   LYS  29          1HZ       LYS  29  -2.011  11.249  -0.286
  223   2HZ   LYS  29          2HZ       LYS  29  -3.536  11.715  -0.720
  224   3HZ   LYS  29          3HZ       LYS  29  -3.282  10.193  -0.164
  225    H    ARG  30           H        ARG  30  -5.522   6.649  -1.926
  226    HA   ARG  30           HA       ARG  30  -6.472   9.344  -1.406
  227   1HB   ARG  30          2HB       ARG  30  -7.161   7.074  -3.080
  228   2HB   ARG  30          3HB       ARG  30  -8.611   7.627  -2.263
  229   1HG   ARG  30          2HG       ARG  30  -6.735   9.588  -3.648
  230   2HG   ARG  30          3HG       ARG  30  -7.849   8.590  -4.588
  231   1HD   ARG  30          2HD       ARG  30  -9.763   9.396  -3.355
  232   2HD   ARG  30          3HD       ARG  30  -8.737  10.418  -2.319
  233    HE   ARG  30           HE       ARG  30  -8.063  11.232  -4.848
  234   1HH1  ARG  30          2HH2      ARG  30 -11.142  10.973  -3.151
  235   2HH1  ARG  30          1HH2      ARG  30 -11.950  12.193  -4.083
  236   1HH2  ARG  30          2HH1      ARG  30  -9.080  12.906  -6.075
  237   2HH2  ARG  30          1HH1      ARG  30 -10.727  13.342  -5.765
  238    H    MET  31           H        MET  31  -6.379   6.572   0.611
  239    HA   MET  31           HA       MET  31  -8.911   6.978   1.913
  240   1HB   MET  31          2HB       MET  31  -8.269   5.164   3.276
  241   2HB   MET  31          3HB       MET  31  -7.487   4.850   1.723
  242   1HG   MET  31          2HG       MET  31  -5.378   5.847   2.809
  243   2HG   MET  31          3HG       MET  31  -6.293   5.798   4.305
  244   1HE   MET  31          1HE       MET  31  -5.220   2.628   5.679
  245   2HE   MET  31          2HE       MET  31  -4.254   4.044   5.424
  246   3HE   MET  31          3HE       MET  31  -5.975   4.223   5.852
  247    HA   PRO  32           HA       PRO  32  -7.686  10.088   4.911
  248   1HB   PRO  32          2HB       PRO  32  -8.977   9.308   7.205
  249   2HB   PRO  32          3HB       PRO  32  -9.832  10.012   5.801
  250   1HG   PRO  32          2HG       PRO  32  -9.482   7.076   6.459
  251   2HG   PRO  32          3HG       PRO  32 -11.003   7.929   6.061
  252   1HD   PRO  32          2HD       PRO  32  -9.646   6.565   4.185
  253   2HD   PRO  32          3HD       PRO  32 -10.370   8.137   3.762
  254    H    GLY  33           H        GLY  33  -5.841  10.255   6.161
  255   1HA   GLY  33          2HA       GLY  33  -4.377   9.583   7.857
  256   2HA   GLY  33          3HA       GLY  33  -4.847   7.897   7.673
  257    H    VAL  34           H        VAL  34  -4.478   8.046   4.559
  258    HA   VAL  34           HA       VAL  34  -1.520   7.862   4.675
  259    HB   VAL  34           HB       VAL  34  -3.372   7.053   2.449
  260   1HG1  VAL  34          1HG1      VAL  34  -1.316   5.734   1.777
  261   2HG1  VAL  34          2HG1      VAL  34  -1.056   7.483   1.693
  262   3HG1  VAL  34          3HG1      VAL  34  -0.404   6.562   3.047
  263   1HG2  VAL  34          1HG2      VAL  34  -3.789   5.824   4.502
  264   2HG2  VAL  34          2HG2      VAL  34  -2.982   4.765   3.331
  265   3HG2  VAL  34          3HG2      VAL  34  -2.078   5.435   4.700
  266    H    THR  35           H        THR  35  -0.248   9.449   4.033
  267    HA   THR  35           HA       THR  35  -1.412  11.707   2.570
  268    HB   THR  35           HB       THR  35   1.202  11.400   3.927
  269    HG1  THR  35           1HG      THR  35  -0.191  11.704   5.613
  270   1HG2  THR  35          1HG2      THR  35   1.208  13.874   3.823
  271   2HG2  THR  35          2HG2      THR  35   1.312  13.150   2.201
  272   3HG2  THR  35          3HG2      THR  35  -0.235  13.825   2.789
  273    H    ASP  36           H        ASP  36   1.429   9.405   2.112
  274    HA   ASP  36           HA       ASP  36   1.034   9.679  -0.771
  275   1HB   ASP  36          2HB       ASP  36   3.450  10.654   0.653
  276   2HB   ASP  36          3HB       ASP  36   3.726   9.645  -0.770
  277    H    ALA  37           H        ALA  37   1.962   8.003  -1.970
  278    HA   ALA  37           HA       ALA  37   3.072   5.707  -0.539
  279   1HB   ALA  37          1HB       ALA  37   0.537   5.540  -0.202
  280   2HB   ALA  37          2HB       ALA  37   0.434   5.220  -1.947
  281   3HB   ALA  37          3HB       ALA  37   1.338   4.116  -0.891
  282    H    ASN  38           H        ASN  38   3.941   3.918  -1.819
  283    HA   ASN  38           HA       ASN  38   4.372   4.543  -4.674
  284   1HB   ASN  38          2HB       ASN  38   6.986   4.395  -3.625
  285   2HB   ASN  38          3HB       ASN  38   6.184   5.797  -4.304
  286   1HD2  ASN  38          1HD2      ASN  38   6.019   4.082  -1.132
  287   2HD2  ASN  38          2HD2      ASN  38   6.312   5.544  -0.183
  288    H    VAL  39           H        VAL  39   4.158   2.515  -5.476
  289    HA   VAL  39           HA       VAL  39   4.875   0.226  -3.851
  290    HB   VAL  39           HB       VAL  39   2.907   0.412  -5.361
  291   1HG1  VAL  39          1HG1      VAL  39   4.062   1.356  -7.385
  292   2HG1  VAL  39          2HG1      VAL  39   4.841  -0.225  -7.637
  293   3HG1  VAL  39          3HG1      VAL  39   3.108  -0.095  -7.719
  294   1HG2  VAL  39          1HG2      VAL  39   4.059  -2.038  -6.370
  295   2HG2  VAL  39          2HG2      VAL  39   4.442  -1.825  -4.650
  296   3HG2  VAL  39          3HG2      VAL  39   2.761  -1.789  -5.192
  297    H    ASN  40           H        ASN  40   7.000  -0.552  -3.719
  298    HA   ASN  40           HA       ASN  40   8.950   0.342  -5.788
  299   1HB   ASN  40          2HB       ASN  40   9.317   0.901  -3.382
  300   2HB   ASN  40          3HB       ASN  40   9.523  -0.815  -3.049
  301   1HD2  ASN  40          1HD2      ASN  40  11.213  -1.908  -4.575
  302   2HD2  ASN  40          2HD2      ASN  40  12.674  -0.956  -4.894
  303    H    LEU  41           H        LEU  41   7.387  -1.277  -6.905
  304    HA   LEU  41           HA       LEU  41   7.778  -4.080  -6.511
  305   1HB   LEU  41          2HB       LEU  41   6.195  -2.349  -8.181
  306   2HB   LEU  41          3HB       LEU  41   7.017  -3.467  -9.248
  307    HG   LEU  41           HG       LEU  41   4.715  -4.071  -8.418
  308   1HD1  LEU  41          1HD1      LEU  41   6.132  -5.721  -9.533
  309   2HD1  LEU  41          2HD1      LEU  41   6.938  -6.106  -8.001
  310   3HD1  LEU  41          3HD1      LEU  41   5.215  -6.475  -8.218
  311   1HD2  LEU  41          1HD2      LEU  41   4.237  -4.731  -6.315
  312   2HD2  LEU  41          2HD2      LEU  41   5.873  -5.303  -5.949
  313   3HD2  LEU  41          3HD2      LEU  41   5.520  -3.576  -5.890
  314    H    ALA  42           H        ALA  42   9.738  -1.721  -8.028
  315    HA   ALA  42           HA       ALA  42  11.418  -3.001  -9.769
  316   1HB   ALA  42          1HB       ALA  42  11.733  -0.684  -8.934
  317   2HB   ALA  42          2HB       ALA  42  12.249  -1.345  -7.357
  318   3HB   ALA  42          3HB       ALA  42  13.227  -1.648  -8.803
  319    H    THR  43           H        THR  43  11.269  -3.548  -6.220
  320    HA   THR  43           HA       THR  43  12.789  -6.040  -6.703
  321    HB   THR  43           HB       THR  43  14.458  -4.610  -5.758
  322    HG1  THR  43           1HG      THR  43  13.387  -6.487  -3.953
  323   1HG2  THR  43          1HG2      THR  43  12.334  -3.887  -3.745
  324   2HG2  THR  43          2HG2      THR  43  14.036  -3.919  -3.244
  325   3HG2  THR  43          3HG2      THR  43  13.537  -2.874  -4.577
  326    H    GLU  44           H        GLU  44  10.003  -5.628  -6.721
  327    HA   GLU  44           HA       GLU  44   8.109  -6.512  -5.946
  328   1HB   GLU  44          2HB       GLU  44  10.247  -8.451  -5.678
  329   2HB   GLU  44          3HB       GLU  44   9.057  -8.772  -4.433
  330   1HG   GLU  44          2HG       GLU  44   8.351  -8.401  -7.378
  331   2HG   GLU  44          3HG       GLU  44   8.682  -9.961  -6.611
  332    H    THR  45           H        THR  45   9.013  -4.367  -4.279
  333    HA   THR  45           HA       THR  45   7.909  -5.136  -1.631
  334    HB   THR  45           HB       THR  45   9.846  -2.887  -2.306
  335    HG1  THR  45           1HG      THR  45  11.449  -4.404  -1.530
  336   1HG2  THR  45          1HG2      THR  45  10.482  -3.158   0.070
  337   2HG2  THR  45          2HG2      THR  45   8.762  -2.768  -0.089
  338   3HG2  THR  45          3HG2      THR  45   9.267  -4.449   0.232
  339    H    VAL  46           H        VAL  46   6.689  -3.361  -0.560
  340    HA   VAL  46           HA       VAL  46   5.687  -1.193  -2.363
  341    HB   VAL  46           HB       VAL  46   3.841  -2.598  -2.344
  342   1HG1  VAL  46          1HG1      VAL  46   4.467  -4.369  -0.872
  343   2HG1  VAL  46          2HG1      VAL  46   4.594  -3.244   0.493
  344   3HG1  VAL  46          3HG1      VAL  46   3.002  -3.659  -0.162
  345   1HG2  VAL  46          1HG2      VAL  46   3.375  -0.937   0.175
  346   2HG2  VAL  46          2HG2      VAL  46   3.283  -0.309  -1.490
  347   3HG2  VAL  46          3HG2      VAL  46   2.171  -1.584  -0.941
  348    H    ASN  47           H        ASN  47   5.440   0.919  -1.337
  349    HA   ASN  47           HA       ASN  47   6.199   0.996   1.508
  350   1HB   ASN  47          2HB       ASN  47   7.437   2.531  -0.820
  351   2HB   ASN  47          3HB       ASN  47   7.411   3.190   0.819
  352   1HD2  ASN  47          1HD2      ASN  47   8.284   1.681   2.589
  353   2HD2  ASN  47          2HD2      ASN  47   9.846   0.999   2.154
  354    H    VAL  48           H        VAL  48   5.188   2.751   2.628
  355    HA   VAL  48           HA       VAL  48   3.171   4.270   1.132
  356    HB   VAL  48           HB       VAL  48   2.075   2.169   1.466
  357   1HG1  VAL  48          1HG1      VAL  48   3.359   1.183   3.265
  358   2HG1  VAL  48          2HG1      VAL  48   2.741   2.371   4.421
  359   3HG1  VAL  48          3HG1      VAL  48   1.646   1.194   3.669
  360   1HG2  VAL  48          1HG2      VAL  48   1.064   4.379   3.284
  361   2HG2  VAL  48          2HG2      VAL  48   0.653   4.049   1.601
  362   3HG2  VAL  48          3HG2      VAL  48   0.148   2.918   2.859
  363    H    ILE  49           H        ILE  49   3.039   6.229   1.953
  364    HA   ILE  49           HA       ILE  49   4.697   6.844   4.301
  365    HB   ILE  49           HB       ILE  49   3.881   8.754   2.081
  366   1HG1  ILE  49          2HG1      ILE  49   5.028   7.087   0.858
  367   2HG1  ILE  49          3HG1      ILE  49   6.085   8.474   1.076
  368   1HG2  ILE  49          1HG2      ILE  49   6.088   8.830   4.169
  369   2HG2  ILE  49          2HG2      ILE  49   5.835  10.026   2.877
  370   3HG2  ILE  49          3HG2      ILE  49   4.613   9.807   4.136
  371   1HD1  ILE  49          1HD1      ILE  49   6.266   5.803   2.525
  372   2HD1  ILE  49          2HD1      ILE  49   7.420   6.514   1.387
  373   3HD1  ILE  49          3HD1      ILE  49   7.203   7.244   2.983
  374    H    TYR  50           H        TYR  50   3.058   6.636   5.887
  375    HA   TYR  50           HA       TYR  50   0.546   8.254   5.530
  376   1HB   TYR  50          2HB       TYR  50  -0.768   6.559   6.543
  377   2HB   TYR  50          3HB       TYR  50   0.050   5.898   5.145
  378    HD1  TYR  50           HD1      TYR  50  -0.114   5.894   8.855
  379    HD2  TYR  50           HD2      TYR  50   1.610   4.077   5.362
  380    HE1  TYR  50           HE1      TYR  50   0.489   3.905  10.181
  381    HE2  TYR  50           HE2      TYR  50   1.893   1.960   6.615
  382    HH   TYR  50           HH       TYR  50   0.478   1.078   8.791
  383    H    ASP  51           H        ASP  51  -0.522   8.529   7.587
  384    HA   ASP  51           HA       ASP  51   1.432   9.458   9.556
  385   1HB   ASP  51          2HB       ASP  51  -1.522   9.981   9.232
  386   2HB   ASP  51          3HB       ASP  51  -0.396  10.698  10.405
  387    HA   PRO  52           HA       PRO  52   0.079   5.659  11.683
  388   1HB   PRO  52          2HB       PRO  52   2.246   5.039  13.192
  389   2HB   PRO  52          3HB       PRO  52   2.226   4.823  11.430
  390   1HG   PRO  52          2HG       PRO  52   3.241   7.262  12.951
  391   2HG   PRO  52          3HG       PRO  52   4.133   6.288  11.747
  392   1HD   PRO  52          2HD       PRO  52   2.867   8.532  11.013
  393   2HD   PRO  52          3HD       PRO  52   2.780   7.072   9.976
  394    H    ALA  53           H        ALA  53  -0.134   8.661  12.704
  395    HA   ALA  53           HA       ALA  53  -0.598   8.144  15.589
  396   1HB   ALA  53          1HB       ALA  53  -1.173  10.562  15.586
  397   2HB   ALA  53          2HB       ALA  53   0.490  10.271  15.025
  398   3HB   ALA  53          3HB       ALA  53  -0.798  10.638  13.848
  399    H    GLU  54           H        GLU  54  -2.042   8.154  12.408
  400    HA   GLU  54           HA       GLU  54  -4.785   8.268  13.519
  401   1HB   GLU  54          2HB       GLU  54  -3.564   9.945  11.632
  402   2HB   GLU  54          3HB       GLU  54  -4.440   8.805  10.613
  403   1HG   GLU  54          2HG       GLU  54  -5.750  10.268  12.953
  404   2HG   GLU  54          3HG       GLU  54  -5.626  10.954  11.332
  405    H    THR  55           H        THR  55  -2.827   6.997  10.794
  406    HA   THR  55           HA       THR  55  -4.399   4.520  10.803
  407    HB   THR  55           HB       THR  55  -2.747   4.155   8.634
  408    HG1  THR  55           1HG      THR  55  -3.233   6.916   8.860
  409   1HG2  THR  55          1HG2      THR  55  -5.440   5.564   8.971
  410   2HG2  THR  55          2HG2      THR  55  -4.707   5.170   7.398
  411   3HG2  THR  55          3HG2      THR  55  -5.085   3.857   8.555
  412    H    GLY  56           H        GLY  56  -2.985   2.731   9.981
  413   1HA   GLY  56          2HA       GLY  56  -0.503   2.173  11.276
  414   2HA   GLY  56          3HA       GLY  56  -1.877   1.373  12.075
  415    H    THR  57           H        THR  57  -2.228  -0.593  11.203
  416    HA   THR  57           HA       THR  57  -1.544  -1.360   8.455
  417    HB   THR  57           HB       THR  57  -2.103  -3.632   9.535
  418    HG1  THR  57           1HG      THR  57  -2.052  -3.501  11.857
  419   1HG2  THR  57          1HG2      THR  57   0.092  -3.665  10.745
  420   2HG2  THR  57          2HG2      THR  57   0.229  -2.774   9.219
  421   3HG2  THR  57          3HG2      THR  57   0.137  -1.891  10.750
  422    H    ALA  58           H        ALA  58  -4.133  -0.619  10.679
  423    HA   ALA  58           HA       ALA  58  -6.029  -2.289   9.993
  424   1HB   ALA  58          1HB       ALA  58  -7.664  -0.695  10.947
  425   2HB   ALA  58          2HB       ALA  58  -6.176  -0.795  11.907
  426   3HB   ALA  58          3HB       ALA  58  -6.450   0.595  10.837
  427    H    ALA  59           H        ALA  59  -5.802   0.872   8.593
  428    HA   ALA  59           HA       ALA  59  -8.233   0.309   6.943
  429   1HB   ALA  59          1HB       ALA  59  -7.865   2.663   6.084
  430   2HB   ALA  59          2HB       ALA  59  -8.339   2.442   7.778
  431   3HB   ALA  59          3HB       ALA  59  -6.661   2.807   7.399
  432    H    ILE  60           H        ILE  60  -4.808   0.173   6.706
  433    HA   ILE  60           HA       ILE  60  -4.561   0.374   3.853
  434    HB   ILE  60           HB       ILE  60  -2.822  -0.158   6.234
  435   1HG1  ILE  60          2HG1      ILE  60  -2.452   1.153   3.558
  436   2HG1  ILE  60          3HG1      ILE  60  -3.235   1.964   4.900
  437   1HG2  ILE  60          1HG2      ILE  60  -1.971  -1.193   3.498
  438   2HG2  ILE  60          2HG2      ILE  60  -0.939  -0.997   4.935
  439   3HG2  ILE  60          3HG2      ILE  60  -2.231  -2.184   4.952
  440   1HD1  ILE  60          1HD1      ILE  60  -1.185   1.697   6.302
  441   2HD1  ILE  60          2HD1      ILE  60  -0.319   1.136   4.856
  442   3HD1  ILE  60          3HD1      ILE  60  -0.998   2.774   4.913
  443    H    GLN  61           H        GLN  61  -4.753  -2.366   6.143
  444    HA   GLN  61           HA       GLN  61  -4.463  -4.359   4.088
  445   1HB   GLN  61          2HB       GLN  61  -5.205  -4.295   6.966
  446   2HB   GLN  61          3HB       GLN  61  -6.037  -5.512   5.996
  447   1HG   GLN  61          2HG       GLN  61  -4.169  -6.593   6.887
  448   2HG   GLN  61          3HG       GLN  61  -3.960  -6.436   5.142
  449   1HE2  GLN  61          1HE2      GLN  61  -3.321  -3.472   7.058
  450   2HE2  GLN  61          2HE2      GLN  61  -1.583  -3.659   6.936
  451    H    GLU  62           H        GLU  62  -7.309  -2.806   5.632
  452    HA   GLU  62           HA       GLU  62  -9.427  -3.974   4.223
  453   1HB   GLU  62          2HB       GLU  62  -8.868  -1.372   5.585
  454   2HB   GLU  62          3HB       GLU  62 -10.191  -1.326   4.426
  455   1HG   GLU  62          2HG       GLU  62 -10.033  -3.479   6.566
  456   2HG   GLU  62          3HG       GLU  62 -10.750  -1.892   6.868
  457    H    LYS  63           H        LYS  63  -7.652  -0.968   3.245
  458    HA   LYS  63           HA       LYS  63  -8.963  -0.782   0.768
  459   1HB   LYS  63          2HB       LYS  63  -6.526   0.393   2.101
  460   2HB   LYS  63          3HB       LYS  63  -6.728   0.636   0.391
  461   1HG   LYS  63          2HG       LYS  63  -8.969   1.142   2.360
  462   2HG   LYS  63          3HG       LYS  63  -7.789   2.397   1.962
  463   1HD   LYS  63          2HD       LYS  63  -8.651   2.813  -0.118
  464   2HD   LYS  63          3HD       LYS  63  -8.936   1.118  -0.462
  465   1HE   LYS  63          2HE       LYS  63 -11.059   2.298  -0.417
  466   2HE   LYS  63          3HE       LYS  63 -10.988   1.087   0.870
  467   1HZ   LYS  63          1HZ       LYS  63 -10.537   3.982   1.219
  468   2HZ   LYS  63          2HZ       LYS  63 -11.898   3.158   1.643
  469   3HZ   LYS  63          3HZ       LYS  63 -10.482   2.855   2.418
  470    H    ILE  64           H        ILE  64  -5.928  -2.466   1.661
  471    HA   ILE  64           HA       ILE  64  -4.870  -3.071  -0.817
  472    HB   ILE  64           HB       ILE  64  -4.786  -4.081   1.925
  473   1HG1  ILE  64          2HG1      ILE  64  -3.230  -2.442   0.892
  474   2HG1  ILE  64          3HG1      ILE  64  -2.519  -3.817   1.726
  475   1HG2  ILE  64          1HG2      ILE  64  -5.187  -6.223   1.170
  476   2HG2  ILE  64          2HG2      ILE  64  -4.176  -6.012  -0.283
  477   3HG2  ILE  64          3HG2      ILE  64  -3.442  -6.081   1.337
  478   1HD1  ILE  64          1HD1      ILE  64  -2.163  -4.972  -0.436
  479   2HD1  ILE  64          2HD1      ILE  64  -2.790  -3.549  -1.289
  480   3HD1  ILE  64          3HD1      ILE  64  -1.305  -3.423  -0.313
  481    H    GLU  65           H        GLU  65  -7.211  -4.939   1.212
  482    HA   GLU  65           HA       GLU  65  -7.883  -6.948  -0.682
  483   1HB   GLU  65          2HB       GLU  65  -9.274  -5.794   1.761
  484   2HB   GLU  65          3HB       GLU  65 -10.012  -7.073   0.801
  485   1HG   GLU  65          2HG       GLU  65  -7.187  -7.383   1.828
  486   2HG   GLU  65          3HG       GLU  65  -8.576  -7.728   2.861
  487    H    LYS  66           H        LYS  66  -9.646  -3.917   0.164
  488    HA   LYS  66           HA       LYS  66 -11.728  -4.321  -1.661
  489   1HB   LYS  66          2HB       LYS  66 -10.727  -2.064  -0.043
  490   2HB   LYS  66          3HB       LYS  66 -11.459  -1.510  -1.546
  491   1HG   LYS  66          2HG       LYS  66 -12.766  -3.436   0.412
  492   2HG   LYS  66          3HG       LYS  66 -13.075  -1.702   0.358
  493   1HD   LYS  66          2HD       LYS  66 -14.503  -1.874  -1.389
  494   2HD   LYS  66          3HD       LYS  66 -13.338  -2.788  -2.341
  495   1HE   LYS  66          2HE       LYS  66 -14.009  -4.861  -0.948
  496   2HE   LYS  66          3HE       LYS  66 -15.352  -3.884  -0.333
  497   1HZ   LYS  66          1HZ       LYS  66 -14.810  -4.567  -3.154
  498   2HZ   LYS  66          2HZ       LYS  66 -15.993  -5.208  -2.211
  499   3HZ   LYS  66          3HZ       LYS  66 -16.062  -3.622  -2.647
  500    H    LEU  67           H        LEU  67  -8.586  -2.843  -2.268
  501    HA   LEU  67           HA       LEU  67  -9.166  -2.029  -4.982
  502   1HB   LEU  67          2HB       LEU  67  -6.640  -2.388  -3.340
  503   2HB   LEU  67          3HB       LEU  67  -6.585  -1.891  -5.032
  504    HG   LEU  67           HG       LEU  67  -8.407  -0.380  -3.138
  505   1HD1  LEU  67          1HD1      LEU  67  -6.454  -0.174  -1.856
  506   2HD1  LEU  67          2HD1      LEU  67  -5.401  -0.194  -3.257
  507   3HD1  LEU  67          3HD1      LEU  67  -6.401   1.234  -2.912
  508   1HD2  LEU  67          1HD2      LEU  67  -8.002   1.442  -4.688
  509   2HD2  LEU  67          2HD2      LEU  67  -6.781   0.500  -5.565
  510   3HD2  LEU  67          3HD2      LEU  67  -8.485   0.023  -5.620
  511    H    GLY  68           H        GLY  68  -8.570  -5.110  -3.555
  512   1HA   GLY  68          2HA       GLY  68  -8.876  -7.109  -4.644
  513   2HA   GLY  68          3HA       GLY  68  -8.615  -6.348  -6.219
  514    H    TYR  69           H        TYR  69  -6.528  -6.229  -3.253
  515    HA   TYR  69           HA       TYR  69  -4.453  -7.851  -4.663
  516   1HB   TYR  69          2HB       TYR  69  -4.417  -5.027  -4.073
  517   2HB   TYR  69          3HB       TYR  69  -3.275  -5.805  -3.004
  518    HD1  TYR  69           HD1      TYR  69  -4.356  -5.686  -6.586
  519    HD2  TYR  69           HD2      TYR  69  -1.155  -6.553  -3.833
  520    HE1  TYR  69           HE1      TYR  69  -2.748  -5.519  -8.419
  521    HE2  TYR  69           HE2      TYR  69   0.466  -6.347  -5.647
  522    HH   TYR  69           HH       TYR  69   0.766  -5.999  -7.942
  523    H    HIS  70           H        HIS  70  -2.654  -8.368  -2.980
  524    HA   HIS  70           HA       HIS  70  -3.666  -8.418  -0.231
  525   1HB   HIS  70          2HB       HIS  70  -4.280 -10.602  -1.329
  526   2HB   HIS  70          3HB       HIS  70  -2.553 -10.917  -1.553
  527    HD1  HIS  70           1HD      HIS  70  -3.916  -9.401   1.733
  528    HD2  HIS  70           2HD      HIS  70  -2.809 -13.099   0.066
  529    HE1  HIS  70           1HE      HIS  70  -3.681 -11.029   3.673
  530    H    VAL  71           H        VAL  71  -2.045  -8.382   1.292
  531    HA   VAL  71           HA       VAL  71   0.633  -7.539   0.338
  532    HB   VAL  71           HB       VAL  71  -0.815  -5.743   1.157
  533   1HG1  VAL  71          1HG1      VAL  71  -2.113  -7.098   2.889
  534   2HG1  VAL  71          2HG1      VAL  71  -0.657  -7.069   3.897
  535   3HG1  VAL  71          3HG1      VAL  71  -1.477  -5.553   3.469
  536   1HG2  VAL  71          1HG2      VAL  71   0.702  -4.739   2.750
  537   2HG2  VAL  71          2HG2      VAL  71   1.576  -6.272   2.942
  538   3HG2  VAL  71          3HG2      VAL  71   1.544  -5.437   1.364
  539    H    VAL  72           H        VAL  72   2.405  -8.198   1.717
  540    HA   VAL  72           HA       VAL  72   1.829 -10.366   3.663
  541    HB   VAL  72           HB       VAL  72   3.961 -10.576   1.594
  542   1HG1  VAL  72          1HG1      VAL  72   4.398 -11.857   3.663
  543   2HG1  VAL  72          2HG1      VAL  72   2.786 -12.600   3.546
  544   3HG1  VAL  72          3HG1      VAL  72   4.028 -12.950   2.330
  545   1HG2  VAL  72          1HG2      VAL  72   1.183 -11.823   1.601
  546   2HG2  VAL  72          2HG2      VAL  72   1.891 -10.774   0.346
  547   3HG2  VAL  72          3HG2      VAL  72   2.530 -12.403   0.605
  548    H    ILE  73           H        ILE  73   3.303 -10.423   5.359
  549    HA   ILE  73           HA       ILE  73   5.387  -8.321   5.446
  550    HB   ILE  73           HB       ILE  73   3.441  -9.112   7.610
  551   1HG1  ILE  73          2HG1      ILE  73   3.269  -6.440   7.367
  552   2HG1  ILE  73          3HG1      ILE  73   3.786  -6.777   5.726
  553   1HG2  ILE  73          1HG2      ILE  73   5.649  -8.674   8.640
  554   2HG2  ILE  73          2HG2      ILE  73   5.797  -7.181   7.687
  555   3HG2  ILE  73          3HG2      ILE  73   4.541  -7.344   8.939
  556   1HD1  ILE  73          1HD1      ILE  73   1.393  -6.674   5.825
  557   2HD1  ILE  73          2HD1      ILE  73   1.811  -8.386   5.613
  558   3HD1  ILE  73          3HD1      ILE  73   1.351  -7.785   7.221
  559    H    GLU  74           H        GLU  74   6.817 -10.117   4.632
  560    HA   GLU  74           HA       GLU  74   7.482 -12.183   6.425
  561   1HB   GLU  74          2HB       GLU  74   8.511 -11.196   3.786
  562   2HB   GLU  74          3HB       GLU  74   9.543 -12.197   4.797
  563   1HG   GLU  74          2HG       GLU  74   7.896 -13.977   4.893
  564   2HG   GLU  74          3HG       GLU  74   6.766 -13.031   3.904
  565    H    GLY  75           H        GLY  75   7.890  -9.050   6.775
  566   1HA   GLY  75          2HA       GLY  75  10.756  -8.910   7.458
  567   2HA   GLY  75          3HA       GLY  75   9.596  -7.578   7.388
  568    H    ARG  76           H        ARG  76   7.668  -9.073   9.183
  569    HA   ARG  76           HA       ARG  76   8.932  -8.193  11.697
  570   1HB   ARG  76          2HB       ARG  76   6.755  -7.047  10.743
  571   2HB   ARG  76          3HB       ARG  76   5.965  -8.537  11.299
  572   1HG   ARG  76          2HG       ARG  76   7.225  -8.087  13.549
  573   2HG   ARG  76          3HG       ARG  76   7.521  -6.470  12.902
  574   1HD   ARG  76          2HD       ARG  76   4.992  -6.184  12.703
  575   2HD   ARG  76          3HD       ARG  76   4.817  -7.821  13.325
  576    HE   ARG  76           HE       ARG  76   5.296  -7.186  15.453
  577   1HH1  ARG  76          2HH2      ARG  76   6.107  -4.532  13.296
  578   2HH1  ARG  76          1HH2      ARG  76   6.447  -3.377  14.549
  579   1HH2  ARG  76          2HH1      ARG  76   5.830  -5.726  17.164
  580   2HH2  ARG  76          1HH1      ARG  76   6.305  -4.097  16.815
  Start of MODEL    7
    1   1H    MET   1          H1        MET   1  -4.595  17.614  16.010
    2   2H    MET   1          H2        MET   1  -5.226  18.618  17.163
    3   3H    MET   1          H3        MET   1  -4.472  19.245  15.832
    4    HA   MET   1           HA       MET   1  -3.064  19.440  17.714
    5   1HB   MET   1          2HB       MET   1  -3.429  16.420  17.810
    6   2HB   MET   1          3HB       MET   1  -2.027  17.237  18.523
    7   1HG   MET   1          2HG       MET   1  -3.458  18.596  19.946
    8   2HG   MET   1          3HG       MET   1  -4.909  17.826  19.281
    9   1HE   MET   1          1HE       MET   1  -5.656  17.425  21.810
   10   2HE   MET   1          2HE       MET   1  -4.671  16.521  22.982
   11   3HE   MET   1          3HE       MET   1  -4.125  18.113  22.410
   12    H    LEU   2           H        LEU   2  -1.935  16.392  16.202
   13    HA   LEU   2           HA       LEU   2  -0.700  17.780  13.983
   14   1HB   LEU   2          2HB       LEU   2   1.540  17.297  14.512
   15   2HB   LEU   2          3HB       LEU   2   0.909  18.133  15.926
   16    HG   LEU   2           HG       LEU   2   1.337  15.105  15.668
   17   1HD1  LEU   2          1HD1      LEU   2   3.427  16.406  15.687
   18   2HD1  LEU   2          2HD1      LEU   2   2.922  17.194  17.200
   19   3HD1  LEU   2          3HD1      LEU   2   3.226  15.443  17.158
   20   1HD2  LEU   2          1HD2      LEU   2   1.072  15.135  18.173
   21   2HD2  LEU   2          2HD2      LEU   2   0.478  16.804  18.054
   22   3HD2  LEU   2          3HD2      LEU   2  -0.427  15.460  17.311
   23    H    SER   3           H        SER   3   0.467  16.101  12.626
   24    HA   SER   3           HA       SER   3  -0.338  13.299  13.167
   25   1HB   SER   3          2HB       SER   3  -0.252  14.402  10.318
   26   2HB   SER   3          3HB       SER   3  -0.884  12.884  10.901
   27    HG   SER   3           HG       SER   3  -1.945  15.446  11.540
   28    H    GLU   4           H        GLU   4   1.641  12.298  13.525
   29    HA   GLU   4           HA       GLU   4   4.106  13.277  12.258
   30   1HB   GLU   4          2HB       GLU   4   3.384  11.201  14.240
   31   2HB   GLU   4          3HB       GLU   4   4.672  10.765  13.137
   32   1HG   GLU   4          2HG       GLU   4   5.689  13.014  13.763
   33   2HG   GLU   4          3HG       GLU   4   4.563  12.968  15.123
   34    H    GLN   5           H        GLN   5   5.264  11.389  10.965
   35    HA   GLN   5           HA       GLN   5   3.335   9.883   9.276
   36   1HB   GLN   5          2HB       GLN   5   5.704  11.497   8.277
   37   2HB   GLN   5          3HB       GLN   5   4.808  10.262   7.378
   38   1HG   GLN   5          2HG       GLN   5   2.813  12.048   8.274
   39   2HG   GLN   5          3HG       GLN   5   4.153  13.083   7.794
   40   1HE2  GLN   5          1HE2      GLN   5   2.203  10.338   6.698
   41   2HE2  GLN   5          2HE2      GLN   5   2.364  10.595   4.996
   42    H    LYS   6           H        LYS   6   4.159   7.897   8.545
   43    HA   LYS   6           HA       LYS   6   6.940   7.291   8.996
   44   1HB   LYS   6          2HB       LYS   6   4.684   5.602  10.176
   45   2HB   LYS   6          3HB       LYS   6   6.292   4.947   9.895
   46   1HG   LYS   6          2HG       LYS   6   5.717   7.291  11.743
   47   2HG   LYS   6          3HG       LYS   6   5.964   5.611  12.242
   48   1HD   LYS   6          2HD       LYS   6   8.246   5.641  11.214
   49   2HD   LYS   6          3HD       LYS   6   8.010   7.329  10.749
   50   1HE   LYS   6          2HE       LYS   6   7.598   7.903  13.178
   51   2HE   LYS   6          3HE       LYS   6   8.180   6.273  13.580
   52   1HZ   LYS   6          1HZ       LYS   6  10.235   6.853  12.414
   53   2HZ   LYS   6          2HZ       LYS   6   9.642   8.352  12.082
   54   3HZ   LYS   6          3HZ       LYS   6   9.930   7.919  13.643
   55    H    GLU   7           H        GLU   7   7.688   5.545   7.975
   56    HA   GLU   7           HA       GLU   7   6.487   5.173   5.316
   57   1HB   GLU   7          2HB       GLU   7   9.421   4.857   5.946
   58   2HB   GLU   7          3HB       GLU   7   8.571   5.369   4.489
   59   1HG   GLU   7          2HG       GLU   7   9.652   7.289   5.271
   60   2HG   GLU   7          3HG       GLU   7   8.011   7.537   5.876
   61    H    ILE   8           H        ILE   8   5.388   3.171   5.670
   62    HA   ILE   8           HA       ILE   8   6.767   1.053   7.131
   63    HB   ILE   8           HB       ILE   8   4.220   0.911   5.627
   64   1HG1  ILE   8          2HG1      ILE   8   3.750   2.815   6.933
   65   2HG1  ILE   8          3HG1      ILE   8   2.928   1.395   7.589
   66   1HG2  ILE   8          1HG2      ILE   8   5.431  -0.552   7.926
   67   2HG2  ILE   8          2HG2      ILE   8   3.716  -0.746   7.462
   68   3HG2  ILE   8          3HG2      ILE   8   4.999  -1.181   6.317
   69   1HD1  ILE   8          1HD1      ILE   8   3.935   2.729   9.364
   70   2HD1  ILE   8          2HD1      ILE   8   4.650   1.097   9.250
   71   3HD1  ILE   8          3HD1      ILE   8   5.535   2.500   8.598
   72    H    ALA   9           H        ALA   9   7.112  -1.045   6.038
   73    HA   ALA   9           HA       ALA   9   7.345  -0.988   3.102
   74   1HB   ALA   9          1HB       ALA   9   9.484  -2.173   3.214
   75   2HB   ALA   9          2HB       ALA   9   9.644  -0.603   4.029
   76   3HB   ALA   9          3HB       ALA   9   9.478  -2.085   4.989
   77    H    MET  10           H        MET  10   6.559  -2.964   2.251
   78    HA   MET  10           HA       MET  10   6.686  -5.371   3.822
   79   1HB   MET  10          2HB       MET  10   4.391  -5.968   3.892
   80   2HB   MET  10          3HB       MET  10   4.646  -4.527   4.856
   81   1HG   MET  10          2HG       MET  10   3.557  -4.475   2.020
   82   2HG   MET  10          3HG       MET  10   2.531  -4.696   3.420
   83   1HE   MET  10          1HE       MET  10   2.351  -1.363   5.209
   84   2HE   MET  10          2HE       MET  10   1.611  -2.959   4.952
   85   3HE   MET  10          3HE       MET  10   3.241  -2.839   5.658
   86    H    GLN  11           H        GLN  11   5.373  -7.171   2.468
   87    HA   GLN  11           HA       GLN  11   6.507  -6.954  -0.276
   88   1HB   GLN  11          2HB       GLN  11   5.803  -9.243   1.616
   89   2HB   GLN  11          3HB       GLN  11   6.127  -9.526  -0.093
   90   1HG   GLN  11          2HG       GLN  11   8.035  -8.249   1.932
   91   2HG   GLN  11          3HG       GLN  11   8.129  -9.907   1.314
   92   1HE2  GLN  11          1HE2      GLN  11   8.031 -10.031  -1.213
   93   2HE2  GLN  11          2HE2      GLN  11   8.744  -8.692  -2.105
   94    H    VAL  12           H        VAL  12   5.238  -8.168  -1.984
   95    HA   VAL  12           HA       VAL  12   2.327  -7.536  -1.753
   96    HB   VAL  12           HB       VAL  12   4.130  -6.971  -4.135
   97   1HG1  VAL  12          1HG1      VAL  12   1.219  -6.264  -3.538
   98   2HG1  VAL  12          2HG1      VAL  12   2.143  -5.718  -4.951
   99   3HG1  VAL  12          3HG1      VAL  12   1.781  -7.436  -4.749
  100   1HG2  VAL  12          1HG2      VAL  12   3.712  -4.565  -3.592
  101   2HG2  VAL  12          2HG2      VAL  12   2.976  -5.068  -2.058
  102   3HG2  VAL  12          3HG2      VAL  12   4.704  -5.378  -2.379
  103    H    SER  13           H        SER  13   1.005  -9.149  -2.451
  104    HA   SER  13           HA       SER  13   2.056 -11.238  -4.308
  105   1HB   SER  13          2HB       SER  13   0.151 -11.483  -1.942
  106   2HB   SER  13          3HB       SER  13   0.262 -12.703  -3.223
  107    HG   SER  13           HG       SER  13   1.670 -13.148  -1.457
  108    H    GLY  14           H        GLY  14   0.028 -12.272  -5.439
  109   1HA   GLY  14          2HA       GLY  14  -1.952 -12.052  -6.606
  110   2HA   GLY  14          3HA       GLY  14  -2.228 -10.455  -5.901
  111    H    MET  15           H        MET  15   0.091  -9.115  -6.598
  112    HA   MET  15           HA       MET  15  -0.252  -8.134  -9.105
  113   1HB   MET  15          2HB       MET  15   2.010  -7.241  -8.992
  114   2HB   MET  15          3HB       MET  15   1.253  -7.192  -7.409
  115   1HG   MET  15          2HG       MET  15   3.322  -7.935  -6.837
  116   2HG   MET  15          3HG       MET  15   2.502  -9.486  -7.009
  117   1HE   MET  15          1HE       MET  15   4.857 -10.685  -7.051
  118   2HE   MET  15          2HE       MET  15   6.201 -10.169  -8.098
  119   3HE   MET  15          3HE       MET  15   5.603  -9.087  -6.817
  120    H    THR  16           H        THR  16   0.383  -8.470 -11.147
  121    HA   THR  16           HA       THR  16   2.373 -10.497 -11.855
  122    HB   THR  16           HB       THR  16   0.622 -11.221 -13.752
  123    HG1  THR  16           1HG      THR  16  -1.001 -10.835 -11.454
  124   1HG2  THR  16          1HG2      THR  16   0.110 -13.236 -12.484
  125   2HG2  THR  16          2HG2      THR  16   1.807 -12.780 -12.259
  126   3HG2  THR  16          3HG2      THR  16   0.624 -12.474 -10.971
  127    H    CYS  17           H        CYS  17   0.007  -8.020 -13.084
  128    HA   CYS  17           HA       CYS  17   1.558  -7.572 -15.473
  129   1HB   CYS  17          2HB       CYS  17   0.102  -5.574 -15.699
  130   2HB   CYS  17          3HB       CYS  17  -0.812  -7.071 -15.426
  131    H    ALA  18           H        ALA  18   2.049  -6.584 -12.221
  132    HA   ALA  18           HA       ALA  18   3.478  -5.182 -11.187
  133   1HB   ALA  18          1HB       ALA  18   5.042  -5.206 -13.799
  134   2HB   ALA  18          2HB       ALA  18   5.657  -4.810 -12.186
  135   3HB   ALA  18          3HB       ALA  18   5.118  -6.460 -12.545
  136    H    ALA  19           H        ALA  19   1.205  -4.051 -12.701
  137    HA   ALA  19           HA       ALA  19   2.115  -1.193 -12.817
  138   1HB   ALA  19          1HB       ALA  19   0.123  -2.594 -14.648
  139   2HB   ALA  19          2HB       ALA  19   0.509  -0.856 -14.645
  140   3HB   ALA  19          3HB       ALA  19   1.755  -2.042 -15.084
  141    H    CYS  20           H        CYS  20  -0.824  -3.263 -12.583
  142    HA   CYS  20           HA       CYS  20  -2.515  -1.571 -11.186
  143   1HB   CYS  20          2HB       CYS  20  -2.121  -4.587 -11.220
  144   2HB   CYS  20          3HB       CYS  20  -3.390  -3.868 -10.261
  145    H    ALA  21           H        ALA  21   0.260  -3.365  -9.894
  146    HA   ALA  21           HA       ALA  21  -0.221  -3.026  -7.149
  147   1HB   ALA  21          1HB       ALA  21   2.480  -2.829  -8.527
  148   2HB   ALA  21          2HB       ALA  21   2.125  -3.384  -6.870
  149   3HB   ALA  21          3HB       ALA  21   1.613  -4.360  -8.245
  150    H    ALA  22           H        ALA  22   0.602  -0.562  -9.568
  151    HA   ALA  22           HA       ALA  22   1.248   1.501  -7.594
  152   1HB   ALA  22          1HB       ALA  22   2.020   1.519 -10.010
  153   2HB   ALA  22          2HB       ALA  22   0.335   1.862 -10.469
  154   3HB   ALA  22          3HB       ALA  22   1.226   3.004  -9.445
  155    H    ARG  23           H        ARG  23  -1.656   0.356  -9.349
  156    HA   ARG  23           HA       ARG  23  -3.328   2.582  -8.733
  157   1HB   ARG  23          2HB       ARG  23  -4.051  -0.346  -9.231
  158   2HB   ARG  23          3HB       ARG  23  -5.211   0.954  -8.967
  159   1HG   ARG  23          2HG       ARG  23  -4.329   2.198 -10.880
  160   2HG   ARG  23          3HG       ARG  23  -3.177   0.894 -11.232
  161   1HD   ARG  23          2HD       ARG  23  -4.833  -0.487 -12.129
  162   2HD   ARG  23          3HD       ARG  23  -5.990  -0.031 -10.900
  163    HE   ARG  23           HE       ARG  23  -6.926   1.511 -12.220
  164   1HH1  ARG  23          2HH2      ARG  23  -3.756   0.777 -13.522
  165   2HH1  ARG  23          1HH2      ARG  23  -3.881   1.807 -14.918
  166   1HH2  ARG  23          2HH1      ARG  23  -7.161   2.927 -14.032
  167   2HH2  ARG  23          1HH1      ARG  23  -5.894   3.068 -15.206
  168    H    ILE  24           H        ILE  24  -2.659  -0.475  -6.942
  169    HA   ILE  24           HA       ILE  24  -4.548   0.127  -4.941
  170    HB   ILE  24           HB       ILE  24  -3.748  -1.536  -3.588
  171   1HG1  ILE  24          2HG1      ILE  24  -1.177  -1.243  -5.046
  172   2HG1  ILE  24          3HG1      ILE  24  -1.518  -1.108  -3.309
  173   1HG2  ILE  24          1HG2      ILE  24  -3.931  -3.351  -5.036
  174   2HG2  ILE  24          2HG2      ILE  24  -4.749  -2.065  -5.918
  175   3HG2  ILE  24          3HG2      ILE  24  -3.101  -2.539  -6.383
  176   1HD1  ILE  24          1HD1      ILE  24  -2.012  -3.594  -3.317
  177   2HD1  ILE  24          2HD1      ILE  24  -1.398  -3.609  -4.994
  178   3HD1  ILE  24          3HD1      ILE  24  -0.323  -3.156  -3.664
  179    H    GLU  25           H        GLU  25  -0.998   0.719  -4.722
  180    HA   GLU  25           HA       GLU  25  -1.047   2.234  -2.378
  181   1HB   GLU  25          2HB       GLU  25   0.780   2.040  -4.750
  182   2HB   GLU  25          3HB       GLU  25   0.970   3.463  -3.711
  183   1HG   GLU  25          2HG       GLU  25   2.427   1.587  -3.002
  184   2HG   GLU  25          3HG       GLU  25   1.304   2.087  -1.737
  185    H    LYS  26           H        LYS  26  -1.794   3.360  -5.672
  186    HA   LYS  26           HA       LYS  26  -1.717   6.168  -4.841
  187   1HB   LYS  26          2HB       LYS  26  -2.446   4.770  -7.412
  188   2HB   LYS  26          3HB       LYS  26  -2.969   6.429  -7.117
  189   1HG   LYS  26          2HG       LYS  26  -0.911   6.576  -8.291
  190   2HG   LYS  26          3HG       LYS  26  -0.619   7.120  -6.630
  191   1HD   LYS  26          2HD       LYS  26   0.443   5.002  -6.082
  192   2HD   LYS  26          3HD       LYS  26   0.069   4.397  -7.712
  193   1HE   LYS  26          2HE       LYS  26   1.514   5.915  -8.798
  194   2HE   LYS  26          3HE       LYS  26   1.685   6.938  -7.362
  195   1HZ   LYS  26          1HZ       LYS  26   3.608   5.556  -7.775
  196   2HZ   LYS  26          2HZ       LYS  26   2.936   5.258  -6.304
  197   3HZ   LYS  26          3HZ       LYS  26   2.715   4.192  -7.551
  198    H    GLY  27           H        GLY  27  -4.325   3.790  -5.509
  199   1HA   GLY  27          2HA       GLY  27  -6.541   5.461  -4.824
  200   2HA   GLY  27          3HA       GLY  27  -6.473   3.689  -4.725
  201    H    LEU  28           H        LEU  28  -4.385   3.335  -2.923
  202    HA   LEU  28           HA       LEU  28  -5.745   3.606  -0.441
  203   1HB   LEU  28          2HB       LEU  28  -4.294   1.774  -0.941
  204   2HB   LEU  28          3HB       LEU  28  -2.895   2.829  -1.132
  205    HG   LEU  28           HG       LEU  28  -3.158   1.394   0.979
  206   1HD1  LEU  28          1HD1      LEU  28  -2.437   4.335   1.049
  207   2HD1  LEU  28          2HD1      LEU  28  -2.070   3.218   2.357
  208   3HD1  LEU  28          3HD1      LEU  28  -1.379   2.954   0.746
  209   1HD2  LEU  28          1HD2      LEU  28  -4.373   2.355   2.853
  210   2HD2  LEU  28          2HD2      LEU  28  -4.977   3.670   1.878
  211   3HD2  LEU  28          3HD2      LEU  28  -5.486   2.007   1.522
  212    H    LYS  29           H        LYS  29  -2.990   5.468  -1.877
  213    HA   LYS  29           HA       LYS  29  -2.589   7.239   0.232
  214   1HB   LYS  29          2HB       LYS  29  -1.254   7.159  -1.889
  215   2HB   LYS  29          3HB       LYS  29  -2.574   8.019  -2.693
  216   1HG   LYS  29          2HG       LYS  29  -2.040   9.535  -0.329
  217   2HG   LYS  29          3HG       LYS  29  -0.490   8.990  -0.850
  218   1HD   LYS  29          2HD       LYS  29  -2.432  10.290  -2.823
  219   2HD   LYS  29          3HD       LYS  29  -1.509  11.265  -1.668
  220   1HE   LYS  29          2HE       LYS  29   0.593  10.297  -2.455
  221   2HE   LYS  29          3HE       LYS  29  -0.231   9.347  -3.690
  222   1HZ   LYS  29          1HZ       LYS  29   0.848  11.419  -4.359
  223   2HZ   LYS  29          2HZ       LYS  29  -0.775  11.459  -4.715
  224   3HZ   LYS  29          3HZ       LYS  29  -0.162  12.292  -3.417
  225    H    ARG  30           H        ARG  30  -5.367   7.034  -1.923
  226    HA   ARG  30           HA       ARG  30  -6.189   9.733  -1.396
  227   1HB   ARG  30          2HB       ARG  30  -6.693   7.885  -3.372
  228   2HB   ARG  30          3HB       ARG  30  -8.167   7.727  -2.430
  229   1HG   ARG  30          2HG       ARG  30  -7.494  10.559  -2.803
  230   2HG   ARG  30          3HG       ARG  30  -7.357   9.740  -4.343
  231   1HD   ARG  30          2HD       ARG  30  -9.607   9.181  -4.434
  232   2HD   ARG  30          3HD       ARG  30  -9.840   9.199  -2.688
  233    HE   ARG  30           HE       ARG  30 -10.057  11.437  -4.506
  234   1HH1  ARG  30          2HH2      ARG  30  -9.231  10.541  -1.119
  235   2HH1  ARG  30          1HH2      ARG  30  -9.629  12.100  -0.496
  236   1HH2  ARG  30          2HH1      ARG  30 -10.474  13.530  -3.648
  237   2HH2  ARG  30          1HH1      ARG  30 -10.312  13.846  -1.953
  238    H    MET  31           H        MET  31  -6.143   7.208   0.707
  239    HA   MET  31           HA       MET  31  -8.758   7.547   1.978
  240   1HB   MET  31          2HB       MET  31  -6.277   5.910   2.688
  241   2HB   MET  31          3HB       MET  31  -7.816   5.756   3.497
  242   1HG   MET  31          2HG       MET  31  -7.315   5.172   0.551
  243   2HG   MET  31          3HG       MET  31  -7.455   3.994   1.836
  244   1HE   MET  31          1HE       MET  31 -10.064   5.146   3.518
  245   2HE   MET  31          2HE       MET  31 -11.264   4.137   2.708
  246   3HE   MET  31          3HE       MET  31  -9.669   3.466   3.133
  247    HA   PRO  32           HA       PRO  32  -7.354  10.503   5.008
  248   1HB   PRO  32          2HB       PRO  32  -8.607   9.703   7.324
  249   2HB   PRO  32          3HB       PRO  32  -9.471  10.466   5.957
  250   1HG   PRO  32          2HG       PRO  32  -9.189   7.507   6.536
  251   2HG   PRO  32          3HG       PRO  32 -10.694   8.409   6.190
  252   1HD   PRO  32          2HD       PRO  32  -9.406   7.061   4.261
  253   2HD   PRO  32          3HD       PRO  32 -10.099   8.659   3.881
  254    H    GLY  33           H        GLY  33  -5.542  10.661   6.289
  255   1HA   GLY  33          2HA       GLY  33  -4.021   9.946   7.933
  256   2HA   GLY  33          3HA       GLY  33  -4.471   8.255   7.666
  257    H    VAL  34           H        VAL  34  -4.253   8.610   4.597
  258    HA   VAL  34           HA       VAL  34  -1.321   8.152   4.631
  259    HB   VAL  34           HB       VAL  34  -3.267   7.582   2.397
  260   1HG1  VAL  34          1HG1      VAL  34  -0.911   7.776   1.697
  261   2HG1  VAL  34          2HG1      VAL  34  -0.376   6.773   3.045
  262   3HG1  VAL  34          3HG1      VAL  34  -1.317   6.059   1.740
  263   1HG2  VAL  34          1HG2      VAL  34  -2.275   5.739   4.615
  264   2HG2  VAL  34          2HG2      VAL  34  -3.952   6.246   4.335
  265   3HG2  VAL  34          3HG2      VAL  34  -3.144   5.221   3.158
  266    H    THR  35           H        THR  35   0.102   9.419   3.484
  267    HA   THR  35           HA       THR  35  -1.054  11.778   2.055
  268    HB   THR  35           HB       THR  35   0.822  11.655   4.296
  269    HG1  THR  35           1HG      THR  35  -0.851  13.633   3.180
  270   1HG2  THR  35          1HG2      THR  35   1.356  13.546   1.970
  271   2HG2  THR  35          2HG2      THR  35   1.980  13.724   3.627
  272   3HG2  THR  35          3HG2      THR  35   2.474  12.333   2.655
  273    H    ASP  36           H        ASP  36   1.703   9.367   2.062
  274    HA   ASP  36           HA       ASP  36   1.540   9.620  -0.795
  275   1HB   ASP  36          2HB       ASP  36   3.814  10.826   0.564
  276   2HB   ASP  36          3HB       ASP  36   4.318   9.514  -0.507
  277    H    ALA  37           H        ALA  37   2.765   7.995  -1.927
  278    HA   ALA  37           HA       ALA  37   3.198   5.523  -0.481
  279   1HB   ALA  37          1HB       ALA  37   0.689   5.668  -0.490
  280   2HB   ALA  37          2HB       ALA  37   0.736   5.690  -2.267
  281   3HB   ALA  37          3HB       ALA  37   1.313   4.267  -1.371
  282    H    ASN  38           H        ASN  38   4.313   3.934  -1.692
  283    HA   ASN  38           HA       ASN  38   5.064   4.679  -4.461
  284   1HB   ASN  38          2HB       ASN  38   7.532   4.365  -3.123
  285   2HB   ASN  38          3HB       ASN  38   6.870   5.804  -3.869
  286   1HD2  ASN  38          1HD2      ASN  38   6.166   4.102  -0.747
  287   2HD2  ASN  38          2HD2      ASN  38   6.486   5.535   0.232
  288    H    VAL  39           H        VAL  39   4.485   2.713  -5.247
  289    HA   VAL  39           HA       VAL  39   5.134   0.303  -3.788
  290    HB   VAL  39           HB       VAL  39   3.100   0.487  -5.003
  291   1HG1  VAL  39          1HG1      VAL  39   4.725   0.664  -7.589
  292   2HG1  VAL  39          2HG1      VAL  39   3.040   0.257  -7.470
  293   3HG1  VAL  39          3HG1      VAL  39   3.587   1.858  -6.934
  294   1HG2  VAL  39          1HG2      VAL  39   3.094  -1.666  -5.945
  295   2HG2  VAL  39          2HG2      VAL  39   4.826  -1.585  -6.330
  296   3HG2  VAL  39          3HG2      VAL  39   4.280  -1.707  -4.636
  297    H    ASN  40           H        ASN  40   7.235  -0.420  -3.646
  298    HA   ASN  40           HA       ASN  40   9.162   0.189  -5.803
  299   1HB   ASN  40          2HB       ASN  40   9.761   0.553  -3.435
  300   2HB   ASN  40          3HB       ASN  40   9.529  -1.173  -3.114
  301   1HD2  ASN  40          1HD2      ASN  40  11.887  -0.795  -2.375
  302   2HD2  ASN  40          2HD2      ASN  40  13.115  -1.022  -3.606
  303    H    LEU  41           H        LEU  41   7.364  -1.251  -6.954
  304    HA   LEU  41           HA       LEU  41   7.841  -4.136  -6.788
  305   1HB   LEU  41          2HB       LEU  41   5.957  -2.346  -8.108
  306   2HB   LEU  41          3HB       LEU  41   6.624  -3.447  -9.284
  307    HG   LEU  41           HG       LEU  41   4.514  -4.189  -8.150
  308   1HD1  LEU  41          1HD1      LEU  41   6.935  -6.029  -7.996
  309   2HD1  LEU  41          2HD1      LEU  41   5.241  -6.547  -7.921
  310   3HD1  LEU  41          3HD1      LEU  41   5.865  -5.773  -9.391
  311   1HD2  LEU  41          1HD2      LEU  41   5.501  -3.565  -5.734
  312   2HD2  LEU  41          2HD2      LEU  41   4.370  -4.909  -5.968
  313   3HD2  LEU  41          3HD2      LEU  41   6.102  -5.219  -5.804
  314    H    ALA  42           H        ALA  42   9.386  -1.485  -8.283
  315    HA   ALA  42           HA       ALA  42  10.833  -2.570 -10.389
  316   1HB   ALA  42          1HB       ALA  42  12.647  -1.065  -9.710
  317   2HB   ALA  42          2HB       ALA  42  11.077  -0.244  -9.563
  318   3HB   ALA  42          3HB       ALA  42  11.910  -0.857  -8.112
  319    H    THR  43           H        THR  43  11.220  -3.212  -6.882
  320    HA   THR  43           HA       THR  43  13.040  -5.443  -7.644
  321    HB   THR  43           HB       THR  43  14.059  -4.019  -6.035
  322    HG1  THR  43           1HG      THR  43  14.340  -6.336  -6.071
  323   1HG2  THR  43          1HG2      THR  43  11.995  -3.286  -4.760
  324   2HG2  THR  43          2HG2      THR  43  12.021  -4.873  -3.948
  325   3HG2  THR  43          3HG2      THR  43  13.386  -3.771  -3.778
  326    H    GLU  44           H        GLU  44  10.426  -4.901  -5.266
  327    HA   GLU  44           HA       GLU  44   8.398  -6.490  -6.004
  328   1HB   GLU  44          2HB       GLU  44  10.680  -8.294  -5.371
  329   2HB   GLU  44          3HB       GLU  44   9.232  -8.691  -4.504
  330   1HG   GLU  44          2HG       GLU  44   7.880  -8.784  -6.505
  331   2HG   GLU  44          3HG       GLU  44   9.294  -8.466  -7.516
  332    H    THR  45           H        THR  45   8.790  -4.286  -4.338
  333    HA   THR  45           HA       THR  45   7.789  -5.214  -1.692
  334    HB   THR  45           HB       THR  45  10.148  -3.398  -2.374
  335    HG1  THR  45           1HG      THR  45   9.922  -5.939  -1.129
  336   1HG2  THR  45          1HG2      THR  45  10.522  -3.250   0.060
  337   2HG2  THR  45          2HG2      THR  45   9.053  -2.420  -0.472
  338   3HG2  THR  45          3HG2      THR  45   8.938  -4.010   0.337
  339    H    VAL  46           H        VAL  46   6.728  -3.383  -0.500
  340    HA   VAL  46           HA       VAL  46   5.941  -1.089  -2.255
  341    HB   VAL  46           HB       VAL  46   4.014  -2.463  -2.238
  342   1HG1  VAL  46          1HG1      VAL  46   2.952  -3.246  -0.094
  343   2HG1  VAL  46          2HG1      VAL  46   4.476  -4.053  -0.461
  344   3HG1  VAL  46          3HG1      VAL  46   4.437  -2.760   0.752
  345   1HG2  VAL  46          1HG2      VAL  46   3.586  -0.077  -1.753
  346   2HG2  VAL  46          2HG2      VAL  46   2.386  -1.164  -1.012
  347   3HG2  VAL  46          3HG2      VAL  46   3.619  -0.417  -0.004
  348    H    ASN  47           H        ASN  47   5.834   0.977  -1.198
  349    HA   ASN  47           HA       ASN  47   6.410   0.949   1.689
  350   1HB   ASN  47          2HB       ASN  47   7.790   2.546  -0.509
  351   2HB   ASN  47          3HB       ASN  47   7.607   3.220   1.113
  352   1HD2  ASN  47          1HD2      ASN  47   8.284   1.656   2.972
  353   2HD2  ASN  47          2HD2      ASN  47   9.919   1.070   2.716
  354    H    VAL  48           H        VAL  48   5.261   2.655   2.825
  355    HA   VAL  48           HA       VAL  48   3.409   4.248   1.209
  356    HB   VAL  48           HB       VAL  48   2.193   2.185   1.509
  357   1HG1  VAL  48          1HG1      VAL  48   1.527   1.345   3.708
  358   2HG1  VAL  48          2HG1      VAL  48   3.275   1.244   3.476
  359   3HG1  VAL  48          3HG1      VAL  48   2.588   2.518   4.507
  360   1HG2  VAL  48          1HG2      VAL  48   0.885   4.166   1.463
  361   2HG2  VAL  48          2HG2      VAL  48   0.222   3.130   2.738
  362   3HG2  VAL  48          3HG2      VAL  48   1.213   4.542   3.158
  363    H    ILE  49           H        ILE  49   3.254   6.218   2.035
  364    HA   ILE  49           HA       ILE  49   4.743   6.767   4.499
  365    HB   ILE  49           HB       ILE  49   4.037   8.711   2.247
  366   1HG1  ILE  49          2HG1      ILE  49   5.379   7.042   1.189
  367   2HG1  ILE  49          3HG1      ILE  49   6.350   8.485   1.463
  368   1HG2  ILE  49          1HG2      ILE  49   5.982   8.873   4.584
  369   2HG2  ILE  49          2HG2      ILE  49   5.935  10.012   3.221
  370   3HG2  ILE  49          3HG2      ILE  49   4.544   9.850   4.292
  371   1HD1  ILE  49          1HD1      ILE  49   7.250   7.419   3.564
  372   2HD1  ILE  49          2HD1      ILE  49   6.408   5.929   3.111
  373   3HD1  ILE  49          3HD1      ILE  49   7.693   6.564   2.063
  374    H    TYR  50           H        TYR  50   3.103   6.571   6.046
  375    HA   TYR  50           HA       TYR  50   0.690   8.284   5.685
  376   1HB   TYR  50          2HB       TYR  50  -0.783   6.623   6.443
  377   2HB   TYR  50          3HB       TYR  50   0.067   6.014   5.059
  378    HD1  TYR  50           HD1      TYR  50   0.603   3.752   5.138
  379    HD2  TYR  50           HD2      TYR  50   0.222   5.882   8.857
  380    HE1  TYR  50           HE1      TYR  50   0.663   1.629   6.370
  381    HE2  TYR  50           HE2      TYR  50   0.505   3.791  10.093
  382    HH   TYR  50           HH       TYR  50   0.877   0.668   8.487
  383    H    ASP  51           H        ASP  51  -0.477   8.636   7.535
  384    HA   ASP  51           HA       ASP  51   1.300   9.368   9.687
  385   1HB   ASP  51          2HB       ASP  51  -1.604  10.086   9.286
  386   2HB   ASP  51          3HB       ASP  51  -0.431  10.780  10.429
  387    HA   PRO  52           HA       PRO  52  -0.168   5.673  11.784
  388   1HB   PRO  52          2HB       PRO  52   1.627   5.477  13.804
  389   2HB   PRO  52          3HB       PRO  52   2.070   5.216  12.093
  390   1HG   PRO  52          2HG       PRO  52   2.341   7.796  13.673
  391   2HG   PRO  52          3HG       PRO  52   3.621   6.941  12.763
  392   1HD   PRO  52          2HD       PRO  52   2.218   8.968  11.663
  393   2HD   PRO  52          3HD       PRO  52   2.647   7.535  10.680
  394    H    ALA  53           H        ALA  53  -1.051   8.679  12.512
  395    HA   ALA  53           HA       ALA  53  -2.096   8.220  15.236
  396   1HB   ALA  53          1HB       ALA  53  -2.330  10.541  13.265
  397   2HB   ALA  53          2HB       ALA  53  -3.054  10.478  14.883
  398   3HB   ALA  53          3HB       ALA  53  -1.285  10.486  14.704
  399    H    GLU  54           H        GLU  54  -2.844   8.190  11.745
  400    HA   GLU  54           HA       GLU  54  -5.721   7.815  12.371
  401   1HB   GLU  54          2HB       GLU  54  -4.292   9.526  10.460
  402   2HB   GLU  54          3HB       GLU  54  -5.392   8.403   9.640
  403   1HG   GLU  54          2HG       GLU  54  -6.640  10.347  10.027
  404   2HG   GLU  54          3HG       GLU  54  -7.253   9.114  11.135
  405    H    THR  55           H        THR  55  -3.105   6.810  10.113
  406    HA   THR  55           HA       THR  55  -4.367   4.157   9.925
  407    HB   THR  55           HB       THR  55  -2.434   3.831   8.091
  408    HG1  THR  55           1HG      THR  55  -3.205   6.476   7.817
  409   1HG2  THR  55          1HG2      THR  55  -4.172   4.473   6.473
  410   2HG2  THR  55          2HG2      THR  55  -4.803   3.526   7.847
  411   3HG2  THR  55          3HG2      THR  55  -5.105   5.285   7.763
  412    H    GLY  56           H        GLY  56  -2.205   2.606   9.597
  413   1HA   GLY  56          2HA       GLY  56  -0.589   1.830  11.520
  414   2HA   GLY  56          3HA       GLY  56  -2.019   2.232  12.499
  415    H    THR  57           H        THR  57  -0.944   0.547   9.890
  416    HA   THR  57           HA       THR  57  -1.616  -0.381   8.114
  417    HB   THR  57           HB       THR  57  -1.366  -2.915   8.451
  418    HG1  THR  57           1HG      THR  57  -2.178  -3.013  10.584
  419   1HG2  THR  57          1HG2      THR  57   0.738  -1.176   9.799
  420   2HG2  THR  57          2HG2      THR  57   0.958  -2.802   9.141
  421   3HG2  THR  57          3HG2      THR  57   0.602  -1.461   8.039
  422    H    ALA  58           H        ALA  58  -3.936  -1.021  10.601
  423    HA   ALA  58           HA       ALA  58  -5.998  -2.414   9.695
  424   1HB   ALA  58          1HB       ALA  58  -7.379  -0.516  10.641
  425   2HB   ALA  58          2HB       ALA  58  -5.964  -0.918  11.651
  426   3HB   ALA  58          3HB       ALA  58  -5.904   0.493  10.593
  427    H    ALA  59           H        ALA  59  -5.350   0.887   8.400
  428    HA   ALA  59           HA       ALA  59  -7.832   0.560   6.812
  429   1HB   ALA  59          1HB       ALA  59  -6.983   2.843   7.660
  430   2HB   ALA  59          2HB       ALA  59  -5.917   2.786   6.209
  431   3HB   ALA  59          3HB       ALA  59  -7.658   2.723   6.027
  432    H    ILE  60           H        ILE  60  -4.381   0.564   6.263
  433    HA   ILE  60           HA       ILE  60  -4.294   0.226   3.469
  434    HB   ILE  60           HB       ILE  60  -2.455  -0.344   5.813
  435   1HG1  ILE  60          2HG1      ILE  60  -0.957   1.073   4.308
  436   2HG1  ILE  60          3HG1      ILE  60  -2.340   1.194   3.212
  437   1HG2  ILE  60          1HG2      ILE  60  -2.052  -2.329   4.396
  438   2HG2  ILE  60          2HG2      ILE  60  -1.779  -1.258   3.000
  439   3HG2  ILE  60          3HG2      ILE  60  -0.702  -1.201   4.420
  440   1HD1  ILE  60          1HD1      ILE  60  -2.240   2.098   6.157
  441   2HD1  ILE  60          2HD1      ILE  60  -1.954   3.176   4.783
  442   3HD1  ILE  60          3HD1      ILE  60  -3.555   2.465   5.012
  443    H    GLN  61           H        GLN  61  -4.492  -2.279   6.059
  444    HA   GLN  61           HA       GLN  61  -4.422  -4.407   4.120
  445   1HB   GLN  61          2HB       GLN  61  -4.688  -4.199   7.026
  446   2HB   GLN  61          3HB       GLN  61  -5.829  -5.348   6.329
  447   1HG   GLN  61          2HG       GLN  61  -4.034  -6.689   6.800
  448   2HG   GLN  61          3HG       GLN  61  -3.912  -6.428   5.062
  449   1HE2  GLN  61          1HE2      GLN  61  -2.872  -3.493   6.193
  450   2HE2  GLN  61          2HE2      GLN  61  -1.176  -3.884   6.414
  451    H    GLU  62           H        GLU  62  -7.102  -2.731   5.849
  452    HA   GLU  62           HA       GLU  62  -9.241  -4.197   4.832
  453   1HB   GLU  62          2HB       GLU  62  -8.936  -1.804   6.342
  454   2HB   GLU  62          3HB       GLU  62  -9.847  -1.304   4.924
  455   1HG   GLU  62          2HG       GLU  62 -10.565  -3.587   6.804
  456   2HG   GLU  62          3HG       GLU  62 -11.338  -1.997   6.746
  457    H    LYS  63           H        LYS  63  -7.735  -1.240   3.380
  458    HA   LYS  63           HA       LYS  63  -9.405  -1.402   1.100
  459   1HB   LYS  63          2HB       LYS  63  -6.955   0.143   1.956
  460   2HB   LYS  63          3HB       LYS  63  -7.515   0.247   0.320
  461   1HG   LYS  63          2HG       LYS  63  -9.334   0.769   2.712
  462   2HG   LYS  63          3HG       LYS  63  -8.307   1.992   1.967
  463   1HD   LYS  63          2HD       LYS  63 -10.540   2.279   1.188
  464   2HD   LYS  63          3HD       LYS  63  -9.491   1.841  -0.162
  465   1HE   LYS  63          2HE       LYS  63 -10.527  -0.301  -0.350
  466   2HE   LYS  63          3HE       LYS  63 -11.247  -0.197   1.290
  467   1HZ   LYS  63          1HZ       LYS  63 -12.028   1.421  -1.036
  468   2HZ   LYS  63          2HZ       LYS  63 -12.849   0.136  -0.419
  469   3HZ   LYS  63          3HZ       LYS  63 -12.690   1.503   0.474
  470    H    ILE  64           H        ILE  64  -6.151  -2.657   1.792
  471    HA   ILE  64           HA       ILE  64  -5.206  -3.201  -0.696
  472    HB   ILE  64           HB       ILE  64  -4.925  -4.259   2.016
  473   1HG1  ILE  64          2HG1      ILE  64  -3.574  -2.410   0.996
  474   2HG1  ILE  64          3HG1      ILE  64  -2.675  -3.745   1.718
  475   1HG2  ILE  64          1HG2      ILE  64  -5.160  -6.376   1.173
  476   2HG2  ILE  64          2HG2      ILE  64  -4.156  -6.023  -0.259
  477   3HG2  ILE  64          3HG2      ILE  64  -3.435  -6.091   1.369
  478   1HD1  ILE  64          1HD1      ILE  64  -1.615  -3.131  -0.317
  479   2HD1  ILE  64          2HD1      ILE  64  -2.393  -4.711  -0.579
  480   3HD1  ILE  64          3HD1      ILE  64  -3.127  -3.238  -1.240
  481    H    GLU  65           H        GLU  65  -7.341  -5.210   1.422
  482    HA   GLU  65           HA       GLU  65  -8.044  -7.297  -0.339
  483   1HB   GLU  65          2HB       GLU  65  -9.410  -5.930   1.998
  484   2HB   GLU  65          3HB       GLU  65 -10.281  -7.134   1.059
  485   1HG   GLU  65          2HG       GLU  65  -7.535  -7.945   1.934
  486   2HG   GLU  65          3HG       GLU  65  -8.727  -7.702   3.219
  487    H    LYS  66           H        LYS  66  -9.919  -4.273   0.270
  488    HA   LYS  66           HA       LYS  66 -11.884  -4.938  -1.695
  489   1HB   LYS  66          2HB       LYS  66 -11.210  -2.482  -0.099
  490   2HB   LYS  66          3HB       LYS  66 -12.288  -2.318  -1.489
  491   1HG   LYS  66          2HG       LYS  66 -13.655  -2.671   0.451
  492   2HG   LYS  66          3HG       LYS  66 -13.753  -4.113  -0.567
  493   1HD   LYS  66          2HD       LYS  66 -12.042  -5.212   0.947
  494   2HD   LYS  66          3HD       LYS  66 -12.064  -3.746   1.952
  495   1HE   LYS  66          2HE       LYS  66 -14.505  -4.109   2.354
  496   2HE   LYS  66          3HE       LYS  66 -14.426  -5.603   1.392
  497   1HZ   LYS  66          1HZ       LYS  66 -14.222  -6.038   3.757
  498   2HZ   LYS  66          2HZ       LYS  66 -12.795  -6.424   3.027
  499   3HZ   LYS  66          3HZ       LYS  66 -12.945  -5.040   3.881
  500    H    LEU  67           H        LEU  67  -8.847  -3.263  -2.053
  501    HA   LEU  67           HA       LEU  67  -9.275  -2.280  -4.744
  502   1HB   LEU  67          2HB       LEU  67  -6.813  -2.745  -3.051
  503   2HB   LEU  67          3HB       LEU  67  -6.747  -2.085  -4.684
  504    HG   LEU  67           HG       LEU  67  -8.540  -0.780  -2.609
  505   1HD1  LEU  67          1HD1      LEU  67  -6.273  -0.927  -1.611
  506   2HD1  LEU  67          2HD1      LEU  67  -5.602  -0.161  -3.048
  507   3HD1  LEU  67          3HD1      LEU  67  -6.724   0.741  -2.018
  508   1HD2  LEU  67          1HD2      LEU  67  -7.062   0.286  -5.060
  509   2HD2  LEU  67          2HD2      LEU  67  -8.798  -0.072  -4.981
  510   3HD2  LEU  67          3HD2      LEU  67  -8.117   1.226  -3.989
  511    H    GLY  68           H        GLY  68  -8.670  -5.406  -3.360
  512   1HA   GLY  68          2HA       GLY  68  -8.938  -7.387  -4.499
  513   2HA   GLY  68          3HA       GLY  68  -8.569  -6.609  -6.043
  514    H    TYR  69           H        TYR  69  -6.669  -6.476  -2.965
  515    HA   TYR  69           HA       TYR  69  -4.444  -7.955  -4.286
  516   1HB   TYR  69          2HB       TYR  69  -4.674  -5.095  -3.659
  517   2HB   TYR  69          3HB       TYR  69  -3.314  -5.819  -2.835
  518    HD1  TYR  69           HD1      TYR  69  -4.910  -5.497  -6.209
  519    HD2  TYR  69           HD2      TYR  69  -1.330  -6.431  -3.995
  520    HE1  TYR  69           HE1      TYR  69  -3.620  -5.435  -8.286
  521    HE2  TYR  69           HE2      TYR  69  -0.011  -6.155  -6.031
  522    HH   TYR  69           HH       TYR  69  -1.525  -5.557  -9.238
  523    H    HIS  70           H        HIS  70  -2.588  -8.133  -2.677
  524    HA   HIS  70           HA       HIS  70  -3.400  -8.685   0.105
  525   1HB   HIS  70          2HB       HIS  70  -4.075 -10.645  -1.276
  526   2HB   HIS  70          3HB       HIS  70  -2.424 -10.807  -1.866
  527    HD1  HIS  70           1HD      HIS  70  -0.950 -10.638   1.070
  528    HD2  HIS  70           2HD      HIS  70  -4.291 -12.935  -0.082
  529    HE1  HIS  70           1HE      HIS  70  -0.976 -12.676   2.561
  530    H    VAL  71           H        VAL  71  -1.701  -7.565   1.149
  531    HA   VAL  71           HA       VAL  71   1.007  -7.636   0.014
  532    HB   VAL  71           HB       VAL  71   1.519  -6.391   2.127
  533   1HG1  VAL  71          1HG1      VAL  71  -0.393  -5.182   0.131
  534   2HG1  VAL  71          2HG1      VAL  71   0.601  -4.232   1.259
  535   3HG1  VAL  71          3HG1      VAL  71   1.367  -5.243   0.017
  536   1HG2  VAL  71          1HG2      VAL  71  -0.453  -7.020   3.481
  537   2HG2  VAL  71          2HG2      VAL  71  -0.182  -5.274   3.387
  538   3HG2  VAL  71          3HG2      VAL  71  -1.469  -6.009   2.431
  539    H    VAL  72           H        VAL  72   2.772  -8.382   1.479
  540    HA   VAL  72           HA       VAL  72   1.928 -10.632   3.246
  541    HB   VAL  72           HB       VAL  72   4.281 -10.738   1.429
  542   1HG1  VAL  72          1HG1      VAL  72   2.957 -12.848   3.190
  543   2HG1  VAL  72          2HG1      VAL  72   4.347 -13.112   2.117
  544   3HG1  VAL  72          3HG1      VAL  72   4.512 -12.059   3.523
  545   1HG2  VAL  72          1HG2      VAL  72   1.553 -12.074   1.183
  546   2HG2  VAL  72          2HG2      VAL  72   2.268 -10.908   0.045
  547   3HG2  VAL  72          3HG2      VAL  72   2.994 -12.512   0.240
  548    H    ILE  73           H        ILE  73   3.083 -10.852   5.069
  549    HA   ILE  73           HA       ILE  73   4.840  -8.566   5.868
  550    HB   ILE  73           HB       ILE  73   2.903 -10.157   7.572
  551   1HG1  ILE  73          2HG1      ILE  73   1.605  -8.750   6.094
  552   2HG1  ILE  73          3HG1      ILE  73   1.628  -8.120   7.733
  553   1HG2  ILE  73          1HG2      ILE  73   4.890  -7.939   8.154
  554   2HG2  ILE  73          2HG2      ILE  73   3.435  -8.149   9.153
  555   3HG2  ILE  73          3HG2      ILE  73   4.605  -9.456   9.019
  556   1HD1  ILE  73          1HD1      ILE  73   3.385  -6.445   7.034
  557   2HD1  ILE  73          2HD1      ILE  73   3.148  -7.021   5.367
  558   3HD1  ILE  73          3HD1      ILE  73   1.810  -6.263   6.235
  559    H    GLU  74           H        GLU  74   6.585 -10.049   4.911
  560    HA   GLU  74           HA       GLU  74   7.299 -12.307   6.416
  561   1HB   GLU  74          2HB       GLU  74   8.606 -10.665   4.244
  562   2HB   GLU  74          3HB       GLU  74   9.426 -11.998   5.032
  563   1HG   GLU  74          2HG       GLU  74   7.666 -13.572   4.347
  564   2HG   GLU  74          3HG       GLU  74   6.746 -12.249   3.607
  565    H    GLY  75           H        GLY  75   7.313  -9.276   7.318
  566   1HA   GLY  75          2HA       GLY  75  10.079  -9.010   8.397
  567   2HA   GLY  75          3HA       GLY  75   8.923  -7.723   8.016
  568    H    ARG  76           H        ARG  76   6.823  -9.400   9.584
  569    HA   ARG  76           HA       ARG  76   7.672  -8.991  12.320
  570   1HB   ARG  76          2HB       ARG  76   6.351  -6.836  11.052
  571   2HB   ARG  76          3HB       ARG  76   5.030  -7.754  11.765
  572   1HG   ARG  76          2HG       ARG  76   5.635  -6.271  13.509
  573   2HG   ARG  76          3HG       ARG  76   6.428  -7.786  13.944
  574   1HD   ARG  76          2HD       ARG  76   8.087  -6.089  14.241
  575   2HD   ARG  76          3HD       ARG  76   8.501  -6.917  12.734
  576    HE   ARG  76           HE       ARG  76   6.758  -4.559  12.478
  577   1HH1  ARG  76          2HH2      ARG  76  10.065  -5.763  12.238
  578   2HH1  ARG  76          1HH2      ARG  76  10.736  -4.285  11.627
  579   1HH2  ARG  76          2HH1      ARG  76   7.592  -2.601  11.607
  580   2HH2  ARG  76          1HH1      ARG  76   9.269  -2.461  11.198
  Start of MODEL    8
    1   1H    MET   1          H1        MET   1   2.821  19.721  15.977
    2   2H    MET   1          H2        MET   1   2.976  18.961  17.435
    3   3H    MET   1          H3        MET   1   2.600  18.095  16.080
    4    HA   MET   1           HA       MET   1   0.632  18.400  17.410
    5   1HB   MET   1          2HB       MET   1   1.472  21.304  17.147
    6   2HB   MET   1          3HB       MET   1  -0.218  20.858  17.418
    7   1HG   MET   1          2HG       MET   1   0.296  19.718  19.467
    8   2HG   MET   1          3HG       MET   1   2.036  19.992  19.263
    9   1HE   MET   1          1HE       MET   1   0.149  20.700  21.853
   10   2HE   MET   1          2HE       MET   1   1.927  20.832  21.817
   11   3HE   MET   1          3HE       MET   1   0.937  22.218  22.337
   12    H    LEU   2           H        LEU   2   0.120  17.185  15.548
   13    HA   LEU   2           HA       LEU   2  -1.809  18.019  13.884
   14   1HB   LEU   2          2HB       LEU   2   0.792  18.924  12.786
   15   2HB   LEU   2          3HB       LEU   2   0.006  17.825  11.683
   16    HG   LEU   2           HG       LEU   2  -1.809  19.916  12.778
   17   1HD1  LEU   2          1HD1      LEU   2   0.174  21.278  12.429
   18   2HD1  LEU   2          2HD1      LEU   2   0.423  20.569  10.817
   19   3HD1  LEU   2          3HD1      LEU   2  -1.004  21.579  11.143
   20   1HD2  LEU   2          1HD2      LEU   2  -2.461  18.169  11.080
   21   2HD2  LEU   2          2HD2      LEU   2  -2.634  19.827  10.471
   22   3HD2  LEU   2          3HD2      LEU   2  -1.247  18.843   9.972
   23    H    SER   3           H        SER   3   1.004  16.287  12.552
   24    HA   SER   3           HA       SER   3   0.041  13.628  13.332
   25   1HB   SER   3          2HB       SER   3  -0.052  14.833  10.516
   26   2HB   SER   3          3HB       SER   3   0.013  13.098  10.803
   27    HG   SER   3           HG       SER   3  -1.955  13.106  11.604
   28    H    GLU   4           H        GLU   4   1.862  12.233  13.248
   29    HA   GLU   4           HA       GLU   4   4.417  13.237  12.184
   30   1HB   GLU   4          2HB       GLU   4   3.537  10.981  13.891
   31   2HB   GLU   4          3HB       GLU   4   4.842  10.624  12.778
   32   1HG   GLU   4          2HG       GLU   4   5.955  12.689  13.644
   33   2HG   GLU   4          3HG       GLU   4   4.742  12.687  14.921
   34    H    GLN   5           H        GLN   5   5.467  11.352  10.776
   35    HA   GLN   5           HA       GLN   5   3.547  10.016   9.004
   36   1HB   GLN   5          2HB       GLN   5   5.941  11.675   8.171
   37   2HB   GLN   5          3HB       GLN   5   5.230  10.481   7.109
   38   1HG   GLN   5          2HG       GLN   5   3.265  12.477   8.186
   39   2HG   GLN   5          3HG       GLN   5   4.553  13.147   7.189
   40   1HE2  GLN   5          1HE2      GLN   5   2.798  10.005   7.040
   41   2HE2  GLN   5          2HE2      GLN   5   2.322  10.172   5.355
   42    H    LYS   6           H        LYS   6   4.400   7.963   8.398
   43    HA   LYS   6           HA       LYS   6   7.237   7.468   8.819
   44   1HB   LYS   6          2HB       LYS   6   5.118   5.665  10.038
   45   2HB   LYS   6          3HB       LYS   6   6.801   5.191   9.841
   46   1HG   LYS   6          2HG       LYS   6   5.940   7.584  11.493
   47   2HG   LYS   6          3HG       LYS   6   6.171   5.958  12.144
   48   1HD   LYS   6          2HD       LYS   6   8.499   5.966  11.836
   49   2HD   LYS   6          3HD       LYS   6   8.454   7.183  10.569
   50   1HE   LYS   6          2HE       LYS   6   9.392   8.118  12.659
   51   2HE   LYS   6          3HE       LYS   6   7.959   8.969  12.081
   52   1HZ   LYS   6          1HZ       LYS   6   7.589   8.768  14.276
   53   2HZ   LYS   6          2HZ       LYS   6   6.675   7.618  13.683
   54   3HZ   LYS   6          3HZ       LYS   6   8.103   7.190  14.410
   55    H    GLU   7           H        GLU   7   8.024   5.748   7.712
   56    HA   GLU   7           HA       GLU   7   6.616   5.156   5.186
   57   1HB   GLU   7          2HB       GLU   7   9.551   4.654   5.428
   58   2HB   GLU   7          3HB       GLU   7   8.595   5.353   4.143
   59   1HG   GLU   7          2HG       GLU   7   9.964   7.083   4.853
   60   2HG   GLU   7          3HG       GLU   7   8.489   7.471   5.743
   61    H    ILE   8           H        ILE   8   5.524   3.188   5.586
   62    HA   ILE   8           HA       ILE   8   6.905   1.066   7.043
   63    HB   ILE   8           HB       ILE   8   4.363   0.757   5.567
   64   1HG1  ILE   8          2HG1      ILE   8   3.839   2.866   6.516
   65   2HG1  ILE   8          3HG1      ILE   8   2.988   1.557   7.329
   66   1HG2  ILE   8          1HG2      ILE   8   5.345  -1.123   6.766
   67   2HG2  ILE   8          2HG2      ILE   8   5.410  -0.125   8.238
   68   3HG2  ILE   8          3HG2      ILE   8   3.834  -0.620   7.556
   69   1HD1  ILE   8          1HD1      ILE   8   5.615   2.507   8.395
   70   2HD1  ILE   8          2HD1      ILE   8   4.108   3.370   8.790
   71   3HD1  ILE   8          3HD1      ILE   8   4.304   1.646   9.222
   72    H    ALA   9           H        ALA   9   7.292  -1.068   5.941
   73    HA   ALA   9           HA       ALA   9   7.642  -0.926   3.000
   74   1HB   ALA   9          1HB       ALA   9   9.843  -0.379   4.085
   75   2HB   ALA   9          2HB       ALA   9   9.751  -1.914   4.969
   76   3HB   ALA   9          3HB       ALA   9   9.859  -1.919   3.195
   77    H    MET  10           H        MET  10   6.818  -2.797   2.084
   78    HA   MET  10           HA       MET  10   6.776  -5.312   3.570
   79   1HB   MET  10          2HB       MET  10   4.278  -5.499   3.551
   80   2HB   MET  10          3HB       MET  10   4.910  -4.259   4.626
   81   1HG   MET  10          2HG       MET  10   4.477  -2.606   2.656
   82   2HG   MET  10          3HG       MET  10   3.447  -3.901   2.025
   83   1HE   MET  10          1HE       MET  10   1.452  -1.995   2.004
   84   2HE   MET  10          2HE       MET  10   1.205  -0.942   3.418
   85   3HE   MET  10          3HE       MET  10   2.759  -0.930   2.564
   86    H    GLN  11           H        GLN  11   5.284  -6.901   2.210
   87    HA   GLN  11           HA       GLN  11   6.375  -6.864  -0.545
   88   1HB   GLN  11          2HB       GLN  11   6.277  -8.805   1.616
   89   2HB   GLN  11          3HB       GLN  11   5.343  -9.431   0.264
   90   1HG   GLN  11          2HG       GLN  11   8.183  -8.400  -0.091
   91   2HG   GLN  11          3HG       GLN  11   7.792 -10.061   0.389
   92   1HE2  GLN  11          1HE2      GLN  11   7.733  -7.800  -2.301
   93   2HE2  GLN  11          2HE2      GLN  11   7.001  -8.901  -3.447
   94    H    VAL  12           H        VAL  12   4.968  -8.017  -2.170
   95    HA   VAL  12           HA       VAL  12   2.087  -7.277  -1.808
   96    HB   VAL  12           HB       VAL  12   3.805  -7.044  -4.317
   97   1HG1  VAL  12          1HG1      VAL  12   1.841  -5.826  -5.219
   98   2HG1  VAL  12          2HG1      VAL  12   1.440  -7.503  -4.849
   99   3HG1  VAL  12          3HG1      VAL  12   0.924  -6.205  -3.747
  100   1HG2  VAL  12          1HG2      VAL  12   4.474  -5.294  -2.790
  101   2HG2  VAL  12          2HG2      VAL  12   3.370  -4.552  -3.952
  102   3HG2  VAL  12          3HG2      VAL  12   2.778  -4.972  -2.342
  103    H    SER  13           H        SER  13   0.561  -8.722  -2.668
  104    HA   SER  13           HA       SER  13   1.512 -11.115  -4.115
  105   1HB   SER  13          2HB       SER  13   1.400 -11.847  -1.811
  106   2HB   SER  13          3HB       SER  13  -0.221 -11.145  -1.613
  107    HG   SER  13           HG       SER  13  -0.245 -13.423  -2.045
  108    H    GLY  14           H        GLY  14  -0.633 -12.325  -4.682
  109   1HA   GLY  14          2HA       GLY  14  -2.239 -12.325  -6.370
  110   2HA   GLY  14          3HA       GLY  14  -3.019 -11.105  -5.346
  111    H    MET  15           H        MET  15  -0.195 -11.265  -7.622
  112    HA   MET  15           HA       MET  15  -1.133  -8.755  -8.904
  113   1HB   MET  15          2HB       MET  15   0.954  -7.699  -8.622
  114   2HB   MET  15          3HB       MET  15   0.572  -8.407  -7.046
  115   1HG   MET  15          2HG       MET  15   2.782  -8.936  -7.240
  116   2HG   MET  15          3HG       MET  15   2.075 -10.408  -7.910
  117   1HE   MET  15          1HE       MET  15   4.414 -11.050  -8.992
  118   2HE   MET  15          2HE       MET  15   5.382  -9.930  -9.978
  119   3HE   MET  15          3HE       MET  15   5.130  -9.595  -8.250
  120    H    THR  16           H        THR  16  -0.507  -8.460 -11.040
  121    HA   THR  16           HA       THR  16   0.676 -10.779 -12.474
  122    HB   THR  16           HB       THR  16  -0.163  -9.076 -14.431
  123    HG1  THR  16           1HG      THR  16  -2.165  -8.891 -12.449
  124   1HG2  THR  16          1HG2      THR  16  -1.815 -11.174 -12.937
  125   2HG2  THR  16          2HG2      THR  16  -2.246 -10.470 -14.518
  126   3HG2  THR  16          3HG2      THR  16  -0.763 -11.419 -14.347
  127    H    CYS  17           H        CYS  17   0.871  -7.134 -12.444
  128    HA   CYS  17           HA       CYS  17   3.748  -7.409 -13.108
  129   1HB   CYS  17          2HB       CYS  17   3.491  -6.020 -15.067
  130   2HB   CYS  17          3HB       CYS  17   2.387  -7.392 -15.216
  131    H    ALA  18           H        ALA  18   4.842  -5.348 -13.186
  132    HA   ALA  18           HA       ALA  18   4.372  -3.809 -10.771
  133   1HB   ALA  18          1HB       ALA  18   6.630  -4.493 -11.524
  134   2HB   ALA  18          2HB       ALA  18   6.439  -3.521 -12.996
  135   3HB   ALA  18          3HB       ALA  18   6.493  -2.725 -11.411
  136    H    ALA  19           H        ALA  19   2.135  -3.404 -12.106
  137    HA   ALA  19           HA       ALA  19   2.226  -0.520 -12.740
  138   1HB   ALA  19          1HB       ALA  19   2.449  -1.553 -14.967
  139   2HB   ALA  19          2HB       ALA  19   0.995  -2.530 -14.675
  140   3HB   ALA  19          3HB       ALA  19   0.869  -0.766 -14.774
  141    H    CYS  20           H        CYS  20  -0.040  -3.367 -12.785
  142    HA   CYS  20           HA       CYS  20  -2.217  -1.930 -11.734
  143   1HB   CYS  20          2HB       CYS  20  -1.620  -4.882 -11.163
  144   2HB   CYS  20          3HB       CYS  20  -3.197  -4.080 -11.201
  145    H    ALA  21           H        ALA  21   0.400  -3.651 -10.080
  146    HA   ALA  21           HA       ALA  21  -0.364  -3.319  -7.416
  147   1HB   ALA  21          1HB       ALA  21   2.014  -3.573  -6.902
  148   2HB   ALA  21          2HB       ALA  21   1.549  -4.678  -8.207
  149   3HB   ALA  21          3HB       ALA  21   2.438  -3.187  -8.588
  150    H    ALA  22           H        ALA  22   0.535  -0.749  -9.647
  151    HA   ALA  22           HA       ALA  22   1.191   1.173  -7.529
  152   1HB   ALA  22          1HB       ALA  22   0.374   1.679 -10.419
  153   2HB   ALA  22          2HB       ALA  22   1.194   2.795  -9.310
  154   3HB   ALA  22          3HB       ALA  22   2.049   1.357  -9.915
  155    H    ARG  23           H        ARG  23  -1.639   0.183  -9.468
  156    HA   ARG  23           HA       ARG  23  -3.234   2.484  -8.914
  157   1HB   ARG  23          2HB       ARG  23  -4.008  -0.403  -9.534
  158   2HB   ARG  23          3HB       ARG  23  -5.166   0.909  -9.439
  159   1HG   ARG  23          2HG       ARG  23  -2.778   0.889 -11.353
  160   2HG   ARG  23          3HG       ARG  23  -4.376   0.276 -11.765
  161   1HD   ARG  23          2HD       ARG  23  -3.685   3.152 -10.987
  162   2HD   ARG  23          3HD       ARG  23  -4.077   2.601 -12.597
  163    HE   ARG  23           HE       ARG  23  -5.892   3.214 -10.404
  164   1HH1  ARG  23          2HH2      ARG  23  -5.585   1.290 -13.333
  165   2HH1  ARG  23          1HH2      ARG  23  -7.288   1.163 -13.642
  166   1HH2  ARG  23          2HH1      ARG  23  -8.177   3.041 -10.739
  167   2HH2  ARG  23          1HH1      ARG  23  -8.795   2.178 -12.109
  168    H    ILE  24           H        ILE  24  -2.886  -0.643  -7.234
  169    HA   ILE  24           HA       ILE  24  -4.844  -0.082  -5.297
  170    HB   ILE  24           HB       ILE  24  -4.038  -1.863  -3.986
  171   1HG1  ILE  24          2HG1      ILE  24  -1.526  -1.481  -5.530
  172   2HG1  ILE  24          3HG1      ILE  24  -1.790  -1.455  -3.767
  173   1HG2  ILE  24          1HG2      ILE  24  -3.490  -2.676  -6.867
  174   2HG2  ILE  24          2HG2      ILE  24  -4.286  -3.572  -5.554
  175   3HG2  ILE  24          3HG2      ILE  24  -5.116  -2.220  -6.315
  176   1HD1  ILE  24          1HD1      ILE  24  -0.579  -3.457  -4.358
  177   2HD1  ILE  24          2HD1      ILE  24  -2.227  -3.915  -3.867
  178   3HD1  ILE  24          3HD1      ILE  24  -1.779  -3.850  -5.596
  179    H    GLU  25           H        GLU  25  -1.281   0.423  -4.997
  180    HA   GLU  25           HA       GLU  25  -1.345   1.723  -2.560
  181   1HB   GLU  25          2HB       GLU  25   0.592   1.253  -4.647
  182   2HB   GLU  25          3HB       GLU  25   0.738   2.930  -4.102
  183   1HG   GLU  25          2HG       GLU  25   2.151   1.407  -2.766
  184   2HG   GLU  25          3HG       GLU  25   0.910   2.173  -1.764
  185    H    LYS  26           H        LYS  26  -1.954   3.123  -5.755
  186    HA   LYS  26           HA       LYS  26  -1.924   5.871  -4.714
  187   1HB   LYS  26          2HB       LYS  26  -3.051   4.873  -7.344
  188   2HB   LYS  26          3HB       LYS  26  -2.748   6.553  -6.889
  189   1HG   LYS  26          2HG       LYS  26  -0.678   4.383  -7.362
  190   2HG   LYS  26          3HG       LYS  26  -1.021   5.776  -8.376
  191   1HD   LYS  26          2HD       LYS  26  -0.117   7.271  -6.585
  192   2HD   LYS  26          3HD       LYS  26   0.105   5.868  -5.530
  193   1HE   LYS  26          2HE       LYS  26   2.245   6.399  -6.424
  194   2HE   LYS  26          3HE       LYS  26   1.710   4.848  -7.077
  195   1HZ   LYS  26          1HZ       LYS  26   1.622   7.436  -8.495
  196   2HZ   LYS  26          2HZ       LYS  26   2.694   6.222  -8.756
  197   3HZ   LYS  26          3HZ       LYS  26   1.109   5.998  -9.115
  198    H    GLY  27           H        GLY  27  -4.518   3.502  -5.488
  199   1HA   GLY  27          2HA       GLY  27  -6.697   5.214  -4.682
  200   2HA   GLY  27          3HA       GLY  27  -6.699   3.441  -4.753
  201    H    LEU  28           H        LEU  28  -4.526   2.996  -3.009
  202    HA   LEU  28           HA       LEU  28  -5.712   2.924  -0.368
  203   1HB   LEU  28          2HB       LEU  28  -4.336   1.259  -1.154
  204   2HB   LEU  28          3HB       LEU  28  -3.023   2.381  -1.494
  205    HG   LEU  28           HG       LEU  28  -4.042   1.929   1.322
  206   1HD1  LEU  28          1HD1      LEU  28  -1.993   0.311   1.332
  207   2HD1  LEU  28          2HD1      LEU  28  -3.487  -0.201   0.515
  208   3HD1  LEU  28          3HD1      LEU  28  -2.099   0.382  -0.428
  209   1HD2  LEU  28          1HD2      LEU  28  -1.482   2.571   1.611
  210   2HD2  LEU  28          2HD2      LEU  28  -1.643   3.251  -0.007
  211   3HD2  LEU  28          3HD2      LEU  28  -2.687   3.829   1.313
  212    H    LYS  29           H        LYS  29  -3.218   5.048  -1.883
  213    HA   LYS  29           HA       LYS  29  -2.779   6.684   0.309
  214   1HB   LYS  29          2HB       LYS  29  -1.644   6.719  -2.008
  215   2HB   LYS  29          3HB       LYS  29  -2.975   7.784  -2.492
  216   1HG   LYS  29          2HG       LYS  29  -2.173   9.018  -0.158
  217   2HG   LYS  29          3HG       LYS  29  -0.669   8.261  -0.633
  218   1HD   LYS  29          2HD       LYS  29  -2.411  10.112  -2.351
  219   2HD   LYS  29          3HD       LYS  29  -0.995  10.602  -1.431
  220   1HE   LYS  29          2HE       LYS  29   0.252   8.725  -2.843
  221   2HE   LYS  29          3HE       LYS  29  -1.124   8.917  -3.942
  222   1HZ   LYS  29          1HZ       LYS  29  -0.502  11.366  -3.899
  223   2HZ   LYS  29          2HZ       LYS  29   0.860  10.916  -3.066
  224   3HZ   LYS  29          3HZ       LYS  29   0.655  10.381  -4.561
  225    H    ARG  30           H        ARG  30  -5.756   6.470  -1.537
  226    HA   ARG  30           HA       ARG  30  -6.695   9.111  -0.737
  227   1HB   ARG  30          2HB       ARG  30  -7.439   7.136  -2.636
  228   2HB   ARG  30          3HB       ARG  30  -8.825   7.293  -1.560
  229   1HG   ARG  30          2HG       ARG  30  -7.338   9.636  -2.834
  230   2HG   ARG  30          3HG       ARG  30  -8.602   8.743  -3.685
  231   1HD   ARG  30          2HD       ARG  30 -10.333   9.579  -2.367
  232   2HD   ARG  30          3HD       ARG  30  -9.314   9.702  -0.942
  233    HE   ARG  30           HE       ARG  30  -8.976  11.853  -1.344
  234   1HH1  ARG  30          2HH2      ARG  30  -9.595  10.359  -4.462
  235   2HH1  ARG  30          1HH2      ARG  30  -9.427  11.813  -5.398
  236   1HH2  ARG  30          2HH1      ARG  30  -8.775  13.824  -2.521
  237   2HH2  ARG  30          1HH1      ARG  30  -8.965  13.847  -4.242
  238    H    MET  31           H        MET  31  -6.121   6.373   1.133
  239    HA   MET  31           HA       MET  31  -8.442   6.500   2.819
  240   1HB   MET  31          2HB       MET  31  -5.613   5.458   3.157
  241   2HB   MET  31          3HB       MET  31  -6.762   5.354   4.479
  242   1HG   MET  31          2HG       MET  31  -7.438   4.212   1.768
  243   2HG   MET  31          3HG       MET  31  -6.428   3.348   2.927
  244   1HE   MET  31          1HE       MET  31 -10.112   5.231   3.212
  245   2HE   MET  31          2HE       MET  31  -9.997   4.086   1.848
  246   3HE   MET  31          3HE       MET  31 -10.970   3.689   3.284
  247    HA   PRO  32           HA       PRO  32  -7.416  10.020   5.379
  248   1HB   PRO  32          2HB       PRO  32  -8.218   9.158   7.877
  249   2HB   PRO  32          3HB       PRO  32  -9.350   9.664   6.592
  250   1HG   PRO  32          2HG       PRO  32  -8.488   6.847   7.284
  251   2HG   PRO  32          3HG       PRO  32 -10.154   7.452   7.038
  252   1HD   PRO  32          2HD       PRO  32  -8.812   6.187   5.081
  253   2HD   PRO  32          3HD       PRO  32  -9.829   7.599   4.679
  254    H    GLY  33           H        GLY  33  -5.566  10.640   6.514
  255   1HA   GLY  33          2HA       GLY  33  -3.683  10.409   7.849
  256   2HA   GLY  33          3HA       GLY  33  -3.937   8.662   7.941
  257    H    VAL  34           H        VAL  34  -4.125   8.478   4.865
  258    HA   VAL  34           HA       VAL  34  -1.223   8.086   4.634
  259    HB   VAL  34           HB       VAL  34  -3.332   7.429   2.567
  260   1HG1  VAL  34          1HG1      VAL  34  -1.469   5.809   1.893
  261   2HG1  VAL  34          2HG1      VAL  34  -1.039   7.519   1.694
  262   3HG1  VAL  34          3HG1      VAL  34  -0.420   6.602   3.066
  263   1HG2  VAL  34          1HG2      VAL  34  -3.900   6.221   4.619
  264   2HG2  VAL  34          2HG2      VAL  34  -3.162   5.109   3.461
  265   3HG2  VAL  34          3HG2      VAL  34  -2.213   5.722   4.834
  266    H    THR  35           H        THR  35   0.130   9.462   3.643
  267    HA   THR  35           HA       THR  35  -1.079  11.814   2.241
  268    HB   THR  35           HB       THR  35   1.133  11.520   4.168
  269    HG1  THR  35           1HG      THR  35  -0.945  13.399   3.777
  270   1HG2  THR  35          1HG2      THR  35   2.312  12.672   2.448
  271   2HG2  THR  35          2HG2      THR  35   0.914  13.719   2.080
  272   3HG2  THR  35          3HG2      THR  35   1.784  13.884   3.625
  273    H    ASP  36           H        ASP  36   1.551   9.303   2.004
  274    HA   ASP  36           HA       ASP  36   1.217   9.599  -0.825
  275   1HB   ASP  36          2HB       ASP  36   3.587  10.823   0.439
  276   2HB   ASP  36          3HB       ASP  36   4.038   9.570  -0.716
  277    H    ALA  37           H        ALA  37   2.619   7.970  -1.981
  278    HA   ALA  37           HA       ALA  37   3.185   5.562  -0.489
  279   1HB   ALA  37          1HB       ALA  37   0.671   5.539  -0.508
  280   2HB   ALA  37          2HB       ALA  37   0.709   5.597  -2.285
  281   3HB   ALA  37          3HB       ALA  37   1.386   4.203  -1.418
  282    H    ASN  38           H        ASN  38   4.164   3.889  -1.778
  283    HA   ASN  38           HA       ASN  38   4.960   4.639  -4.512
  284   1HB   ASN  38          2HB       ASN  38   7.424   4.256  -3.147
  285   2HB   ASN  38          3HB       ASN  38   6.829   5.678  -3.980
  286   1HD2  ASN  38          1HD2      ASN  38   5.973   4.189  -0.771
  287   2HD2  ASN  38          2HD2      ASN  38   6.386   5.648   0.126
  288    H    VAL  39           H        VAL  39   4.717   2.754  -5.500
  289    HA   VAL  39           HA       VAL  39   5.082   0.212  -4.088
  290    HB   VAL  39           HB       VAL  39   3.080   0.510  -5.309
  291   1HG1  VAL  39          1HG1      VAL  39   3.281   0.593  -7.921
  292   2HG1  VAL  39          2HG1      VAL  39   3.301   2.094  -6.970
  293   3HG1  VAL  39          3HG1      VAL  39   4.792   1.433  -7.636
  294   1HG2  VAL  39          1HG2      VAL  39   4.087  -1.704  -5.259
  295   2HG2  VAL  39          2HG2      VAL  39   3.119  -1.447  -6.715
  296   3HG2  VAL  39          3HG2      VAL  39   4.878  -1.385  -6.829
  297    H    ASN  40           H        ASN  40   7.320  -0.094  -3.796
  298    HA   ASN  40           HA       ASN  40   9.131   0.337  -6.070
  299   1HB   ASN  40          2HB       ASN  40   9.695   0.917  -3.710
  300   2HB   ASN  40          3HB       ASN  40   9.703  -0.809  -3.317
  301   1HD2  ASN  40          1HD2      ASN  40  12.004   0.272  -2.725
  302   2HD2  ASN  40          2HD2      ASN  40  13.220   0.034  -3.971
  303    H    LEU  41           H        LEU  41   7.421  -1.318  -7.055
  304    HA   LEU  41           HA       LEU  41   7.858  -4.124  -6.568
  305   1HB   LEU  41          2HB       LEU  41   6.206  -2.465  -8.321
  306   2HB   LEU  41          3HB       LEU  41   6.915  -3.769  -9.239
  307    HG   LEU  41           HG       LEU  41   4.645  -4.154  -8.223
  308   1HD1  LEU  41          1HD1      LEU  41   5.958  -5.961  -9.205
  309   2HD1  LEU  41          2HD1      LEU  41   6.841  -6.190  -7.682
  310   3HD1  LEU  41          3HD1      LEU  41   5.100  -6.537  -7.765
  311   1HD2  LEU  41          1HD2      LEU  41   4.294  -4.628  -6.015
  312   2HD2  LEU  41          2HD2      LEU  41   5.977  -5.056  -5.677
  313   3HD2  LEU  41          3HD2      LEU  41   5.522  -3.358  -5.836
  314    H    ALA  42           H        ALA  42   9.620  -1.740  -8.346
  315    HA   ALA  42           HA       ALA  42  11.157  -3.231 -10.128
  316   1HB   ALA  42          1HB       ALA  42  11.338  -0.775  -9.802
  317   2HB   ALA  42          2HB       ALA  42  12.102  -1.060  -8.216
  318   3HB   ALA  42          3HB       ALA  42  12.920  -1.584  -9.697
  319    H    THR  43           H        THR  43  11.287  -3.211  -6.541
  320    HA   THR  43           HA       THR  43  13.264  -5.432  -6.743
  321    HB   THR  43           HB       THR  43  14.222  -3.320  -5.972
  322    HG1  THR  43           1HG      THR  43  15.048  -5.431  -5.478
  323   1HG2  THR  43          1HG2      THR  43  12.852  -3.867  -3.307
  324   2HG2  THR  43          2HG2      THR  43  13.862  -2.485  -3.754
  325   3HG2  THR  43          3HG2      THR  43  12.242  -2.673  -4.463
  326    H    GLU  44           H        GLU  44  10.322  -5.468  -6.815
  327    HA   GLU  44           HA       GLU  44   8.468  -6.295  -5.782
  328   1HB   GLU  44          2HB       GLU  44  10.618  -8.271  -4.979
  329   2HB   GLU  44          3HB       GLU  44   8.882  -8.558  -4.794
  330   1HG   GLU  44          2HG       GLU  44   8.506  -8.279  -7.204
  331   2HG   GLU  44          3HG       GLU  44  10.226  -7.933  -7.461
  332    H    THR  45           H        THR  45   9.000  -4.130  -4.315
  333    HA   THR  45           HA       THR  45   8.140  -5.025  -1.649
  334    HB   THR  45           HB       THR  45  10.297  -2.931  -2.258
  335    HG1  THR  45           1HG      THR  45  10.472  -5.642  -1.913
  336   1HG2  THR  45          1HG2      THR  45   9.215  -4.181   0.272
  337   2HG2  THR  45          2HG2      THR  45  10.678  -3.161   0.210
  338   3HG2  THR  45          3HG2      THR  45   9.101  -2.460  -0.217
  339    H    VAL  46           H        VAL  46   7.002  -3.170  -0.537
  340    HA   VAL  46           HA       VAL  46   6.222  -0.934  -2.321
  341    HB   VAL  46           HB       VAL  46   4.494  -2.545  -2.674
  342   1HG1  VAL  46          1HG1      VAL  46   4.360  -2.763   0.348
  343   2HG1  VAL  46          2HG1      VAL  46   3.073  -3.349  -0.714
  344   3HG1  VAL  46          3HG1      VAL  46   4.684  -4.073  -0.806
  345   1HG2  VAL  46          1HG2      VAL  46   3.824  -0.147  -2.283
  346   2HG2  VAL  46          2HG2      VAL  46   2.600  -1.399  -2.002
  347   3HG2  VAL  46          3HG2      VAL  46   3.380  -0.602  -0.620
  348    H    ASN  47           H        ASN  47   5.744   1.004  -1.223
  349    HA   ASN  47           HA       ASN  47   6.273   0.998   1.683
  350   1HB   ASN  47          2HB       ASN  47   7.558   2.672  -0.528
  351   2HB   ASN  47          3HB       ASN  47   7.513   3.217   1.153
  352   1HD2  ASN  47          1HD2      ASN  47   8.366   1.554   2.808
  353   2HD2  ASN  47          2HD2      ASN  47   9.927   0.892   2.346
  354    H    VAL  48           H        VAL  48   5.056   2.610   2.825
  355    HA   VAL  48           HA       VAL  48   3.199   4.247   1.219
  356    HB   VAL  48           HB       VAL  48   2.297   2.509   3.537
  357   1HG1  VAL  48          1HG1      VAL  48   1.136   4.764   3.082
  358   2HG1  VAL  48          2HG1      VAL  48   0.674   4.111   1.505
  359   3HG1  VAL  48          3HG1      VAL  48   0.098   3.333   2.993
  360   1HG2  VAL  48          1HG2      VAL  48   2.710   1.066   1.558
  361   2HG2  VAL  48          2HG2      VAL  48   0.974   1.256   1.838
  362   3HG2  VAL  48          3HG2      VAL  48   1.772   2.170   0.544
  363    H    ILE  49           H        ILE  49   3.135   6.265   2.066
  364    HA   ILE  49           HA       ILE  49   4.736   6.735   4.488
  365    HB   ILE  49           HB       ILE  49   4.070   8.743   2.303
  366   1HG1  ILE  49          2HG1      ILE  49   5.264   7.053   1.136
  367   2HG1  ILE  49          3HG1      ILE  49   6.313   8.437   1.406
  368   1HG2  ILE  49          1HG2      ILE  49   6.042   9.925   3.259
  369   2HG2  ILE  49          2HG2      ILE  49   4.711   9.746   4.406
  370   3HG2  ILE  49          3HG2      ILE  49   6.132   8.701   4.544
  371   1HD1  ILE  49          1HD1      ILE  49   6.408   5.793   2.915
  372   2HD1  ILE  49          2HD1      ILE  49   7.596   6.424   1.768
  373   3HD1  ILE  49          3HD1      ILE  49   7.379   7.225   3.330
  374    H    TYR  50           H        TYR  50   3.182   6.733   6.145
  375    HA   TYR  50           HA       TYR  50   0.768   8.460   5.780
  376   1HB   TYR  50          2HB       TYR  50  -0.681   6.813   6.681
  377   2HB   TYR  50          3HB       TYR  50   0.061   6.251   5.212
  378    HD1  TYR  50           HD1      TYR  50   0.500   5.980   8.954
  379    HD2  TYR  50           HD2      TYR  50   0.666   3.992   5.151
  380    HE1  TYR  50           HE1      TYR  50   0.822   3.836  10.098
  381    HE2  TYR  50           HE2      TYR  50   0.657   1.810   6.304
  382    HH   TYR  50           HH       TYR  50   1.072   1.520   9.784
  383    H    ASP  51           H        ASP  51  -0.379   8.895   7.680
  384    HA   ASP  51           HA       ASP  51   1.373   9.522   9.944
  385   1HB   ASP  51          2HB       ASP  51  -0.201  11.184   9.345
  386   2HB   ASP  51          3HB       ASP  51  -1.548  10.039   9.414
  387    HA   PRO  52           HA       PRO  52   0.156   5.488  11.646
  388   1HB   PRO  52          2HB       PRO  52   1.976   5.230  13.623
  389   2HB   PRO  52          3HB       PRO  52   2.430   5.137  11.897
  390   1HG   PRO  52          2HG       PRO  52   2.566   7.579  13.700
  391   2HG   PRO  52          3HG       PRO  52   3.883   6.890  12.703
  392   1HD   PRO  52          2HD       PRO  52   2.327   8.937  11.827
  393   2HD   PRO  52          3HD       PRO  52   2.877   7.654  10.704
  394    H    ALA  53           H        ALA  53  -0.619   8.568  12.828
  395    HA   ALA  53           HA       ALA  53  -1.710   7.598  15.393
  396   1HB   ALA  53          1HB       ALA  53  -1.975  10.280  13.985
  397   2HB   ALA  53          2HB       ALA  53  -2.434   9.887  15.649
  398   3HB   ALA  53          3HB       ALA  53  -0.718   9.894  15.181
  399    H    GLU  54           H        GLU  54  -2.510   8.236  11.979
  400    HA   GLU  54           HA       GLU  54  -5.368   8.002  12.628
  401   1HB   GLU  54          2HB       GLU  54  -4.058   9.822  10.930
  402   2HB   GLU  54          3HB       GLU  54  -4.755   8.613   9.848
  403   1HG   GLU  54          2HG       GLU  54  -6.531   9.961   9.907
  404   2HG   GLU  54          3HG       GLU  54  -6.948   9.007  11.332
  405    H    THR  55           H        THR  55  -2.987   6.953  10.171
  406    HA   THR  55           HA       THR  55  -4.279   4.329   9.983
  407    HB   THR  55           HB       THR  55  -2.387   4.095   8.032
  408    HG1  THR  55           1HG      THR  55  -3.425   6.613   7.701
  409   1HG2  THR  55          1HG2      THR  55  -5.185   5.345   7.952
  410   2HG2  THR  55          2HG2      THR  55  -4.290   4.715   6.542
  411   3HG2  THR  55          3HG2      THR  55  -4.755   3.614   7.866
  412    H    GLY  56           H        GLY  56  -2.207   2.768   9.462
  413   1HA   GLY  56          2HA       GLY  56  -0.598   1.761  11.311
  414   2HA   GLY  56          3HA       GLY  56  -1.991   2.212  12.315
  415    H    THR  57           H        THR  57  -1.005   0.490   9.685
  416    HA   THR  57           HA       THR  57  -1.712  -0.455   7.915
  417    HB   THR  57           HB       THR  57  -1.585  -2.937   8.313
  418    HG1  THR  57           1HG      THR  57  -1.281  -3.554  10.520
  419   1HG2  THR  57          1HG2      THR  57   0.662  -2.973   9.271
  420   2HG2  THR  57          2HG2      THR  57   0.508  -1.584   8.178
  421   3HG2  THR  57          3HG2      THR  57   0.456  -1.347   9.941
  422    H    ALA  58           H        ALA  58  -4.054  -0.955  10.441
  423    HA   ALA  58           HA       ALA  58  -6.194  -2.302   9.609
  424   1HB   ALA  58          1HB       ALA  58  -6.020  -0.769  11.534
  425   2HB   ALA  58          2HB       ALA  58  -6.008   0.616  10.444
  426   3HB   ALA  58          3HB       ALA  58  -7.483  -0.379  10.584
  427    H    ALA  59           H        ALA  59  -5.429   0.952   8.292
  428    HA   ALA  59           HA       ALA  59  -7.977   0.756   6.766
  429   1HB   ALA  59          1HB       ALA  59  -6.085   3.002   6.239
  430   2HB   ALA  59          2HB       ALA  59  -7.849   2.968   6.299
  431   3HB   ALA  59          3HB       ALA  59  -6.951   2.925   7.812
  432    H    ILE  60           H        ILE  60  -4.546   0.674   6.201
  433    HA   ILE  60           HA       ILE  60  -4.509   0.569   3.389
  434    HB   ILE  60           HB       ILE  60  -2.652  -0.121   5.684
  435   1HG1  ILE  60          2HG1      ILE  60  -1.134   1.205   4.076
  436   2HG1  ILE  60          3HG1      ILE  60  -2.601   1.446   3.116
  437   1HG2  ILE  60          1HG2      ILE  60  -0.928  -1.040   4.192
  438   2HG2  ILE  60          2HG2      ILE  60  -2.251  -2.149   4.469
  439   3HG2  ILE  60          3HG2      ILE  60  -2.150  -1.277   2.924
  440   1HD1  ILE  60          1HD1      ILE  60  -2.246   2.218   6.067
  441   2HD1  ILE  60          2HD1      ILE  60  -2.001   3.329   4.712
  442   3HD1  ILE  60          3HD1      ILE  60  -3.617   2.671   5.023
  443    H    GLN  61           H        GLN  61  -4.503  -2.116   5.781
  444    HA   GLN  61           HA       GLN  61  -4.514  -4.107   3.791
  445   1HB   GLN  61          2HB       GLN  61  -4.388  -4.011   6.558
  446   2HB   GLN  61          3HB       GLN  61  -5.813  -5.006   6.229
  447   1HG   GLN  61          2HG       GLN  61  -4.550  -6.680   5.207
  448   2HG   GLN  61          3HG       GLN  61  -3.260  -5.583   4.704
  449   1HE2  GLN  61          1HE2      GLN  61  -1.921  -4.548   6.441
  450   2HE2  GLN  61          2HE2      GLN  61  -1.506  -5.585   7.802
  451    H    GLU  62           H        GLU  62  -7.220  -2.532   5.529
  452    HA   GLU  62           HA       GLU  62  -9.414  -3.844   4.386
  453   1HB   GLU  62          2HB       GLU  62  -8.821  -1.178   5.570
  454   2HB   GLU  62          3HB       GLU  62 -10.157  -1.143   4.443
  455   1HG   GLU  62          2HG       GLU  62 -10.240  -3.397   6.418
  456   2HG   GLU  62          3HG       GLU  62 -10.378  -1.772   7.085
  457    H    LYS  63           H        LYS  63  -7.749  -0.941   2.977
  458    HA   LYS  63           HA       LYS  63  -9.293  -1.089   0.584
  459   1HB   LYS  63          2HB       LYS  63  -6.872   0.384   1.592
  460   2HB   LYS  63          3HB       LYS  63  -7.206   0.393  -0.112
  461   1HG   LYS  63          2HG       LYS  63  -9.164   1.207   2.054
  462   2HG   LYS  63          3HG       LYS  63  -8.160   2.286   1.073
  463   1HD   LYS  63          2HD       LYS  63  -9.910   2.563  -0.214
  464   2HD   LYS  63          3HD       LYS  63  -9.465   1.019  -0.942
  465   1HE   LYS  63          2HE       LYS  63 -11.192  -0.149   0.299
  466   2HE   LYS  63          3HE       LYS  63 -11.347   1.158   1.477
  467   1HZ   LYS  63          1HZ       LYS  63 -12.359   2.496  -0.192
  468   2HZ   LYS  63          2HZ       LYS  63 -12.158   1.332  -1.343
  469   3HZ   LYS  63          3HZ       LYS  63 -13.157   1.069  -0.065
  470    H    ILE  64           H        ILE  64  -6.104  -2.363   1.438
  471    HA   ILE  64           HA       ILE  64  -5.100  -3.101  -0.986
  472    HB   ILE  64           HB       ILE  64  -4.698  -3.759   1.762
  473   1HG1  ILE  64          2HG1      ILE  64  -3.237  -2.449   0.247
  474   2HG1  ILE  64          3HG1      ILE  64  -2.434  -3.666   1.230
  475   1HG2  ILE  64          1HG2      ILE  64  -4.368  -6.136  -0.029
  476   2HG2  ILE  64          2HG2      ILE  64  -3.440  -5.889   1.466
  477   3HG2  ILE  64          3HG2      ILE  64  -5.188  -6.025   1.546
  478   1HD1  ILE  64          1HD1      ILE  64  -2.393  -5.227  -0.692
  479   2HD1  ILE  64          2HD1      ILE  64  -3.221  -4.027  -1.695
  480   3HD1  ILE  64          3HD1      ILE  64  -1.586  -3.695  -1.076
  481    H    GLU  65           H        GLU  65  -7.181  -4.991   1.269
  482    HA   GLU  65           HA       GLU  65  -7.840  -7.199  -0.388
  483   1HB   GLU  65          2HB       GLU  65  -9.085  -5.881   2.045
  484   2HB   GLU  65          3HB       GLU  65  -9.897  -7.227   1.238
  485   1HG   GLU  65          2HG       GLU  65  -6.991  -7.632   1.874
  486   2HG   GLU  65          3HG       GLU  65  -8.124  -7.593   3.230
  487    H    LYS  66           H        LYS  66  -9.799  -4.233   0.309
  488    HA   LYS  66           HA       LYS  66 -11.923  -5.043  -1.390
  489   1HB   LYS  66          2HB       LYS  66 -11.123  -2.455  -0.093
  490   2HB   LYS  66          3HB       LYS  66 -12.281  -2.383  -1.422
  491   1HG   LYS  66          2HG       LYS  66 -13.585  -2.544   0.538
  492   2HG   LYS  66          3HG       LYS  66 -13.696  -4.098  -0.293
  493   1HD   LYS  66          2HD       LYS  66 -11.857  -4.929   1.322
  494   2HD   LYS  66          3HD       LYS  66 -12.061  -3.389   2.184
  495   1HE   LYS  66          2HE       LYS  66 -14.529  -3.959   2.424
  496   2HE   LYS  66          3HE       LYS  66 -14.171  -5.556   1.734
  497   1HZ   LYS  66          1HZ       LYS  66 -12.612  -5.861   3.608
  498   2HZ   LYS  66          2HZ       LYS  66 -13.051  -4.405   4.198
  499   3HZ   LYS  66          3HZ       LYS  66 -14.157  -5.602   4.138
  500    H    LEU  67           H        LEU  67  -8.951  -3.368  -2.245
  501    HA   LEU  67           HA       LEU  67  -9.758  -2.647  -4.926
  502   1HB   LEU  67          2HB       LEU  67  -7.138  -2.858  -3.428
  503   2HB   LEU  67          3HB       LEU  67  -7.146  -2.586  -5.166
  504    HG   LEU  67           HG       LEU  67  -8.928  -0.825  -3.482
  505   1HD1  LEU  67          1HD1      LEU  67  -6.865   0.793  -3.440
  506   2HD1  LEU  67          2HD1      LEU  67  -7.030  -0.449  -2.196
  507   3HD1  LEU  67          3HD1      LEU  67  -5.920  -0.710  -3.526
  508   1HD2  LEU  67          1HD2      LEU  67  -8.430   0.784  -5.261
  509   2HD2  LEU  67          2HD2      LEU  67  -7.234  -0.317  -5.972
  510   3HD2  LEU  67          3HD2      LEU  67  -8.956  -0.742  -5.987
  511    H    GLY  68           H        GLY  68  -9.016  -5.689  -3.481
  512   1HA   GLY  68          2HA       GLY  68  -9.261  -7.746  -4.488
  513   2HA   GLY  68          3HA       GLY  68  -9.163  -7.021  -6.101
  514    H    TYR  69           H        TYR  69  -6.989  -6.816  -3.211
  515    HA   TYR  69           HA       TYR  69  -4.776  -8.139  -4.681
  516   1HB   TYR  69          2HB       TYR  69  -5.126  -5.280  -4.262
  517   2HB   TYR  69          3HB       TYR  69  -3.771  -5.842  -3.307
  518    HD1  TYR  69           HD1      TYR  69  -1.738  -6.639  -4.328
  519    HD2  TYR  69           HD2      TYR  69  -5.185  -5.730  -6.751
  520    HE1  TYR  69           HE1      TYR  69  -0.310  -6.449  -6.287
  521    HE2  TYR  69           HE2      TYR  69  -3.765  -5.656  -8.748
  522    HH   TYR  69           HH       TYR  69  -0.202  -6.043  -8.567
  523    H    HIS  70           H        HIS  70  -2.842  -8.245  -2.989
  524    HA   HIS  70           HA       HIS  70  -3.782  -8.240  -0.223
  525   1HB   HIS  70          2HB       HIS  70  -4.314 -10.518  -1.189
  526   2HB   HIS  70          3HB       HIS  70  -2.581 -10.764  -1.406
  527    HD1  HIS  70           1HD      HIS  70  -2.265 -12.621   0.445
  528    HD2  HIS  70           2HD      HIS  70  -4.455  -9.262   1.724
  529    HE1  HIS  70           1HE      HIS  70  -2.695 -12.925   2.941
  530    H    VAL  71           H        VAL  71  -2.078  -8.020   1.259
  531    HA   VAL  71           HA       VAL  71   0.576  -7.366   0.078
  532    HB   VAL  71           HB       VAL  71  -0.861  -5.434   0.902
  533   1HG1  VAL  71          1HG1      VAL  71  -1.034  -4.966   3.242
  534   2HG1  VAL  71          2HG1      VAL  71  -1.738  -6.573   2.984
  535   3HG1  VAL  71          3HG1      VAL  71  -0.112  -6.414   3.679
  536   1HG2  VAL  71          1HG2      VAL  71   1.850  -5.803   2.183
  537   2HG2  VAL  71          2HG2      VAL  71   1.508  -5.191   0.540
  538   3HG2  VAL  71          3HG2      VAL  71   0.971  -4.276   1.949
  539    H    VAL  72           H        VAL  72   2.373  -8.132   1.313
  540    HA   VAL  72           HA       VAL  72   1.705 -10.133   3.431
  541    HB   VAL  72           HB       VAL  72   3.871 -10.507   1.436
  542   1HG1  VAL  72          1HG1      VAL  72   3.806 -12.829   2.261
  543   2HG1  VAL  72          2HG1      VAL  72   4.034 -11.722   3.619
  544   3HG1  VAL  72          3HG1      VAL  72   2.440 -12.438   3.324
  545   1HG2  VAL  72          1HG2      VAL  72   1.053 -11.659   1.332
  546   2HG2  VAL  72          2HG2      VAL  72   1.805 -10.584   0.129
  547   3HG2  VAL  72          3HG2      VAL  72   2.425 -12.226   0.354
  548    H    ILE  73           H        ILE  73   3.121 -10.118   5.159
  549    HA   ILE  73           HA       ILE  73   4.991  -7.790   5.247
  550    HB   ILE  73           HB       ILE  73   3.330  -8.995   7.463
  551   1HG1  ILE  73          2HG1      ILE  73   2.701  -6.396   7.478
  552   2HG1  ILE  73          3HG1      ILE  73   3.205  -6.473   5.792
  553   1HG2  ILE  73          1HG2      ILE  73   4.254  -7.180   8.827
  554   2HG2  ILE  73          2HG2      ILE  73   5.544  -8.275   8.339
  555   3HG2  ILE  73          3HG2      ILE  73   5.350  -6.725   7.494
  556   1HD1  ILE  73          1HD1      ILE  73   1.123  -8.224   7.138
  557   2HD1  ILE  73          2HD1      ILE  73   0.769  -6.776   6.163
  558   3HD1  ILE  73          3HD1      ILE  73   1.490  -8.201   5.391
  559    H    GLU  74           H        GLU  74   6.505  -9.312   4.145
  560    HA   GLU  74           HA       GLU  74   7.653 -11.398   5.555
  561   1HB   GLU  74          2HB       GLU  74   8.340  -9.811   3.160
  562   2HB   GLU  74          3HB       GLU  74   9.686 -10.572   4.010
  563   1HG   GLU  74          2HG       GLU  74   8.816 -12.052   2.242
  564   2HG   GLU  74          3HG       GLU  74   8.664 -12.771   3.851
  565    H    GLY  75           H        GLY  75   7.762  -8.248   6.235
  566   1HA   GLY  75          2HA       GLY  75   8.786  -7.072   8.023
  567   2HA   GLY  75          3HA       GLY  75   9.715  -8.527   8.418
  568    H    ARG  76           H        ARG  76   9.458  -5.788   6.191
  569    HA   ARG  76           HA       ARG  76  10.745  -4.681   4.873
  570   1HB   ARG  76          2HB       ARG  76  11.866  -4.253   6.944
  571   2HB   ARG  76          3HB       ARG  76  12.843  -5.705   6.793
  572   1HG   ARG  76          2HG       ARG  76  14.221  -3.786   6.338
  573   2HG   ARG  76          3HG       ARG  76  14.063  -4.776   4.898
  574   1HD   ARG  76          2HD       ARG  76  12.099  -3.111   4.280
  575   2HD   ARG  76          3HD       ARG  76  12.819  -2.092   5.552
  576    HE   ARG  76           HE       ARG  76  14.517  -3.216   3.384
  577   1HH1  ARG  76          2HH2      ARG  76  12.679  -0.402   4.456
  578   2HH1  ARG  76          1HH2      ARG  76  13.409   0.714   3.345
  579   1HH2  ARG  76          2HH1      ARG  76  15.500  -1.776   1.880
  580   2HH2  ARG  76          1HH1      ARG  76  15.044  -0.102   1.822
  Start of MODEL    9
    1   1H    MET   1          H1        MET   1  -2.597  16.146  19.248
    2   2H    MET   1          H2        MET   1  -1.879  16.403  20.734
    3   3H    MET   1          H3        MET   1  -2.178  17.658  19.684
    4    HA   MET   1           HA       MET   1   0.082  17.235  19.392
    5   1HB   MET   1          2HB       MET   1  -0.850  14.331  19.302
    6   2HB   MET   1          3HB       MET   1   0.715  14.840  18.658
    7   1HG   MET   1          2HG       MET   1   1.418  15.696  20.817
    8   2HG   MET   1          3HG       MET   1  -0.144  15.277  21.544
    9   1HE   MET   1          1HE       MET   1   2.420  12.791  23.181
   10   2HE   MET   1          2HE       MET   1   2.782  14.448  22.648
   11   3HE   MET   1          3HE       MET   1   1.246  14.093  23.484
   12    H    LEU   2           H        LEU   2   1.076  16.808  17.174
   13    HA   LEU   2           HA       LEU   2  -0.917  17.221  15.015
   14   1HB   LEU   2          2HB       LEU   2   2.061  17.611  15.374
   15   2HB   LEU   2          3HB       LEU   2   1.452  17.335  13.747
   16    HG   LEU   2           HG       LEU   2   0.138  19.450  15.469
   17   1HD1  LEU   2          1HD1      LEU   2   2.527  19.978  15.563
   18   2HD1  LEU   2          2HD1      LEU   2   2.668  19.790  13.801
   19   3HD1  LEU   2          3HD1      LEU   2   1.698  21.113  14.484
   20   1HD2  LEU   2          1HD2      LEU   2   0.603  19.164  12.456
   21   2HD2  LEU   2          2HD2      LEU   2  -0.908  18.749  13.288
   22   3HD2  LEU   2          3HD2      LEU   2  -0.350  20.430  13.251
   23    H    SER   3           H        SER   3  -0.893  15.822  13.139
   24    HA   SER   3           HA       SER   3  -0.516  13.079  13.491
   25   1HB   SER   3          2HB       SER   3  -0.376  14.541  10.825
   26   2HB   SER   3          3HB       SER   3  -1.087  12.976  11.204
   27    HG   SER   3           HG       SER   3  -2.747  14.472  11.083
   28    H    GLU   4           H        GLU   4   1.489  12.334  14.090
   29    HA   GLU   4           HA       GLU   4   3.986  13.146  12.801
   30   1HB   GLU   4          2HB       GLU   4   3.134  11.097  14.754
   31   2HB   GLU   4          3HB       GLU   4   4.412  10.591  13.680
   32   1HG   GLU   4          2HG       GLU   4   5.562  12.759  14.334
   33   2HG   GLU   4          3HG       GLU   4   4.403  12.789  15.670
   34    H    GLN   5           H        GLN   5   5.134  11.290  11.522
   35    HA   GLN   5           HA       GLN   5   3.264   9.843   9.733
   36   1HB   GLN   5          2HB       GLN   5   5.561  11.630   8.916
   37   2HB   GLN   5          3HB       GLN   5   4.860  10.412   7.870
   38   1HG   GLN   5          2HG       GLN   5   2.729  12.101   8.989
   39   2HG   GLN   5          3HG       GLN   5   3.981  13.097   8.249
   40   1HE2  GLN   5          1HE2      GLN   5   2.793   9.808   7.405
   41   2HE2  GLN   5          2HE2      GLN   5   2.254  10.245   5.794
   42    H    LYS   6           H        LYS   6   4.175   7.957   8.787
   43    HA   LYS   6           HA       LYS   6   6.913   7.220   9.431
   44   1HB   LYS   6          2HB       LYS   6   4.508   5.549  10.289
   45   2HB   LYS   6          3HB       LYS   6   6.134   4.888  10.153
   46   1HG   LYS   6          2HG       LYS   6   5.377   7.146  12.045
   47   2HG   LYS   6          3HG       LYS   6   5.490   5.427  12.454
   48   1HD   LYS   6          2HD       LYS   6   7.932   5.489  11.711
   49   2HD   LYS   6          3HD       LYS   6   7.759   7.218  11.423
   50   1HE   LYS   6          2HE       LYS   6   8.808   6.915  13.559
   51   2HE   LYS   6          3HE       LYS   6   7.213   7.650  13.773
   52   1HZ   LYS   6          1HZ       LYS   6   6.372   5.513  14.424
   53   2HZ   LYS   6          2HZ       LYS   6   7.830   4.790  14.156
   54   3HZ   LYS   6          3HZ       LYS   6   7.660   5.902  15.362
   55    H    GLU   7           H        GLU   7   7.624   5.427   8.266
   56    HA   GLU   7           HA       GLU   7   6.418   5.185   5.585
   57   1HB   GLU   7          2HB       GLU   7   9.356   4.853   6.248
   58   2HB   GLU   7          3HB       GLU   7   8.542   5.307   4.753
   59   1HG   GLU   7          2HG       GLU   7   9.686   7.221   5.570
   60   2HG   GLU   7          3HG       GLU   7   7.983   7.532   5.935
   61    H    ILE   8           H        ILE   8   5.338   3.147   5.844
   62    HA   ILE   8           HA       ILE   8   6.714   1.020   7.314
   63    HB   ILE   8           HB       ILE   8   4.182   0.988   5.770
   64   1HG1  ILE   8          2HG1      ILE   8   3.723   2.730   7.266
   65   2HG1  ILE   8          3HG1      ILE   8   2.942   1.250   7.850
   66   1HG2  ILE   8          1HG2      ILE   8   3.676  -0.838   7.478
   67   2HG2  ILE   8          2HG2      ILE   8   4.873  -1.182   6.216
   68   3HG2  ILE   8          3HG2      ILE   8   5.421  -0.735   7.857
   69   1HD1  ILE   8          1HD1      ILE   8   3.996   2.401   9.692
   70   2HD1  ILE   8          2HD1      ILE   8   4.814   0.846   9.359
   71   3HD1  ILE   8          3HD1      ILE   8   5.554   2.374   8.821
   72    H    ALA   9           H        ALA   9   7.007  -1.084   6.157
   73    HA   ALA   9           HA       ALA   9   7.329  -0.926   3.248
   74   1HB   ALA   9          1HB       ALA   9   9.465  -2.101   3.321
   75   2HB   ALA   9          2HB       ALA   9   9.616  -0.579   4.223
   76   3HB   ALA   9          3HB       ALA   9   9.442  -2.111   5.098
   77    H    MET  10           H        MET  10   6.580  -2.898   2.315
   78    HA   MET  10           HA       MET  10   6.563  -5.311   3.913
   79   1HB   MET  10          2HB       MET  10   4.227  -5.836   3.771
   80   2HB   MET  10          3HB       MET  10   4.448  -4.377   4.738
   81   1HG   MET  10          2HG       MET  10   3.585  -4.446   1.832
   82   2HG   MET  10          3HG       MET  10   2.467  -4.466   3.168
   83   1HE   MET  10          1HE       MET  10   1.302  -2.506   4.084
   84   2HE   MET  10          2HE       MET  10   2.701  -2.499   5.191
   85   3HE   MET  10          3HE       MET  10   2.128  -0.978   4.458
   86    H    GLN  11           H        GLN  11   5.372  -7.126   2.502
   87    HA   GLN  11           HA       GLN  11   6.532  -6.881  -0.232
   88   1HB   GLN  11          2HB       GLN  11   6.024  -9.189   1.701
   89   2HB   GLN  11          3HB       GLN  11   6.124  -9.498  -0.029
   90   1HG   GLN  11          2HG       GLN  11   8.284  -8.195   1.688
   91   2HG   GLN  11          3HG       GLN  11   8.309  -9.851   1.051
   92   1HE2  GLN  11          1HE2      GLN  11   7.723  -9.856  -1.519
   93   2HE2  GLN  11          2HE2      GLN  11   8.345  -8.514  -2.432
   94    H    VAL  12           H        VAL  12   5.354  -7.906  -1.975
   95    HA   VAL  12           HA       VAL  12   2.430  -7.324  -1.745
   96    HB   VAL  12           HB       VAL  12   4.310  -7.083  -4.135
   97   1HG1  VAL  12          1HG1      VAL  12   2.416  -5.753  -5.112
   98   2HG1  VAL  12          2HG1      VAL  12   2.045  -7.461  -4.938
   99   3HG1  VAL  12          3HG1      VAL  12   1.388  -6.286  -3.769
  100   1HG2  VAL  12          1HG2      VAL  12   4.903  -5.375  -2.562
  101   2HG2  VAL  12          2HG2      VAL  12   3.871  -4.586  -3.750
  102   3HG2  VAL  12          3HG2      VAL  12   3.188  -5.037  -2.188
  103    H    SER  13           H        SER  13   1.011  -8.631  -3.184
  104    HA   SER  13           HA       SER  13   2.163 -10.890  -4.592
  105   1HB   SER  13          2HB       SER  13   0.144 -11.256  -2.334
  106   2HB   SER  13          3HB       SER  13   0.466 -12.483  -3.569
  107    HG   SER  13           HG       SER  13   2.725 -11.456  -2.333
  108    H    GLY  14           H        GLY  14   0.390 -11.836  -5.997
  109   1HA   GLY  14          2HA       GLY  14  -1.614 -11.643  -7.194
  110   2HA   GLY  14          3HA       GLY  14  -1.946 -10.068  -6.473
  111    H    MET  15           H        MET  15   0.835  -9.071  -7.119
  112    HA   MET  15           HA       MET  15   0.374  -7.831  -9.568
  113   1HB   MET  15          2HB       MET  15   2.743  -7.334  -9.620
  114   2HB   MET  15          3HB       MET  15   1.986  -6.971  -8.053
  115   1HG   MET  15          2HG       MET  15   3.630  -8.150  -7.051
  116   2HG   MET  15          3HG       MET  15   3.002  -9.615  -7.794
  117   1HE   MET  15          1HE       MET  15   6.727 -10.285  -8.289
  118   2HE   MET  15          2HE       MET  15   5.803  -9.735  -6.872
  119   3HE   MET  15          3HE       MET  15   5.136 -10.995  -7.936
  120    H    THR  16           H        THR  16  -0.132  -8.866 -11.389
  121    HA   THR  16           HA       THR  16   2.006 -10.309 -12.753
  122    HB   THR  16           HB       THR  16  -0.003 -12.022 -13.317
  123    HG1  THR  16           1HG      THR  16  -0.604 -11.089 -10.795
  124   1HG2  THR  16          1HG2      THR  16   2.283 -12.701 -12.817
  125   2HG2  THR  16          2HG2      THR  16   2.027 -12.458 -11.078
  126   3HG2  THR  16          3HG2      THR  16   1.116 -13.699 -11.945
  127    H    CYS  17           H        CYS  17   0.191  -7.782 -13.095
  128    HA   CYS  17           HA       CYS  17  -0.931  -8.478 -15.783
  129   1HB   CYS  17          2HB       CYS  17  -1.456  -5.956 -14.170
  130   2HB   CYS  17          3HB       CYS  17  -2.380  -6.645 -15.506
  131    H    ALA  18           H        ALA  18   0.678  -5.880 -14.049
  132    HA   ALA  18           HA       ALA  18   2.969  -5.627 -15.660
  133   1HB   ALA  18          1HB       ALA  18   1.555  -4.650 -17.409
  134   2HB   ALA  18          2HB       ALA  18   0.782  -3.561 -16.239
  135   3HB   ALA  18          3HB       ALA  18   2.500  -3.362 -16.647
  136    H    ALA  19           H        ALA  19   0.559  -3.567 -13.966
  137    HA   ALA  19           HA       ALA  19   2.409  -3.012 -11.722
  138   1HB   ALA  19          1HB       ALA  19   1.661  -0.970 -13.828
  139   2HB   ALA  19          2HB       ALA  19   2.598  -0.640 -12.341
  140   3HB   ALA  19          3HB       ALA  19   3.268  -1.693 -13.605
  141    H    CYS  20           H        CYS  20  -0.434  -4.020 -12.001
  142    HA   CYS  20           HA       CYS  20  -2.244  -2.038 -11.127
  143   1HB   CYS  20          2HB       CYS  20  -2.067  -5.025 -10.590
  144   2HB   CYS  20          3HB       CYS  20  -3.467  -4.025 -10.154
  145    H    ALA  21           H        ALA  21   0.238  -3.836  -9.332
  146    HA   ALA  21           HA       ALA  21  -0.355  -3.057  -6.729
  147   1HB   ALA  21          1HB       ALA  21   1.410  -4.636  -7.328
  148   2HB   ALA  21          2HB       ALA  21   2.366  -3.313  -8.034
  149   3HB   ALA  21          3HB       ALA  21   2.034  -3.346  -6.284
  150    H    ALA  22           H        ALA  22   0.739  -0.973  -9.387
  151    HA   ALA  22           HA       ALA  22   1.428   1.251  -7.608
  152   1HB   ALA  22          1HB       ALA  22   0.675   1.317 -10.557
  153   2HB   ALA  22          2HB       ALA  22   1.514   2.567  -9.622
  154   3HB   ALA  22          3HB       ALA  22   2.318   1.015  -9.957
  155    H    ARG  23           H        ARG  23  -1.437   0.114  -9.412
  156    HA   ARG  23           HA       ARG  23  -3.018   2.466  -8.947
  157   1HB   ARG  23          2HB       ARG  23  -3.881  -0.413  -9.456
  158   2HB   ARG  23          3HB       ARG  23  -4.949   0.981  -9.482
  159   1HG   ARG  23          2HG       ARG  23  -2.499   0.747 -11.298
  160   2HG   ARG  23          3HG       ARG  23  -4.073   0.101 -11.743
  161   1HD   ARG  23          2HD       ARG  23  -3.587   3.033 -11.044
  162   2HD   ARG  23          3HD       ARG  23  -3.583   2.352 -12.683
  163    HE   ARG  23           HE       ARG  23  -5.988   1.565 -11.409
  164   1HH1  ARG  23          2HH2      ARG  23  -4.460   4.482 -12.649
  165   2HH1  ARG  23          1HH2      ARG  23  -5.933   5.250 -13.159
  166   1HH2  ARG  23          2HH1      ARG  23  -7.982   2.536 -12.080
  167   2HH2  ARG  23          1HH1      ARG  23  -7.990   4.105 -12.811
  168    H    ILE  24           H        ILE  24  -2.688  -0.663  -7.174
  169    HA   ILE  24           HA       ILE  24  -4.566   0.072  -5.205
  170    HB   ILE  24           HB       ILE  24  -3.846  -1.593  -3.769
  171   1HG1  ILE  24          2HG1      ILE  24  -1.327  -1.493  -5.312
  172   2HG1  ILE  24          3HG1      ILE  24  -1.547  -1.275  -3.563
  173   1HG2  ILE  24          1HG2      ILE  24  -3.330  -2.716  -6.546
  174   2HG2  ILE  24          2HG2      ILE  24  -4.155  -3.457  -5.156
  175   3HG2  ILE  24          3HG2      ILE  24  -4.932  -2.147  -6.042
  176   1HD1  ILE  24          1HD1      ILE  24  -0.455  -3.392  -3.979
  177   2HD1  ILE  24          2HD1      ILE  24  -2.111  -3.712  -3.406
  178   3HD1  ILE  24          3HD1      ILE  24  -1.713  -3.844  -5.137
  179    H    GLU  25           H        GLU  25  -0.980   0.474  -4.957
  180    HA   GLU  25           HA       GLU  25  -0.980   1.882  -2.575
  181   1HB   GLU  25          2HB       GLU  25   0.899   1.376  -4.731
  182   2HB   GLU  25          3HB       GLU  25   1.067   3.056  -4.205
  183   1HG   GLU  25          2HG       GLU  25   2.533   1.545  -2.908
  184   2HG   GLU  25          3HG       GLU  25   1.331   2.317  -1.867
  185    H    LYS  26           H        LYS  26  -1.707   3.144  -5.764
  186    HA   LYS  26           HA       LYS  26  -1.475   5.957  -4.951
  187   1HB   LYS  26          2HB       LYS  26  -2.210   4.489  -7.472
  188   2HB   LYS  26          3HB       LYS  26  -2.784   6.139  -7.261
  189   1HG   LYS  26          2HG       LYS  26  -0.655   6.036  -8.489
  190   2HG   LYS  26          3HG       LYS  26  -0.590   7.037  -7.032
  191   1HD   LYS  26          2HD       LYS  26   0.660   5.300  -5.841
  192   2HD   LYS  26          3HD       LYS  26   0.536   4.228  -7.246
  193   1HE   LYS  26          2HE       LYS  26   1.790   5.772  -8.652
  194   2HE   LYS  26          3HE       LYS  26   1.859   6.973  -7.354
  195   1HZ   LYS  26          1HZ       LYS  26   3.101   4.311  -7.258
  196   2HZ   LYS  26          2HZ       LYS  26   3.885   5.723  -7.553
  197   3HZ   LYS  26          3HZ       LYS  26   3.198   5.470  -6.080
  198    H    GLY  27           H        GLY  27  -4.183   3.653  -5.558
  199   1HA   GLY  27          2HA       GLY  27  -6.283   5.459  -4.794
  200   2HA   GLY  27          3HA       GLY  27  -6.336   3.689  -4.716
  201    H    LEU  28           H        LEU  28  -4.299   3.124  -2.997
  202    HA   LEU  28           HA       LEU  28  -5.369   3.348  -0.381
  203   1HB   LEU  28          2HB       LEU  28  -4.040   1.585  -1.207
  204   2HB   LEU  28          3HB       LEU  28  -2.656   2.653  -1.428
  205    HG   LEU  28           HG       LEU  28  -3.892   2.004   1.283
  206   1HD1  LEU  28          1HD1      LEU  28  -1.820   0.480   1.366
  207   2HD1  LEU  28          2HD1      LEU  28  -3.196  -0.041   0.369
  208   3HD1  LEU  28          3HD1      LEU  28  -1.763   0.667  -0.392
  209   1HD2  LEU  28          1HD2      LEU  28  -2.556   3.982   1.467
  210   2HD2  LEU  28          2HD2      LEU  28  -1.408   2.697   1.853
  211   3HD2  LEU  28          3HD2      LEU  28  -1.377   3.429   0.253
  212    H    LYS  29           H        LYS  29  -2.750   5.293  -1.981
  213    HA   LYS  29           HA       LYS  29  -2.292   6.986   0.194
  214   1HB   LYS  29          2HB       LYS  29  -1.035   6.878  -2.008
  215   2HB   LYS  29          3HB       LYS  29  -2.304   7.921  -2.670
  216   1HG   LYS  29          2HG       LYS  29  -1.676   9.381  -0.436
  217   2HG   LYS  29          3HG       LYS  29  -0.170   8.511  -0.617
  218   1HD   LYS  29          2HD       LYS  29  -1.600  10.120  -2.786
  219   2HD   LYS  29          3HD       LYS  29  -0.326  10.786  -1.762
  220   1HE   LYS  29          2HE       LYS  29   1.369   9.621  -2.767
  221   2HE   LYS  29          3HE       LYS  29   0.378   8.238  -3.217
  222   1HZ   LYS  29          1HZ       LYS  29   1.093   9.564  -5.069
  223   2HZ   LYS  29          2HZ       LYS  29  -0.558   9.549  -4.959
  224   3HZ   LYS  29          3HZ       LYS  29   0.304  10.884  -4.492
  225    H    ARG  30           H        ARG  30  -5.082   7.005  -2.004
  226    HA   ARG  30           HA       ARG  30  -5.868   9.712  -1.309
  227   1HB   ARG  30          2HB       ARG  30  -6.822   7.590  -3.105
  228   2HB   ARG  30          3HB       ARG  30  -8.157   8.327  -2.247
  229   1HG   ARG  30          2HG       ARG  30  -6.031   9.750  -3.900
  230   2HG   ARG  30          3HG       ARG  30  -7.679   9.356  -4.406
  231   1HD   ARG  30          2HD       ARG  30  -8.304  11.413  -3.664
  232   2HD   ARG  30          3HD       ARG  30  -8.184  10.725  -2.059
  233    HE   ARG  30           HE       ARG  30  -6.353  12.010  -1.622
  234   1HH1  ARG  30          2HH2      ARG  30  -6.736  11.772  -5.098
  235   2HH1  ARG  30          1HH2      ARG  30  -5.590  13.013  -5.508
  236   1HH2  ARG  30          2HH1      ARG  30  -4.758  13.639  -2.088
  237   2HH2  ARG  30          1HH1      ARG  30  -4.416  14.089  -3.725
  238    H    MET  31           H        MET  31  -5.818   6.935   0.618
  239    HA   MET  31           HA       MET  31  -8.460   7.244   1.759
  240   1HB   MET  31          2HB       MET  31  -6.055   5.608   2.670
  241   2HB   MET  31          3HB       MET  31  -7.712   5.390   3.238
  242   1HG   MET  31          2HG       MET  31  -6.834   5.093   0.330
  243   2HG   MET  31          3HG       MET  31  -7.047   3.774   1.449
  244   1HE   MET  31          1HE       MET  31  -9.793   3.687  -1.405
  245   2HE   MET  31          2HE       MET  31  -8.430   4.786  -1.618
  246   3HE   MET  31          3HE       MET  31  -8.142   3.176  -0.913
  247    HA   PRO  32           HA       PRO  32  -7.509  10.257   4.864
  248   1HB   PRO  32          2HB       PRO  32  -8.923   9.351   7.057
  249   2HB   PRO  32          3HB       PRO  32  -9.672  10.150   5.647
  250   1HG   PRO  32          2HG       PRO  32  -9.412   7.179   6.156
  251   2HG   PRO  32          3HG       PRO  32 -10.880   8.078   5.666
  252   1HD   PRO  32          2HD       PRO  32  -9.389   6.777   3.847
  253   2HD   PRO  32          3HD       PRO  32 -10.026   8.397   3.449
  254    H    GLY  33           H        GLY  33  -5.886  10.493   6.393
  255   1HA   GLY  33          2HA       GLY  33  -4.307   9.871   7.934
  256   2HA   GLY  33          3HA       GLY  33  -4.795   8.169   7.768
  257    H    VAL  34           H        VAL  34  -4.273   8.938   4.585
  258    HA   VAL  34           HA       VAL  34  -1.396   8.216   4.834
  259    HB   VAL  34           HB       VAL  34  -3.259   7.617   2.519
  260   1HG1  VAL  34          1HG1      VAL  34  -0.384   6.878   3.254
  261   2HG1  VAL  34          2HG1      VAL  34  -1.297   6.068   1.977
  262   3HG1  VAL  34          3HG1      VAL  34  -0.927   7.802   1.854
  263   1HG2  VAL  34          1HG2      VAL  34  -4.000   6.301   4.439
  264   2HG2  VAL  34          2HG2      VAL  34  -3.100   5.255   3.343
  265   3HG2  VAL  34          3HG2      VAL  34  -2.325   5.853   4.825
  266    H    THR  35           H        THR  35   0.082   9.484   3.896
  267    HA   THR  35           HA       THR  35  -0.886  12.008   2.643
  268    HB   THR  35           HB       THR  35   1.401  11.332   4.391
  269    HG1  THR  35           1HG      THR  35  -0.091  12.114   5.705
  270   1HG2  THR  35          1HG2      THR  35   2.504  12.637   2.789
  271   2HG2  THR  35          2HG2      THR  35   1.098  13.709   2.543
  272   3HG2  THR  35          3HG2      THR  35   2.038  13.793   4.046
  273    H    ASP  36           H        ASP  36   1.731   9.449   2.334
  274    HA   ASP  36           HA       ASP  36   1.622   9.911  -0.517
  275   1HB   ASP  36          2HB       ASP  36   3.642  11.233   0.765
  276   2HB   ASP  36          3HB       ASP  36   4.434   9.692   0.398
  277    H    ALA  37           H        ALA  37   3.023   8.270  -1.645
  278    HA   ALA  37           HA       ALA  37   3.422   5.777  -0.298
  279   1HB   ALA  37          1HB       ALA  37   0.887   5.798  -0.339
  280   2HB   ALA  37          2HB       ALA  37   0.984   5.713  -2.114
  281   3HB   ALA  37          3HB       ALA  37   1.640   4.399  -1.117
  282    H    ASN  38           H        ASN  38   4.438   4.126  -1.511
  283    HA   ASN  38           HA       ASN  38   5.293   4.850  -4.248
  284   1HB   ASN  38          2HB       ASN  38   7.701   4.386  -2.823
  285   2HB   ASN  38          3HB       ASN  38   7.159   5.842  -3.631
  286   1HD2  ASN  38          1HD2      ASN  38   6.192   4.287  -0.486
  287   2HD2  ASN  38          2HD2      ASN  38   6.587   5.723   0.455
  288    H    VAL  39           H        VAL  39   4.789   2.952  -5.165
  289    HA   VAL  39           HA       VAL  39   5.192   0.419  -3.785
  290    HB   VAL  39           HB       VAL  39   3.231   0.711  -5.048
  291   1HG1  VAL  39          1HG1      VAL  39   4.980   1.731  -7.279
  292   2HG1  VAL  39          2HG1      VAL  39   3.567   0.774  -7.691
  293   3HG1  VAL  39          3HG1      VAL  39   3.391   2.247  -6.713
  294   1HG2  VAL  39          1HG2      VAL  39   4.241  -1.505  -4.994
  295   2HG2  VAL  39          2HG2      VAL  39   3.268  -1.236  -6.447
  296   3HG2  VAL  39          3HG2      VAL  39   5.031  -1.169  -6.561
  297    H    ASN  40           H        ASN  40   7.358  -0.175  -3.524
  298    HA   ASN  40           HA       ASN  40   9.324   0.359  -5.652
  299   1HB   ASN  40          2HB       ASN  40   9.901   0.711  -3.292
  300   2HB   ASN  40          3HB       ASN  40   9.585  -0.996  -2.948
  301   1HD2  ASN  40          1HD2      ASN  40  11.900  -0.896  -2.153
  302   2HD2  ASN  40          2HD2      ASN  40  13.164  -1.127  -3.349
  303    H    LEU  41           H        LEU  41   7.568  -1.059  -6.860
  304    HA   LEU  41           HA       LEU  41   7.996  -3.961  -6.753
  305   1HB   LEU  41          2HB       LEU  41   6.292  -2.022  -8.194
  306   2HB   LEU  41          3HB       LEU  41   6.840  -3.309  -9.229
  307    HG   LEU  41           HG       LEU  41   4.631  -3.629  -8.044
  308   1HD1  LEU  41          1HD1      LEU  41   6.747  -5.813  -7.902
  309   2HD1  LEU  41          2HD1      LEU  41   4.990  -6.061  -7.825
  310   3HD1  LEU  41          3HD1      LEU  41   5.728  -5.408  -9.300
  311   1HD2  LEU  41          1HD2      LEU  41   5.708  -3.122  -5.673
  312   2HD2  LEU  41          2HD2      LEU  41   4.468  -4.375  -5.874
  313   3HD2  LEU  41          3HD2      LEU  41   6.172  -4.823  -5.732
  314    H    ALA  42           H        ALA  42   9.688  -1.334  -8.084
  315    HA   ALA  42           HA       ALA  42  11.112  -2.336 -10.240
  316   1HB   ALA  42          1HB       ALA  42  12.290  -0.973  -7.784
  317   2HB   ALA  42          2HB       ALA  42  13.030  -1.072  -9.391
  318   3HB   ALA  42          3HB       ALA  42  11.537  -0.129  -9.165
  319    H    THR  43           H        THR  43  11.371  -3.285  -6.810
  320    HA   THR  43           HA       THR  43  12.886  -5.673  -7.728
  321    HB   THR  43           HB       THR  43  14.193  -4.541  -6.145
  322    HG1  THR  43           1HG      THR  43  14.084  -6.834  -6.124
  323   1HG2  THR  43          1HG2      THR  43  12.159  -4.922  -3.929
  324   2HG2  THR  43          2HG2      THR  43  13.697  -4.075  -3.904
  325   3HG2  THR  43          3HG2      THR  43  12.346  -3.379  -4.810
  326    H    GLU  44           H        GLU  44  10.585  -5.045  -5.040
  327    HA   GLU  44           HA       GLU  44   8.397  -6.430  -6.072
  328   1HB   GLU  44          2HB       GLU  44  10.385  -8.345  -5.635
  329   2HB   GLU  44          3HB       GLU  44   9.535  -8.387  -4.119
  330   1HG   GLU  44          2HG       GLU  44   7.374  -8.582  -5.496
  331   2HG   GLU  44          3HG       GLU  44   8.407  -8.751  -6.934
  332    H    THR  45           H        THR  45   9.023  -4.140  -4.242
  333    HA   THR  45           HA       THR  45   7.864  -5.048  -1.650
  334    HB   THR  45           HB       THR  45  10.224  -3.227  -2.308
  335    HG1  THR  45           1HG      THR  45  10.052  -5.857  -1.257
  336   1HG2  THR  45          1HG2      THR  45   9.237  -2.434  -0.252
  337   2HG2  THR  45          2HG2      THR  45   9.109  -4.101   0.379
  338   3HG2  THR  45          3HG2      THR  45  10.700  -3.351   0.127
  339    H    VAL  46           H        VAL  46   7.004  -3.121  -0.396
  340    HA   VAL  46           HA       VAL  46   6.110  -0.849  -2.116
  341    HB   VAL  46           HB       VAL  46   4.232  -2.248  -2.256
  342   1HG1  VAL  46          1HG1      VAL  46   3.260  -3.425  -0.246
  343   2HG1  VAL  46          2HG1      VAL  46   4.826  -4.059  -0.752
  344   3HG1  VAL  46          3HG1      VAL  46   4.743  -2.966   0.631
  345   1HG2  VAL  46          1HG2      VAL  46   2.535  -1.302  -0.809
  346   2HG2  VAL  46          2HG2      VAL  46   3.726  -0.620   0.286
  347   3HG2  VAL  46          3HG2      VAL  46   3.619  -0.005  -1.382
  348    H    ASN  47           H        ASN  47   5.882   1.145  -0.994
  349    HA   ASN  47           HA       ASN  47   6.347   1.066   1.916
  350   1HB   ASN  47          2HB       ASN  47   7.745   2.771  -0.198
  351   2HB   ASN  47          3HB       ASN  47   7.589   3.314   1.477
  352   1HD2  ASN  47          1HD2      ASN  47   8.368   1.688   3.193
  353   2HD2  ASN  47          2HD2      ASN  47   9.973   1.073   2.832
  354    H    VAL  48           H        VAL  48   5.080   2.663   3.033
  355    HA   VAL  48           HA       VAL  48   3.300   4.341   1.374
  356    HB   VAL  48           HB       VAL  48   2.330   2.617   3.678
  357   1HG1  VAL  48          1HG1      VAL  48   1.239   4.905   3.286
  358   2HG1  VAL  48          2HG1      VAL  48   0.769   4.321   1.684
  359   3HG1  VAL  48          3HG1      VAL  48   0.158   3.522   3.148
  360   1HG2  VAL  48          1HG2      VAL  48   2.677   1.141   1.762
  361   2HG2  VAL  48          2HG2      VAL  48   0.950   1.444   1.961
  362   3HG2  VAL  48          3HG2      VAL  48   1.849   2.286   0.685
  363    H    ILE  49           H        ILE  49   3.307   6.364   2.213
  364    HA   ILE  49           HA       ILE  49   4.804   6.789   4.710
  365    HB   ILE  49           HB       ILE  49   4.197   8.830   2.541
  366   1HG1  ILE  49          2HG1      ILE  49   5.438   7.160   1.386
  367   2HG1  ILE  49          3HG1      ILE  49   6.463   8.553   1.687
  368   1HG2  ILE  49          1HG2      ILE  49   6.116  10.028   3.560
  369   2HG2  ILE  49          2HG2      ILE  49   4.762   9.807   4.677
  370   3HG2  ILE  49          3HG2      ILE  49   6.200   8.785   4.826
  371   1HD1  ILE  49          1HD1      ILE  49   7.729   6.504   2.052
  372   2HD1  ILE  49          2HD1      ILE  49   7.547   7.365   3.583
  373   3HD1  ILE  49          3HD1      ILE  49   6.552   5.930   3.243
  374    H    TYR  50           H        TYR  50   3.169   6.758   6.295
  375    HA   TYR  50           HA       TYR  50   0.670   8.325   5.756
  376   1HB   TYR  50          2HB       TYR  50  -0.719   6.617   6.585
  377   2HB   TYR  50          3HB       TYR  50   0.165   6.029   5.219
  378    HD1  TYR  50           HD1      TYR  50   0.908   3.814   5.362
  379    HD2  TYR  50           HD2      TYR  50   0.255   6.021   8.998
  380    HE1  TYR  50           HE1      TYR  50   0.862   1.715   6.654
  381    HE2  TYR  50           HE2      TYR  50   0.584   3.981  10.304
  382    HH   TYR  50           HH       TYR  50   1.110   1.661  10.147
  383    H    ASP  51           H        ASP  51  -0.592   8.641   7.641
  384    HA   ASP  51           HA       ASP  51   1.145   9.542   9.825
  385   1HB   ASP  51          2HB       ASP  51  -1.736  10.205   9.195
  386   2HB   ASP  51          3HB       ASP  51  -0.679  10.922  10.432
  387    HA   PRO  52           HA       PRO  52  -0.475   5.756  11.775
  388   1HB   PRO  52          2HB       PRO  52   1.262   5.430  13.838
  389   2HB   PRO  52          3HB       PRO  52   1.742   5.178  12.137
  390   1HG   PRO  52          2HG       PRO  52   2.051   7.728  13.757
  391   2HG   PRO  52          3HG       PRO  52   3.335   6.824  12.910
  392   1HD   PRO  52          2HD       PRO  52   2.114   8.893  11.737
  393   2HD   PRO  52          3HD       PRO  52   2.436   7.429  10.762
  394    H    ALA  53           H        ALA  53  -1.150   8.812  12.681
  395    HA   ALA  53           HA       ALA  53  -2.265   8.206  15.356
  396   1HB   ALA  53          1HB       ALA  53  -2.973  10.560  15.260
  397   2HB   ALA  53          2HB       ALA  53  -1.219  10.417  15.024
  398   3HB   ALA  53          3HB       ALA  53  -2.284  10.721  13.632
  399    H    GLU  54           H        GLU  54  -2.925   8.283  11.896
  400    HA   GLU  54           HA       GLU  54  -5.843   8.078  12.404
  401   1HB   GLU  54          2HB       GLU  54  -4.282   9.732  10.541
  402   2HB   GLU  54          3HB       GLU  54  -5.401   8.640   9.706
  403   1HG   GLU  54          2HG       GLU  54  -7.301   9.425  10.955
  404   2HG   GLU  54          3HG       GLU  54  -6.262  10.553  11.851
  405    H    THR  55           H        THR  55  -3.193   6.976  10.210
  406    HA   THR  55           HA       THR  55  -4.574   4.355  10.037
  407    HB   THR  55           HB       THR  55  -2.920   3.810   8.143
  408    HG1  THR  55           1HG      THR  55  -2.975   6.605   8.083
  409   1HG2  THR  55          1HG2      THR  55  -4.481   4.772   6.584
  410   2HG2  THR  55          2HG2      THR  55  -5.239   3.957   7.980
  411   3HG2  THR  55          3HG2      THR  55  -5.228   5.739   7.887
  412    H    GLY  56           H        GLY  56  -2.021   2.883   9.584
  413   1HA   GLY  56          2HA       GLY  56  -0.593   2.017  11.518
  414   2HA   GLY  56          3HA       GLY  56  -2.016   2.384  12.503
  415    H    THR  57           H        THR  57  -0.957   0.765   9.813
  416    HA   THR  57           HA       THR  57  -1.625  -0.138   8.048
  417    HB   THR  57           HB       THR  57  -1.397  -2.646   8.322
  418    HG1  THR  57           1HG      THR  57  -0.976  -3.366  10.438
  419   1HG2  THR  57          1HG2      THR  57   0.669  -1.052   9.895
  420   2HG2  THR  57          2HG2      THR  57   0.898  -2.622   9.109
  421   3HG2  THR  57          3HG2      THR  57   0.618  -1.178   8.120
  422    H    ALA  58           H        ALA  58  -3.937  -0.816  10.543
  423    HA   ALA  58           HA       ALA  58  -6.022  -2.135   9.666
  424   1HB   ALA  58          1HB       ALA  58  -5.915   0.775  10.542
  425   2HB   ALA  58          2HB       ALA  58  -7.388  -0.232  10.618
  426   3HB   ALA  58          3HB       ALA  58  -5.961  -0.631  11.609
  427    H    ALA  59           H        ALA  59  -5.358   1.122   8.275
  428    HA   ALA  59           HA       ALA  59  -7.909   0.767   6.761
  429   1HB   ALA  59          1HB       ALA  59  -7.689   2.905   5.838
  430   2HB   ALA  59          2HB       ALA  59  -7.205   3.056   7.533
  431   3HB   ALA  59          3HB       ALA  59  -5.975   3.003   6.215
  432    H    ILE  60           H        ILE  60  -4.469   0.798   6.195
  433    HA   ILE  60           HA       ILE  60  -4.427   0.466   3.398
  434    HB   ILE  60           HB       ILE  60  -2.532  -0.049   5.735
  435   1HG1  ILE  60          2HG1      ILE  60  -1.126   1.355   3.996
  436   2HG1  ILE  60          3HG1      ILE  60  -2.700   1.634   3.256
  437   1HG2  ILE  60          1HG2      ILE  60  -0.757  -0.836   4.272
  438   2HG2  ILE  60          2HG2      ILE  60  -2.041  -2.021   4.443
  439   3HG2  ILE  60          3HG2      ILE  60  -1.929  -1.073   2.950
  440   1HD1  ILE  60          1HD1      ILE  60  -3.462   2.676   5.413
  441   2HD1  ILE  60          2HD1      ILE  60  -1.911   2.231   6.170
  442   3HD1  ILE  60          3HD1      ILE  60  -1.954   3.431   4.871
  443    H    GLN  61           H        GLN  61  -4.534  -2.026   6.007
  444    HA   GLN  61           HA       GLN  61  -4.384  -4.197   4.129
  445   1HB   GLN  61          2HB       GLN  61  -4.719  -3.938   7.020
  446   2HB   GLN  61          3HB       GLN  61  -5.855  -5.098   6.330
  447   1HG   GLN  61          2HG       GLN  61  -4.071  -6.431   6.862
  448   2HG   GLN  61          3HG       GLN  61  -3.918  -6.212   5.121
  449   1HE2  GLN  61          1HE2      GLN  61  -2.889  -3.268   6.048
  450   2HE2  GLN  61          2HE2      GLN  61  -1.204  -3.629   6.373
  451    H    GLU  62           H        GLU  62  -7.136  -2.586   5.802
  452    HA   GLU  62           HA       GLU  62  -9.260  -4.005   4.728
  453   1HB   GLU  62          2HB       GLU  62  -8.835  -1.312   5.901
  454   2HB   GLU  62          3HB       GLU  62 -10.087  -1.277   4.666
  455   1HG   GLU  62          2HG       GLU  62 -10.063  -3.206   7.006
  456   2HG   GLU  62          3HG       GLU  62 -11.023  -1.720   6.897
  457    H    LYS  63           H        LYS  63  -7.732  -1.074   3.257
  458    HA   LYS  63           HA       LYS  63  -9.349  -1.291   0.944
  459   1HB   LYS  63          2HB       LYS  63  -6.921   0.292   1.801
  460   2HB   LYS  63          3HB       LYS  63  -7.573   0.422   0.197
  461   1HG   LYS  63          2HG       LYS  63  -9.236   0.843   2.737
  462   2HG   LYS  63          3HG       LYS  63  -8.354   2.106   1.899
  463   1HD   LYS  63          2HD       LYS  63 -10.559   2.377   1.259
  464   2HD   LYS  63          3HD       LYS  63  -9.706   1.725  -0.154
  465   1HE   LYS  63          2HE       LYS  63 -10.857  -0.279  -0.110
  466   2HE   LYS  63          3HE       LYS  63 -11.319  -0.122   1.613
  467   1HZ   LYS  63          1HZ       LYS  63 -13.137   0.244   0.104
  468   2HZ   LYS  63          2HZ       LYS  63 -12.816   1.630   0.924
  469   3HZ   LYS  63          3HZ       LYS  63 -12.348   1.470  -0.649
  470    H    ILE  64           H        ILE  64  -6.078  -2.406   1.696
  471    HA   ILE  64           HA       ILE  64  -5.081  -3.121  -0.732
  472    HB   ILE  64           HB       ILE  64  -4.783  -3.921   2.035
  473   1HG1  ILE  64          2HG1      ILE  64  -3.351  -2.354   0.707
  474   2HG1  ILE  64          3HG1      ILE  64  -2.529  -3.587   1.662
  475   1HG2  ILE  64          1HG2      ILE  64  -4.219  -6.034   0.022
  476   2HG2  ILE  64          2HG2      ILE  64  -3.408  -5.923   1.607
  477   3HG2  ILE  64          3HG2      ILE  64  -5.149  -6.136   1.541
  478   1HD1  ILE  64          1HD1      ILE  64  -2.226  -4.992  -0.314
  479   2HD1  ILE  64          2HD1      ILE  64  -3.066  -3.798  -1.320
  480   3HD1  ILE  64          3HD1      ILE  64  -1.513  -3.382  -0.555
  481    H    GLU  65           H        GLU  65  -7.190  -5.020   1.511
  482    HA   GLU  65           HA       GLU  65  -7.821  -7.229  -0.135
  483   1HB   GLU  65          2HB       GLU  65  -9.233  -5.879   2.193
  484   2HB   GLU  65          3HB       GLU  65  -9.914  -7.293   1.393
  485   1HG   GLU  65          2HG       GLU  65  -7.053  -7.407   2.331
  486   2HG   GLU  65          3HG       GLU  65  -8.360  -7.548   3.512
  487    H    LYS  66           H        LYS  66  -9.845  -4.296   0.480
  488    HA   LYS  66           HA       LYS  66 -11.865  -5.064  -1.366
  489   1HB   LYS  66          2HB       LYS  66 -11.100  -2.490  -0.022
  490   2HB   LYS  66          3HB       LYS  66 -12.229  -2.423  -1.381
  491   1HG   LYS  66          2HG       LYS  66 -13.584  -2.556   0.530
  492   2HG   LYS  66          3HG       LYS  66 -13.661  -4.142  -0.239
  493   1HD   LYS  66          2HD       LYS  66 -11.953  -4.963   1.445
  494   2HD   LYS  66          3HD       LYS  66 -11.993  -3.355   2.201
  495   1HE   LYS  66          2HE       LYS  66 -14.423  -3.609   2.635
  496   2HE   LYS  66          3HE       LYS  66 -14.382  -5.236   1.917
  497   1HZ   LYS  66          1HZ       LYS  66 -12.773  -5.811   3.709
  498   2HZ   LYS  66          2HZ       LYS  66 -12.922  -4.322   4.320
  499   3HZ   LYS  66          3HZ       LYS  66 -14.214  -5.309   4.325
  500    H    LEU  67           H        LEU  67  -8.838  -3.389  -2.001
  501    HA   LEU  67           HA       LEU  67  -9.470  -2.575  -4.701
  502   1HB   LEU  67          2HB       LEU  67  -6.894  -2.848  -3.137
  503   2HB   LEU  67          3HB       LEU  67  -6.934  -2.316  -4.818
  504    HG   LEU  67           HG       LEU  67  -8.673  -0.911  -2.765
  505   1HD1  LEU  67          1HD1      LEU  67  -5.794  -0.190  -3.404
  506   2HD1  LEU  67          2HD1      LEU  67  -6.908   0.713  -2.364
  507   3HD1  LEU  67          3HD1      LEU  67  -6.336  -0.894  -1.881
  508   1HD2  LEU  67          1HD2      LEU  67  -8.401   0.987  -4.319
  509   2HD2  LEU  67          2HD2      LEU  67  -7.339   0.013  -5.353
  510   3HD2  LEU  67          3HD2      LEU  67  -9.053  -0.414  -5.180
  511    H    GLY  68           H        GLY  68  -8.733  -5.624  -3.252
  512   1HA   GLY  68          2HA       GLY  68  -8.974  -7.651  -4.320
  513   2HA   GLY  68          3HA       GLY  68  -8.705  -6.909  -5.903
  514    H    TYR  69           H        TYR  69  -6.729  -6.686  -2.878
  515    HA   TYR  69           HA       TYR  69  -4.491  -8.148  -4.190
  516   1HB   TYR  69          2HB       TYR  69  -4.739  -5.259  -3.671
  517   2HB   TYR  69          3HB       TYR  69  -3.387  -5.947  -2.802
  518    HD1  TYR  69           HD1      TYR  69  -4.924  -5.692  -6.196
  519    HD2  TYR  69           HD2      TYR  69  -1.391  -6.639  -3.913
  520    HE1  TYR  69           HE1      TYR  69  -3.605  -5.693  -8.252
  521    HE2  TYR  69           HE2      TYR  69  -0.044  -6.548  -5.968
  522    HH   TYR  69           HH       TYR  69  -1.529  -6.323  -9.165
  523    H    HIS  70           H        HIS  70  -2.674  -8.434  -2.543
  524    HA   HIS  70           HA       HIS  70  -3.394  -8.078   0.205
  525   1HB   HIS  70          2HB       HIS  70  -4.274 -10.458  -0.672
  526   2HB   HIS  70          3HB       HIS  70  -2.589 -10.913  -0.409
  527    HD1  HIS  70           1HD      HIS  70  -4.707  -8.569   1.862
  528    HD2  HIS  70           2HD      HIS  70  -3.251 -12.500   1.674
  529    HE1  HIS  70           1HE      HIS  70  -5.117  -9.597   4.147
  530    H    VAL  71           H        VAL  71  -1.544  -7.926   1.508
  531    HA   VAL  71           HA       VAL  71   1.060  -7.931   0.101
  532    HB   VAL  71           HB       VAL  71   1.679  -6.605   2.213
  533   1HG1  VAL  71          1HG1      VAL  71   0.860  -4.450   1.200
  534   2HG1  VAL  71          2HG1      VAL  71   1.635  -5.542   0.040
  535   3HG1  VAL  71          3HG1      VAL  71  -0.123  -5.420   0.085
  536   1HG2  VAL  71          1HG2      VAL  71   0.016  -5.353   3.376
  537   2HG2  VAL  71          2HG2      VAL  71  -1.284  -6.015   2.384
  538   3HG2  VAL  71          3HG2      VAL  71  -0.397  -7.069   3.510
  539    H    VAL  72           H        VAL  72   2.859  -8.575   1.579
  540    HA   VAL  72           HA       VAL  72   2.102 -10.819   3.388
  541    HB   VAL  72           HB       VAL  72   4.455 -10.830   1.564
  542   1HG1  VAL  72          1HG1      VAL  72   4.534 -13.242   2.190
  543   2HG1  VAL  72          2HG1      VAL  72   4.713 -12.207   3.609
  544   3HG1  VAL  72          3HG1      VAL  72   3.157 -12.996   3.281
  545   1HG2  VAL  72          1HG2      VAL  72   3.196 -12.609   0.297
  546   2HG2  VAL  72          2HG2      VAL  72   1.750 -12.200   1.242
  547   3HG2  VAL  72          3HG2      VAL  72   2.473 -11.006   0.142
  548    H    ILE  73           H        ILE  73   3.324 -10.988   5.212
  549    HA   ILE  73           HA       ILE  73   5.194  -8.758   5.893
  550    HB   ILE  73           HB       ILE  73   3.116  -9.964   7.714
  551   1HG1  ILE  73          2HG1      ILE  73   2.039  -8.559   5.968
  552   2HG1  ILE  73          3HG1      ILE  73   1.945  -7.943   7.605
  553   1HG2  ILE  73          1HG2      ILE  73   5.089  -9.208   8.932
  554   2HG2  ILE  73          2HG2      ILE  73   5.124  -7.682   8.048
  555   3HG2  ILE  73          3HG2      ILE  73   3.796  -8.038   9.179
  556   1HD1  ILE  73          1HD1      ILE  73   2.383  -6.189   5.867
  557   2HD1  ILE  73          2HD1      ILE  73   3.540  -6.207   7.207
  558   3HD1  ILE  73          3HD1      ILE  73   3.988  -6.909   5.642
  559    H    GLU  74           H        GLU  74   6.810 -10.505   5.129
  560    HA   GLU  74           HA       GLU  74   7.174 -12.698   6.826
  561   1HB   GLU  74          2HB       GLU  74   8.861 -11.413   4.666
  562   2HB   GLU  74          3HB       GLU  74   9.339 -12.826   5.583
  563   1HG   GLU  74          2HG       GLU  74   7.049 -13.859   4.848
  564   2HG   GLU  74          3HG       GLU  74   7.046 -12.578   3.619
  565    H    GLY  75           H        GLY  75   7.565  -9.634   7.524
  566   1HA   GLY  75          2HA       GLY  75  10.258  -9.613   8.710
  567   2HA   GLY  75          3HA       GLY  75   9.145  -8.251   8.567
  568    H    ARG  76           H        ARG  76   6.862  -9.366   9.916
  569    HA   ARG  76           HA       ARG  76   7.820  -9.403  12.697
  570   1HB   ARG  76          2HB       ARG  76   7.089  -7.105  11.574
  571   2HB   ARG  76          3HB       ARG  76   5.457  -7.712  11.812
  572   1HG   ARG  76          2HG       ARG  76   7.558  -7.346  14.016
  573   2HG   ARG  76          3HG       ARG  76   6.389  -6.120  13.528
  574   1HD   ARG  76          2HD       ARG  76   5.483  -7.132  15.499
  575   2HD   ARG  76          3HD       ARG  76   4.514  -7.639  14.120
  576    HE   ARG  76           HE       ARG  76   5.346  -9.813  14.213
  577   1HH1  ARG  76          2HH2      ARG  76   6.945  -7.971  16.762
  578   2HH1  ARG  76          1HH2      ARG  76   7.927  -9.316  17.269
  579   1HH2  ARG  76          2HH1      ARG  76   6.657 -11.347  14.622
  580   2HH2  ARG  76          1HH1      ARG  76   7.694 -11.435  16.048
  Start of MODEL   10
    1   1H    MET   1          H1        MET   1   3.084  16.859  13.033
    2   2H    MET   1          H2        MET   1   4.453  17.756  13.320
    3   3H    MET   1          H3        MET   1   3.702  16.896  14.526
    4    HA   MET   1           HA       MET   1   3.223  19.148  14.900
    5   1HB   MET   1          2HB       MET   1   2.121  19.045  12.065
    6   2HB   MET   1          3HB       MET   1   1.715  20.319  13.229
    7   1HG   MET   1          2HG       MET   1   3.589  21.430  12.908
    8   2HG   MET   1          3HG       MET   1   4.604  20.008  13.114
    9   1HE   MET   1          1HE       MET   1   5.398  22.435  11.268
   10   2HE   MET   1          2HE       MET   1   6.394  20.972  11.483
   11   3HE   MET   1          3HE       MET   1   6.017  21.562   9.847
   12    H    LEU   2           H        LEU   2   0.191  19.062  13.492
   13    HA   LEU   2           HA       LEU   2  -1.083  17.698  15.658
   14   1HB   LEU   2          2HB       LEU   2  -3.055  17.659  14.213
   15   2HB   LEU   2          3HB       LEU   2  -2.372  19.265  14.397
   16    HG   LEU   2           HG       LEU   2  -1.390  17.809  11.974
   17   1HD1  LEU   2          1HD1      LEU   2  -3.475  18.128  10.715
   18   2HD1  LEU   2          2HD1      LEU   2  -3.678  16.947  12.017
   19   3HD1  LEU   2          3HD1      LEU   2  -4.317  18.596  12.208
   20   1HD2  LEU   2          1HD2      LEU   2  -1.841  19.961  10.908
   21   2HD2  LEU   2          2HD2      LEU   2  -2.692  20.539  12.354
   22   3HD2  LEU   2          3HD2      LEU   2  -0.945  20.242  12.407
   23    H    SER   3           H        SER   3   0.341  16.623  12.624
   24    HA   SER   3           HA       SER   3  -0.259  13.801  13.246
   25   1HB   SER   3          2HB       SER   3  -0.052  15.207  10.531
   26   2HB   SER   3          3HB       SER   3  -0.389  13.495  10.765
   27    HG   SER   3           HG       SER   3  -2.308  14.087  11.836
   28    H    GLU   4           H        GLU   4   1.386  12.405  12.466
   29    HA   GLU   4           HA       GLU   4   4.114  13.466  11.986
   30   1HB   GLU   4          2HB       GLU   4   3.025  11.199  13.576
   31   2HB   GLU   4          3HB       GLU   4   4.481  10.888  12.676
   32   1HG   GLU   4          2HG       GLU   4   5.269  13.116  13.771
   33   2HG   GLU   4          3HG       GLU   4   3.978  12.772  14.910
   34    H    GLN   5           H        GLN   5   5.329  11.637  10.626
   35    HA   GLN   5           HA       GLN   5   3.543  10.099   8.858
   36   1HB   GLN   5          2HB       GLN   5   5.937  11.822   8.142
   37   2HB   GLN   5          3HB       GLN   5   5.255  10.683   7.007
   38   1HG   GLN   5          2HG       GLN   5   3.708  13.031   8.267
   39   2HG   GLN   5          3HG       GLN   5   4.582  13.091   6.773
   40   1HE2  GLN   5          1HE2      GLN   5   3.442   9.975   6.597
   41   2HE2  GLN   5          2HE2      GLN   5   1.909  10.304   5.838
   42    H    LYS   6           H        LYS   6   4.482   8.082   8.356
   43    HA   LYS   6           HA       LYS   6   7.354   7.779   8.626
   44   1HB   LYS   6          2HB       LYS   6   5.488   5.828  10.049
   45   2HB   LYS   6          3HB       LYS   6   7.212   5.563   9.720
   46   1HG   LYS   6          2HG       LYS   6   7.671   7.763  10.926
   47   2HG   LYS   6          3HG       LYS   6   5.991   7.710  11.491
   48   1HD   LYS   6          2HD       LYS   6   6.493   5.487  12.561
   49   2HD   LYS   6          3HD       LYS   6   8.178   5.653  12.007
   50   1HE   LYS   6          2HE       LYS   6   8.327   7.859  13.232
   51   2HE   LYS   6          3HE       LYS   6   6.683   7.627  13.835
   52   1HZ   LYS   6          1HZ       LYS   6   8.997   5.904  14.421
   53   2HZ   LYS   6          2HZ       LYS   6   8.304   7.002  15.434
   54   3HZ   LYS   6          3HZ       LYS   6   7.462   5.663  14.982
   55    H    GLU   7           H        GLU   7   8.154   5.987   7.482
   56    HA   GLU   7           HA       GLU   7   6.623   5.445   5.023
   57   1HB   GLU   7          2HB       GLU   7   9.634   5.309   5.286
   58   2HB   GLU   7          3HB       GLU   7   8.588   5.640   3.910
   59   1HG   GLU   7          2HG       GLU   7   9.618   7.690   4.392
   60   2HG   GLU   7          3HG       GLU   7   8.065   7.891   5.216
   61    H    ILE   8           H        ILE   8   5.678   3.478   5.725
   62    HA   ILE   8           HA       ILE   8   7.375   1.471   7.027
   63    HB   ILE   8           HB       ILE   8   4.498   1.480   6.277
   64   1HG1  ILE   8          2HG1      ILE   8   4.151   1.586   8.821
   65   2HG1  ILE   8          3HG1      ILE   8   5.883   1.859   9.014
   66   1HG2  ILE   8          1HG2      ILE   8   5.269  -0.730   6.453
   67   2HG2  ILE   8          2HG2      ILE   8   6.164  -0.306   7.962
   68   3HG2  ILE   8          3HG2      ILE   8   4.372  -0.334   7.931
   69   1HD1  ILE   8          1HD1      ILE   8   5.714   4.010   8.214
   70   2HD1  ILE   8          2HD1      ILE   8   4.215   3.672   7.301
   71   3HD1  ILE   8          3HD1      ILE   8   4.175   3.818   9.079
   72    H    ALA   9           H        ALA   9   7.277  -0.729   6.017
   73    HA   ALA   9           HA       ALA   9   7.422  -0.701   3.054
   74   1HB   ALA   9          1HB       ALA   9   9.489  -2.020   3.154
   75   2HB   ALA   9          2HB       ALA   9   9.736  -0.446   3.941
   76   3HB   ALA   9          3HB       ALA   9   9.505  -1.902   4.927
   77    H    MET  10           H        MET  10   6.476  -2.578   2.193
   78    HA   MET  10           HA       MET  10   6.244  -4.963   3.935
   79   1HB   MET  10          2HB       MET  10   3.834  -4.003   2.359
   80   2HB   MET  10          3HB       MET  10   3.961  -5.343   3.486
   81   1HG   MET  10          2HG       MET  10   2.736  -3.781   4.593
   82   2HG   MET  10          3HG       MET  10   4.328  -3.635   5.336
   83   1HE   MET  10          1HE       MET  10   2.470  -0.117   5.478
   84   2HE   MET  10          2HE       MET  10   1.580  -1.642   5.285
   85   3HE   MET  10          3HE       MET  10   2.961  -1.558   6.401
   86    H    GLN  11           H        GLN  11   5.336  -6.799   2.585
   87    HA   GLN  11           HA       GLN  11   6.578  -6.975  -0.091
   88   1HB   GLN  11          2HB       GLN  11   6.235  -8.795   2.145
   89   2HB   GLN  11          3HB       GLN  11   5.300  -9.419   0.794
   90   1HG   GLN  11          2HG       GLN  11   8.217  -8.610   0.463
   91   2HG   GLN  11          3HG       GLN  11   7.720 -10.194   1.076
   92   1HE2  GLN  11          1HE2      GLN  11   7.716  -8.119  -1.806
   93   2HE2  GLN  11          2HE2      GLN  11   7.025  -9.271  -2.906
   94    H    VAL  12           H        VAL  12   5.190  -8.033  -1.774
   95    HA   VAL  12           HA       VAL  12   2.316  -7.223  -1.553
   96    HB   VAL  12           HB       VAL  12   4.212  -7.052  -3.938
   97   1HG1  VAL  12          1HG1      VAL  12   1.248  -6.389  -3.668
   98   2HG1  VAL  12          2HG1      VAL  12   2.267  -5.887  -5.031
   99   3HG1  VAL  12          3HG1      VAL  12   1.985  -7.603  -4.744
  100   1HG2  VAL  12          1HG2      VAL  12   3.750  -4.590  -3.742
  101   2HG2  VAL  12          2HG2      VAL  12   2.893  -4.903  -2.221
  102   3HG2  VAL  12          3HG2      VAL  12   4.638  -5.232  -2.357
  103    H    SER  13           H        SER  13   0.798  -8.706  -2.580
  104    HA   SER  13           HA       SER  13   1.915 -11.001  -4.028
  105   1HB   SER  13          2HB       SER  13   0.175 -11.283  -1.542
  106   2HB   SER  13          3HB       SER  13   0.582 -12.603  -2.650
  107    HG   SER  13           HG       SER  13   2.844 -11.347  -1.911
  108    H    GLY  14           H        GLY  14   0.230 -12.185  -5.143
  109   1HA   GLY  14          2HA       GLY  14  -1.661 -12.348  -6.446
  110   2HA   GLY  14          3HA       GLY  14  -2.472 -11.200  -5.369
  111    H    MET  15           H        MET  15   0.017 -11.369  -7.992
  112    HA   MET  15           HA       MET  15  -0.976  -8.865  -9.157
  113   1HB   MET  15          2HB       MET  15   1.237  -7.842  -9.152
  114   2HB   MET  15          3HB       MET  15   0.753  -8.223  -7.495
  115   1HG   MET  15          2HG       MET  15   2.962  -8.902  -7.508
  116   2HG   MET  15          3HG       MET  15   2.120 -10.416  -7.823
  117   1HE   MET  15          1HE       MET  15   5.084 -11.307  -9.981
  118   2HE   MET  15          2HE       MET  15   4.917 -10.811  -8.277
  119   3HE   MET  15          3HE       MET  15   3.723 -11.916  -9.013
  120    H    THR  16           H        THR  16  -0.263  -8.590 -11.345
  121    HA   THR  16           HA       THR  16   0.839 -11.003 -12.715
  122    HB   THR  16           HB       THR  16  -0.143  -9.654 -14.719
  123    HG1  THR  16           1HG      THR  16  -1.837  -8.237 -14.031
  124   1HG2  THR  16          1HG2      THR  16  -2.412 -10.570 -14.352
  125   2HG2  THR  16          2HG2      THR  16  -1.159 -11.739 -13.901
  126   3HG2  THR  16          3HG2      THR  16  -2.031 -10.847 -12.636
  127    H    CYS  17           H        CYS  17   0.693  -7.459 -13.150
  128    HA   CYS  17           HA       CYS  17   3.573  -7.459 -13.948
  129   1HB   CYS  17          2HB       CYS  17   2.984  -5.889 -15.670
  130   2HB   CYS  17          3HB       CYS  17   1.901  -7.281 -15.801
  131    H    ALA  18           H        ALA  18   4.665  -5.412 -13.797
  132    HA   ALA  18           HA       ALA  18   4.290  -4.134 -11.211
  133   1HB   ALA  18          1HB       ALA  18   6.366  -2.956 -11.809
  134   2HB   ALA  18          2HB       ALA  18   6.523  -4.698 -12.091
  135   3HB   ALA  18          3HB       ALA  18   6.272  -3.595 -13.461
  136    H    ALA  19           H        ALA  19   1.998  -3.636 -12.424
  137    HA   ALA  19           HA       ALA  19   2.071  -0.686 -12.847
  138   1HB   ALA  19          1HB       ALA  19   0.445  -0.794 -14.652
  139   2HB   ALA  19          2HB       ALA  19   1.903  -1.697 -15.117
  140   3HB   ALA  19          3HB       ALA  19   0.435  -2.564 -14.606
  141    H    CYS  20           H        CYS  20  -0.142  -3.540 -12.522
  142    HA   CYS  20           HA       CYS  20  -2.231  -2.095 -11.405
  143   1HB   CYS  20          2HB       CYS  20  -1.455  -4.994 -10.802
  144   2HB   CYS  20          3HB       CYS  20  -3.072  -4.277 -10.597
  145    H    ALA  21           H        ALA  21   0.496  -3.606  -9.694
  146    HA   ALA  21           HA       ALA  21  -0.353  -3.014  -7.080
  147   1HB   ALA  21          1HB       ALA  21   1.884  -3.444  -6.408
  148   2HB   ALA  21          2HB       ALA  21   1.517  -4.540  -7.742
  149   3HB   ALA  21          3HB       ALA  21   2.519  -3.100  -8.042
  150    H    ALA  22           H        ALA  22   0.663  -0.756  -9.546
  151    HA   ALA  22           HA       ALA  22   1.411   1.387  -7.698
  152   1HB   ALA  22          1HB       ALA  22   2.161   1.248 -10.120
  153   2HB   ALA  22          2HB       ALA  22   0.479   1.591 -10.588
  154   3HB   ALA  22          3HB       ALA  22   1.392   2.780  -9.651
  155    H    ARG  23           H        ARG  23  -1.444   0.288  -9.556
  156    HA   ARG  23           HA       ARG  23  -3.118   2.549  -9.107
  157   1HB   ARG  23          2HB       ARG  23  -3.818  -0.384  -9.563
  158   2HB   ARG  23          3HB       ARG  23  -4.996   0.924  -9.522
  159   1HG   ARG  23          2HG       ARG  23  -4.081   1.982 -11.454
  160   2HG   ARG  23          3HG       ARG  23  -2.642   0.956 -11.447
  161   1HD   ARG  23          2HD       ARG  23  -3.637  -0.719 -12.546
  162   2HD   ARG  23          3HD       ARG  23  -5.065  -0.718 -11.541
  163    HE   ARG  23           HE       ARG  23  -4.655   0.527 -14.138
  164   1HH1  ARG  23          2HH2      ARG  23  -6.541   0.750 -11.187
  165   2HH1  ARG  23          1HH2      ARG  23  -7.989   1.359 -11.934
  166   1HH2  ARG  23          2HH1      ARG  23  -6.540   1.365 -15.198
  167   2HH2  ARG  23          1HH1      ARG  23  -7.961   1.753 -14.286
  168    H    ILE  24           H        ILE  24  -2.778  -0.562  -7.333
  169    HA   ILE  24           HA       ILE  24  -4.715   0.072  -5.406
  170    HB   ILE  24           HB       ILE  24  -3.920  -1.636  -3.992
  171   1HG1  ILE  24          2HG1      ILE  24  -1.424  -1.419  -5.595
  172   2HG1  ILE  24          3HG1      ILE  24  -1.634  -1.227  -3.840
  173   1HG2  ILE  24          1HG2      ILE  24  -5.021  -2.127  -6.274
  174   2HG2  ILE  24          2HG2      ILE  24  -3.406  -2.617  -6.823
  175   3HG2  ILE  24          3HG2      ILE  24  -4.186  -3.449  -5.458
  176   1HD1  ILE  24          1HD1      ILE  24  -2.176  -3.669  -3.690
  177   2HD1  ILE  24          2HD1      ILE  24  -1.756  -3.805  -5.416
  178   3HD1  ILE  24          3HD1      ILE  24  -0.520  -3.330  -4.244
  179    H    GLU  25           H        GLU  25  -1.175   0.588  -5.134
  180    HA   GLU  25           HA       GLU  25  -1.182   1.959  -2.749
  181   1HB   GLU  25          2HB       GLU  25   0.659   1.422  -4.893
  182   2HB   GLU  25          3HB       GLU  25   0.794   3.146  -4.538
  183   1HG   GLU  25          2HG       GLU  25   2.349   1.593  -3.256
  184   2HG   GLU  25          3HG       GLU  25   1.393   2.688  -2.267
  185    H    LYS  26           H        LYS  26  -1.840   3.372  -5.952
  186    HA   LYS  26           HA       LYS  26  -1.815   6.058  -4.841
  187   1HB   LYS  26          2HB       LYS  26  -2.665   5.042  -7.532
  188   2HB   LYS  26          3HB       LYS  26  -3.053   6.673  -6.979
  189   1HG   LYS  26          2HG       LYS  26  -1.041   6.947  -8.122
  190   2HG   LYS  26          3HG       LYS  26  -0.593   7.042  -6.411
  191   1HD   LYS  26          2HD       LYS  26   0.199   4.670  -6.500
  192   2HD   LYS  26          3HD       LYS  26  -0.435   4.590  -8.137
  193   1HE   LYS  26          2HE       LYS  26   1.897   4.867  -8.427
  194   2HE   LYS  26          3HE       LYS  26   1.210   6.452  -8.775
  195   1HZ   LYS  26          1HZ       LYS  26   1.839   7.105  -6.502
  196   2HZ   LYS  26          2HZ       LYS  26   2.483   5.636  -6.213
  197   3HZ   LYS  26          3HZ       LYS  26   3.138   6.604  -7.366
  198    H    GLY  27           H        GLY  27  -4.443   3.737  -5.695
  199   1HA   GLY  27          2HA       GLY  27  -6.597   5.446  -4.818
  200   2HA   GLY  27          3HA       GLY  27  -6.659   3.687  -4.981
  201    H    LEU  28           H        LEU  28  -4.380   3.257  -3.184
  202    HA   LEU  28           HA       LEU  28  -5.669   2.971  -0.615
  203   1HB   LEU  28          2HB       LEU  28  -4.162   1.430  -1.417
  204   2HB   LEU  28          3HB       LEU  28  -2.863   2.616  -1.570
  205    HG   LEU  28           HG       LEU  28  -4.091   2.234   1.145
  206   1HD1  LEU  28          1HD1      LEU  28  -2.337   0.292  -0.407
  207   2HD1  LEU  28          2HD1      LEU  28  -2.396   0.282   1.351
  208   3HD1  LEU  28          3HD1      LEU  28  -3.891   0.002   0.421
  209   1HD2  LEU  28          1HD2      LEU  28  -2.244   3.934   0.544
  210   2HD2  LEU  28          2HD2      LEU  28  -1.842   2.820   1.836
  211   3HD2  LEU  28          3HD2      LEU  28  -1.195   2.549   0.206
  212    H    LYS  29           H        LYS  29  -3.148   5.224  -1.896
  213    HA   LYS  29           HA       LYS  29  -2.804   6.718   0.412
  214   1HB   LYS  29          2HB       LYS  29  -1.506   6.948  -1.728
  215   2HB   LYS  29          3HB       LYS  29  -2.861   7.872  -2.384
  216   1HG   LYS  29          2HG       LYS  29  -2.316   9.136   0.102
  217   2HG   LYS  29          3HG       LYS  29  -0.748   8.651  -0.447
  218   1HD   LYS  29          2HD       LYS  29  -2.733  10.112  -2.254
  219   2HD   LYS  29          3HD       LYS  29  -1.752  10.994  -1.089
  220   1HE   LYS  29          2HE       LYS  29   0.188  10.785  -2.224
  221   2HE   LYS  29          3HE       LYS  29  -0.153   9.132  -2.784
  222   1HZ   LYS  29          1HZ       LYS  29  -1.261  11.620  -3.884
  223   2HZ   LYS  29          2HZ       LYS  29  -0.016  10.742  -4.505
  224   3HZ   LYS  29          3HZ       LYS  29  -1.537  10.093  -4.464
  225    H    ARG  30           H        ARG  30  -5.658   6.710  -1.649
  226    HA   ARG  30           HA       ARG  30  -6.637   9.214  -0.586
  227   1HB   ARG  30          2HB       ARG  30  -7.415   7.433  -2.685
  228   2HB   ARG  30          3HB       ARG  30  -8.792   7.565  -1.595
  229   1HG   ARG  30          2HG       ARG  30  -8.392  10.117  -1.654
  230   2HG   ARG  30          3HG       ARG  30  -7.212   9.801  -2.944
  231   1HD   ARG  30          2HD       ARG  30  -9.040   8.811  -4.323
  232   2HD   ARG  30          3HD       ARG  30 -10.174   9.117  -2.979
  233    HE   ARG  30           HE       ARG  30  -8.726  11.495  -3.782
  234   1HH1  ARG  30          2HH2      ARG  30 -11.483   9.495  -4.681
  235   2HH1  ARG  30          1HH2      ARG  30 -12.422  10.796  -5.344
  236   1HH2  ARG  30          2HH1      ARG  30  -9.931  13.253  -4.659
  237   2HH2  ARG  30          1HH1      ARG  30 -11.493  12.986  -5.353
  238    H    MET  31           H        MET  31  -6.117   6.451   1.148
  239    HA   MET  31           HA       MET  31  -8.470   6.558   2.839
  240   1HB   MET  31          2HB       MET  31  -5.655   5.458   3.139
  241   2HB   MET  31          3HB       MET  31  -6.801   5.347   4.463
  242   1HG   MET  31          2HG       MET  31  -7.479   4.253   1.732
  243   2HG   MET  31          3HG       MET  31  -6.491   3.364   2.889
  244   1HE   MET  31          1HE       MET  31 -10.085   4.387   1.925
  245   2HE   MET  31          2HE       MET  31 -11.037   3.831   3.321
  246   3HE   MET  31          3HE       MET  31 -10.121   5.333   3.440
  247    HA   PRO  32           HA       PRO  32  -7.257  10.011   5.414
  248   1HB   PRO  32          2HB       PRO  32  -8.081   9.222   7.915
  249   2HB   PRO  32          3HB       PRO  32  -9.207   9.720   6.621
  250   1HG   PRO  32          2HG       PRO  32  -8.388   6.900   7.359
  251   2HG   PRO  32          3HG       PRO  32 -10.048   7.528   7.126
  252   1HD   PRO  32          2HD       PRO  32  -8.756   6.206   5.155
  253   2HD   PRO  32          3HD       PRO  32  -9.751   7.628   4.755
  254    H    GLY  33           H        GLY  33  -5.608  10.574   6.996
  255   1HA   GLY  33          2HA       GLY  33  -3.663  10.375   8.109
  256   2HA   GLY  33          3HA       GLY  33  -3.992   8.657   8.321
  257    H    VAL  34           H        VAL  34  -4.054   8.300   5.245
  258    HA   VAL  34           HA       VAL  34  -1.181   8.018   4.868
  259    HB   VAL  34           HB       VAL  34  -3.359   7.545   2.827
  260   1HG1  VAL  34          1HG1      VAL  34  -1.109   7.576   1.842
  261   2HG1  VAL  34          2HG1      VAL  34  -0.450   6.610   3.165
  262   3HG1  VAL  34          3HG1      VAL  34  -1.559   5.871   2.019
  263   1HG2  VAL  34          1HG2      VAL  34  -3.923   6.177   4.757
  264   2HG2  VAL  34          2HG2      VAL  34  -3.202   5.144   3.522
  265   3HG2  VAL  34          3HG2      VAL  34  -2.238   5.649   4.930
  266    H    THR  35           H        THR  35   0.118   9.178   3.435
  267    HA   THR  35           HA       THR  35  -1.097  11.653   2.269
  268    HB   THR  35           HB       THR  35   0.834  11.383   4.447
  269    HG1  THR  35           1HG      THR  35  -1.268  12.347   4.466
  270   1HG2  THR  35          1HG2      THR  35   1.990  13.485   3.933
  271   2HG2  THR  35          2HG2      THR  35   2.457  12.171   2.844
  272   3HG2  THR  35          3HG2      THR  35   1.338  13.448   2.279
  273    H    ASP  36           H        ASP  36   1.618   9.267   2.012
  274    HA   ASP  36           HA       ASP  36   1.151   9.607  -0.758
  275   1HB   ASP  36          2HB       ASP  36   3.316  11.090  -0.033
  276   2HB   ASP  36          3HB       ASP  36   4.088   9.548  -0.438
  277    H    ALA  37           H        ALA  37   2.387   7.983  -2.065
  278    HA   ALA  37           HA       ALA  37   3.044   5.573  -0.634
  279   1HB   ALA  37          1HB       ALA  37   1.183   4.227  -0.864
  280   2HB   ALA  37          2HB       ALA  37   0.412   5.767  -0.549
  281   3HB   ALA  37          3HB       ALA  37   0.509   5.178  -2.219
  282    H    ASN  38           H        ASN  38   4.094   3.975  -1.820
  283    HA   ASN  38           HA       ASN  38   4.649   4.579  -4.668
  284   1HB   ASN  38          2HB       ASN  38   7.194   4.435  -3.448
  285   2HB   ASN  38          3HB       ASN  38   6.442   5.812  -4.224
  286   1HD2  ASN  38          1HD2      ASN  38   5.962   4.241  -0.979
  287   2HD2  ASN  38          2HD2      ASN  38   6.267   5.738  -0.100
  288    H    VAL  39           H        VAL  39   4.324   2.544  -5.424
  289    HA   VAL  39           HA       VAL  39   5.094   0.269  -3.790
  290    HB   VAL  39           HB       VAL  39   3.064   0.467  -5.347
  291   1HG1  VAL  39          1HG1      VAL  39   4.282   1.160  -7.405
  292   2HG1  VAL  39          2HG1      VAL  39   5.064  -0.439  -7.454
  293   3HG1  VAL  39          3HG1      VAL  39   3.315  -0.307  -7.616
  294   1HG2  VAL  39          1HG2      VAL  39   4.885  -1.835  -4.846
  295   2HG2  VAL  39          2HG2      VAL  39   3.217  -1.542  -4.321
  296   3HG2  VAL  39          3HG2      VAL  39   3.543  -2.070  -5.981
  297    H    ASN  40           H        ASN  40   7.052  -0.872  -3.958
  298    HA   ASN  40           HA       ASN  40   9.064   0.089  -5.954
  299   1HB   ASN  40          2HB       ASN  40   9.653   0.674  -3.665
  300   2HB   ASN  40          3HB       ASN  40   9.405  -0.993  -3.149
  301   1HD2  ASN  40          1HD2      ASN  40  11.729  -0.609  -2.371
  302   2HD2  ASN  40          2HD2      ASN  40  13.002  -0.950  -3.530
  303    H    LEU  41           H        LEU  41   7.341  -1.446  -6.990
  304    HA   LEU  41           HA       LEU  41   7.866  -4.296  -6.739
  305   1HB   LEU  41          2HB       LEU  41   5.929  -2.571  -8.017
  306   2HB   LEU  41          3HB       LEU  41   6.639  -3.573  -9.262
  307    HG   LEU  41           HG       LEU  41   4.555  -4.466  -8.205
  308   1HD1  LEU  41          1HD1      LEU  41   7.008  -6.248  -7.871
  309   2HD1  LEU  41          2HD1      LEU  41   5.325  -6.793  -7.994
  310   3HD1  LEU  41          3HD1      LEU  41   6.095  -5.983  -9.372
  311   1HD2  LEU  41          1HD2      LEU  41   4.411  -5.264  -6.025
  312   2HD2  LEU  41          2HD2      LEU  41   6.157  -5.276  -5.759
  313   3HD2  LEU  41          3HD2      LEU  41   5.288  -3.738  -5.824
  314    H    ALA  42           H        ALA  42   9.417  -1.694  -8.274
  315    HA   ALA  42           HA       ALA  42  10.918  -2.785 -10.335
  316   1HB   ALA  42          1HB       ALA  42  11.198  -0.474  -9.454
  317   2HB   ALA  42          2HB       ALA  42  11.973  -1.148  -7.995
  318   3HB   ALA  42          3HB       ALA  42  12.746  -1.344  -9.576
  319    H    THR  43           H        THR  43  11.151  -3.493  -6.828
  320    HA   THR  43           HA       THR  43  12.877  -5.792  -7.590
  321    HB   THR  43           HB       THR  43  14.122  -4.340  -6.182
  322    HG1  THR  43           1HG      THR  43  14.287  -6.658  -6.067
  323   1HG2  THR  43          1HG2      THR  43  13.667  -3.898  -3.895
  324   2HG2  THR  43          2HG2      THR  43  12.216  -3.390  -4.781
  325   3HG2  THR  43          3HG2      THR  43  12.243  -4.934  -3.885
  326    H    GLU  44           H        GLU  44  10.522  -5.013  -4.996
  327    HA   GLU  44           HA       GLU  44   8.407  -6.650  -5.432
  328   1HB   GLU  44          2HB       GLU  44  10.779  -8.319  -4.791
  329   2HB   GLU  44          3HB       GLU  44   9.396  -8.680  -3.803
  330   1HG   GLU  44          2HG       GLU  44   9.038  -8.581  -6.803
  331   2HG   GLU  44          3HG       GLU  44   9.630 -10.012  -5.956
  332    H    THR  45           H        THR  45   8.912  -4.266  -4.088
  333    HA   THR  45           HA       THR  45   7.977  -4.958  -1.382
  334    HB   THR  45           HB       THR  45   9.887  -2.653  -1.849
  335    HG1  THR  45           1HG      THR  45  11.621  -4.128  -1.410
  336   1HG2  THR  45          1HG2      THR  45  10.582  -3.310   0.431
  337   2HG2  THR  45          2HG2      THR  45   8.826  -3.035   0.326
  338   3HG2  THR  45          3HG2      THR  45   9.468  -4.701   0.328
  339    H    VAL  46           H        VAL  46   6.791  -3.159  -0.365
  340    HA   VAL  46           HA       VAL  46   5.947  -0.993  -2.230
  341    HB   VAL  46           HB       VAL  46   4.135  -2.556  -2.257
  342   1HG1  VAL  46          1HG1      VAL  46   2.939  -3.238  -0.181
  343   2HG1  VAL  46          2HG1      VAL  46   4.556  -3.932  -0.281
  344   3HG1  VAL  46          3HG1      VAL  46   4.248  -2.530   0.780
  345   1HG2  VAL  46          1HG2      VAL  46   2.339  -1.287  -1.303
  346   2HG2  VAL  46          2HG2      VAL  46   3.424  -0.353  -0.270
  347   3HG2  VAL  46          3HG2      VAL  46   3.514  -0.173  -2.041
  348    H    ASN  47           H        ASN  47   5.724   1.088  -1.243
  349    HA   ASN  47           HA       ASN  47   6.324   1.160   1.649
  350   1HB   ASN  47          2HB       ASN  47   7.642   2.705  -0.624
  351   2HB   ASN  47          3HB       ASN  47   7.510   3.395   0.997
  352   1HD2  ASN  47          1HD2      ASN  47   8.241   1.842   2.853
  353   2HD2  ASN  47          2HD2      ASN  47   9.852   1.213   2.546
  354    H    VAL  48           H        VAL  48   5.099   2.733   2.749
  355    HA   VAL  48           HA       VAL  48   3.244   4.351   1.143
  356    HB   VAL  48           HB       VAL  48   1.995   2.340   1.393
  357   1HG1  VAL  48          1HG1      VAL  48   1.453   1.381   3.632
  358   2HG1  VAL  48          2HG1      VAL  48   3.136   1.169   3.134
  359   3HG1  VAL  48          3HG1      VAL  48   2.724   2.408   4.327
  360   1HG2  VAL  48          1HG2      VAL  48   0.107   3.146   2.829
  361   2HG2  VAL  48          2HG2      VAL  48   1.099   4.522   3.316
  362   3HG2  VAL  48          3HG2      VAL  48   0.676   4.305   1.614
  363    H    ILE  49           H        ILE  49   3.029   6.283   2.012
  364    HA   ILE  49           HA       ILE  49   4.647   6.845   4.396
  365    HB   ILE  49           HB       ILE  49   3.784   8.815   2.243
  366   1HG1  ILE  49          2HG1      ILE  49   4.975   7.158   0.997
  367   2HG1  ILE  49          3HG1      ILE  49   5.956   8.604   1.186
  368   1HG2  ILE  49          1HG2      ILE  49   5.975   8.861   4.348
  369   2HG2  ILE  49          2HG2      ILE  49   5.752  10.078   3.072
  370   3HG2  ILE  49          3HG2      ILE  49   4.502   9.841   4.301
  371   1HD1  ILE  49          1HD1      ILE  49   7.352   6.638   1.471
  372   2HD1  ILE  49          2HD1      ILE  49   7.236   7.498   3.010
  373   3HD1  ILE  49          3HD1      ILE  49   6.296   6.010   2.747
  374    H    TYR  50           H        TYR  50   3.206   6.864   6.133
  375    HA   TYR  50           HA       TYR  50   0.724   8.477   5.910
  376   1HB   TYR  50          2HB       TYR  50  -0.678   6.731   6.775
  377   2HB   TYR  50          3HB       TYR  50   0.071   6.175   5.303
  378    HD1  TYR  50           HD1      TYR  50  -0.268   5.670   8.900
  379    HD2  TYR  50           HD2      TYR  50   1.816   4.366   5.376
  380    HE1  TYR  50           HE1      TYR  50   0.471   3.616  10.070
  381    HE2  TYR  50           HE2      TYR  50   2.238   2.165   6.462
  382    HH   TYR  50           HH       TYR  50   1.400   1.542   9.857
  383    H    ASP  51           H        ASP  51  -0.376   8.605   7.994
  384    HA   ASP  51           HA       ASP  51   1.663   9.100  10.117
  385   1HB   ASP  51          2HB       ASP  51   0.016  10.868   9.670
  386   2HB   ASP  51          3HB       ASP  51  -1.270   9.801  10.224
  387    HA   PRO  52           HA       PRO  52   0.214   5.051  11.625
  388   1HB   PRO  52          2HB       PRO  52   2.204   4.396  13.324
  389   2HB   PRO  52          3HB       PRO  52   2.430   4.392  11.556
  390   1HG   PRO  52          2HG       PRO  52   3.103   6.651  13.483
  391   2HG   PRO  52          3HG       PRO  52   4.184   5.904  12.268
  392   1HD   PRO  52          2HD       PRO  52   2.803   8.190  11.766
  393   2HD   PRO  52          3HD       PRO  52   3.049   6.956  10.491
  394    H    ALA  53           H        ALA  53  -0.051   8.059  13.109
  395    HA   ALA  53           HA       ALA  53  -1.047   7.006  15.673
  396   1HB   ALA  53          1HB       ALA  53   0.043   9.261  15.496
  397   2HB   ALA  53          2HB       ALA  53  -1.241   9.751  14.365
  398   3HB   ALA  53          3HB       ALA  53  -1.649   9.337  16.041
  399    H    GLU  54           H        GLU  54  -2.016   7.819  12.348
  400    HA   GLU  54           HA       GLU  54  -4.834   7.809  13.181
  401   1HB   GLU  54          2HB       GLU  54  -3.869   9.925  12.247
  402   2HB   GLU  54          3HB       GLU  54  -3.739   9.124  10.676
  403   1HG   GLU  54          2HG       GLU  54  -6.204   8.736  10.704
  404   2HG   GLU  54          3HG       GLU  54  -6.299   9.452  12.323
  405    H    THR  55           H        THR  55  -2.816   6.948  10.354
  406    HA   THR  55           HA       THR  55  -4.384   4.525  10.038
  407    HB   THR  55           HB       THR  55  -2.640   4.304   7.892
  408    HG1  THR  55           1HG      THR  55  -3.843   6.674   7.528
  409   1HG2  THR  55          1HG2      THR  55  -5.483   5.440   8.169
  410   2HG2  THR  55          2HG2      THR  55  -4.737   4.815   6.672
  411   3HG2  THR  55          3HG2      THR  55  -5.047   3.704   8.033
  412    H    GLY  56           H        GLY  56  -2.667   2.791   9.126
  413   1HA   GLY  56          2HA       GLY  56  -0.678   1.904  10.906
  414   2HA   GLY  56          3HA       GLY  56  -2.303   1.448  11.481
  415    H    THR  57           H        THR  57  -2.282  -0.710  10.798
  416    HA   THR  57           HA       THR  57  -1.582  -1.536   8.072
  417    HB   THR  57           HB       THR  57  -2.337  -3.757   9.158
  418    HG1  THR  57           1HG      THR  57  -2.434  -3.621  11.453
  419   1HG2  THR  57          1HG2      THR  57   0.058  -3.079   8.930
  420   2HG2  THR  57          2HG2      THR  57  -0.038  -2.169  10.449
  421   3HG2  THR  57          3HG2      THR  57  -0.210  -3.938  10.457
  422    H    ALA  58           H        ALA  58  -4.274  -1.159  10.325
  423    HA   ALA  58           HA       ALA  58  -6.234  -2.470   9.179
  424   1HB   ALA  58          1HB       ALA  58  -6.576   0.257  10.470
  425   2HB   ALA  58          2HB       ALA  58  -7.856  -0.959  10.266
  426   3HB   ALA  58          3HB       ALA  58  -6.466  -1.301  11.314
  427    H    ALA  59           H        ALA  59  -5.813   0.928   8.306
  428    HA   ALA  59           HA       ALA  59  -8.253   0.709   6.665
  429   1HB   ALA  59          1HB       ALA  59  -7.333   2.837   7.872
  430   2HB   ALA  59          2HB       ALA  59  -6.360   3.025   6.379
  431   3HB   ALA  59          3HB       ALA  59  -8.127   2.985   6.303
  432    H    ILE  60           H        ILE  60  -4.808   0.671   6.190
  433    HA   ILE  60           HA       ILE  60  -4.690   0.584   3.363
  434    HB   ILE  60           HB       ILE  60  -2.913  -0.179   5.704
  435   1HG1  ILE  60          2HG1      ILE  60  -1.349   1.168   4.265
  436   2HG1  ILE  60          3HG1      ILE  60  -2.721   1.370   3.150
  437   1HG2  ILE  60          1HG2      ILE  60  -2.545  -2.200   4.445
  438   2HG2  ILE  60          2HG2      ILE  60  -2.441  -1.305   2.917
  439   3HG2  ILE  60          3HG2      ILE  60  -1.190  -1.119   4.160
  440   1HD1  ILE  60          1HD1      ILE  60  -2.239   3.281   4.787
  441   2HD1  ILE  60          2HD1      ILE  60  -3.913   2.701   4.792
  442   3HD1  ILE  60          3HD1      ILE  60  -2.788   2.213   6.085
  443    H    GLN  61           H        GLN  61  -4.888  -2.089   5.770
  444    HA   GLN  61           HA       GLN  61  -4.860  -4.082   3.807
  445   1HB   GLN  61          2HB       GLN  61  -4.683  -4.035   6.481
  446   2HB   GLN  61          3HB       GLN  61  -6.295  -4.724   6.322
  447   1HG   GLN  61          2HG       GLN  61  -5.452  -6.729   5.621
  448   2HG   GLN  61          3HG       GLN  61  -4.289  -6.005   4.519
  449   1HE2  GLN  61          1HE2      GLN  61  -2.491  -4.631   5.828
  450   2HE2  GLN  61          2HE2      GLN  61  -1.720  -5.612   7.069
  451    H    GLU  62           H        GLU  62  -7.614  -2.513   5.482
  452    HA   GLU  62           HA       GLU  62  -9.818  -3.692   4.314
  453   1HB   GLU  62          2HB       GLU  62  -9.117  -0.957   5.317
  454   2HB   GLU  62          3HB       GLU  62 -10.488  -1.004   4.225
  455   1HG   GLU  62          2HG       GLU  62 -11.374  -1.192   6.396
  456   2HG   GLU  62          3HG       GLU  62 -11.501  -2.813   5.706
  457    H    LYS  63           H        LYS  63  -7.987  -0.931   2.858
  458    HA   LYS  63           HA       LYS  63  -9.481  -1.021   0.429
  459   1HB   LYS  63          2HB       LYS  63  -7.026   0.346   1.516
  460   2HB   LYS  63          3HB       LYS  63  -7.287   0.359  -0.201
  461   1HG   LYS  63          2HG       LYS  63  -9.418   1.168   1.814
  462   2HG   LYS  63          3HG       LYS  63  -8.234   2.296   1.149
  463   1HD   LYS  63          2HD       LYS  63 -10.196   0.780  -0.603
  464   2HD   LYS  63          3HD       LYS  63 -10.496   2.378   0.080
  465   1HE   LYS  63          2HE       LYS  63  -7.850   2.264  -1.220
  466   2HE   LYS  63          3HE       LYS  63  -9.107   1.760  -2.345
  467   1HZ   LYS  63          1HZ       LYS  63  -8.506   4.190  -2.159
  468   2HZ   LYS  63          2HZ       LYS  63 -10.124   3.829  -2.155
  469   3HZ   LYS  63          3HZ       LYS  63  -9.331   4.225  -0.759
  470    H    ILE  64           H        ILE  64  -6.341  -2.353   1.405
  471    HA   ILE  64           HA       ILE  64  -5.240  -3.079  -0.992
  472    HB   ILE  64           HB       ILE  64  -4.891  -3.686   1.770
  473   1HG1  ILE  64          2HG1      ILE  64  -3.435  -2.321   0.271
  474   2HG1  ILE  64          3HG1      ILE  64  -2.624  -3.479   1.320
  475   1HG2  ILE  64          1HG2      ILE  64  -4.364  -6.068   0.019
  476   2HG2  ILE  64          2HG2      ILE  64  -3.566  -5.756   1.575
  477   3HG2  ILE  64          3HG2      ILE  64  -5.305  -5.975   1.523
  478   1HD1  ILE  64          1HD1      ILE  64  -2.393  -5.069  -0.535
  479   2HD1  ILE  64          2HD1      ILE  64  -3.258  -3.954  -1.613
  480   3HD1  ILE  64          3HD1      ILE  64  -1.674  -3.500  -0.941
  481    H    GLU  65           H        GLU  65  -7.361  -4.979   1.218
  482    HA   GLU  65           HA       GLU  65  -7.889  -7.231  -0.418
  483   1HB   GLU  65          2HB       GLU  65  -9.366  -5.895   1.883
  484   2HB   GLU  65          3HB       GLU  65  -9.967  -7.366   1.112
  485   1HG   GLU  65          2HG       GLU  65  -7.147  -7.221   2.194
  486   2HG   GLU  65          3HG       GLU  65  -8.523  -7.646   3.215
  487    H    LYS  66           H        LYS  66  -9.979  -4.327   0.161
  488    HA   LYS  66           HA       LYS  66 -12.017  -5.051  -1.641
  489   1HB   LYS  66          2HB       LYS  66 -10.996  -2.407  -0.590
  490   2HB   LYS  66          3HB       LYS  66 -12.265  -2.437  -1.807
  491   1HG   LYS  66          2HG       LYS  66 -12.787  -4.345   0.392
  492   2HG   LYS  66          3HG       LYS  66 -12.622  -2.698   0.984
  493   1HD   LYS  66          2HD       LYS  66 -14.384  -3.426  -1.400
  494   2HD   LYS  66          3HD       LYS  66 -14.983  -3.460   0.266
  495   1HE   LYS  66          2HE       LYS  66 -14.585  -1.107   0.597
  496   2HE   LYS  66          3HE       LYS  66 -13.682  -0.954  -0.913
  497   1HZ   LYS  66          1HZ       LYS  66 -15.900  -0.114  -1.116
  498   2HZ   LYS  66          2HZ       LYS  66 -15.684  -1.393  -2.124
  499   3HZ   LYS  66          3HZ       LYS  66 -16.553  -1.574  -0.735
  500    H    LEU  67           H        LEU  67  -8.962  -3.424  -2.402
  501    HA   LEU  67           HA       LEU  67  -9.644  -2.819  -5.146
  502   1HB   LEU  67          2HB       LEU  67  -7.090  -2.899  -3.521
  503   2HB   LEU  67          3HB       LEU  67  -7.050  -2.615  -5.259
  504    HG   LEU  67           HG       LEU  67  -8.936  -0.938  -3.594
  505   1HD1  LEU  67          1HD1      LEU  67  -5.933  -0.595  -3.759
  506   2HD1  LEU  67          2HD1      LEU  67  -7.025   0.756  -3.407
  507   3HD1  LEU  67          3HD1      LEU  67  -6.935  -0.638  -2.320
  508   1HD2  LEU  67          1HD2      LEU  67  -7.234  -0.357  -6.066
  509   2HD2  LEU  67          2HD2      LEU  67  -8.946  -0.823  -6.103
  510   3HD2  LEU  67          3HD2      LEU  67  -8.463   0.710  -5.360
  511    H    GLY  68           H        GLY  68  -8.807  -5.770  -3.555
  512   1HA   GLY  68          2HA       GLY  68  -8.950  -7.865  -4.519
  513   2HA   GLY  68          3HA       GLY  68  -8.751  -7.185  -6.141
  514    H    TYR  69           H        TYR  69  -6.817  -6.947  -3.079
  515    HA   TYR  69           HA       TYR  69  -4.470  -8.201  -4.382
  516   1HB   TYR  69          2HB       TYR  69  -4.906  -5.331  -4.007
  517   2HB   TYR  69          3HB       TYR  69  -3.581  -5.869  -2.998
  518    HD1  TYR  69           HD1      TYR  69  -1.502  -6.687  -3.933
  519    HD2  TYR  69           HD2      TYR  69  -4.835  -5.716  -6.490
  520    HE1  TYR  69           HE1      TYR  69   0.001  -6.619  -5.877
  521    HE2  TYR  69           HE2      TYR  69  -3.348  -5.699  -8.435
  522    HH   TYR  69           HH       TYR  69  -1.198  -6.193  -9.196
  523    H    HIS  70           H        HIS  70  -2.671  -8.392  -2.711
  524    HA   HIS  70           HA       HIS  70  -3.612  -8.361   0.099
  525   1HB   HIS  70          2HB       HIS  70  -3.997 -10.630  -0.923
  526   2HB   HIS  70          3HB       HIS  70  -2.254 -10.775  -1.150
  527    HD1  HIS  70           1HD      HIS  70  -1.202  -9.883   1.738
  528    HD2  HIS  70           2HD      HIS  70  -4.631 -12.220   0.984
  529    HE1  HIS  70           1HE      HIS  70  -1.598 -11.267   3.803
  530    H    VAL  71           H        VAL  71  -2.106  -7.308   1.259
  531    HA   VAL  71           HA       VAL  71   0.685  -7.062   0.261
  532    HB   VAL  71           HB       VAL  71  -0.655  -5.013   0.933
  533   1HG1  VAL  71          1HG1      VAL  71  -1.748  -6.000   2.999
  534   2HG1  VAL  71          2HG1      VAL  71  -0.159  -5.959   3.786
  535   3HG1  VAL  71          3HG1      VAL  71  -0.925  -4.452   3.259
  536   1HG2  VAL  71          1HG2      VAL  71   1.750  -4.982   0.740
  537   2HG2  VAL  71          2HG2      VAL  71   1.223  -3.956   2.083
  538   3HG2  VAL  71          3HG2      VAL  71   1.919  -5.559   2.414
  539    H    VAL  72           H        VAL  72   2.408  -7.889   1.647
  540    HA   VAL  72           HA       VAL  72   1.490  -9.654   3.888
  541    HB   VAL  72           HB       VAL  72   3.654 -10.301   1.972
  542   1HG1  VAL  72          1HG1      VAL  72   3.642 -12.520   3.081
  543   2HG1  VAL  72          2HG1      VAL  72   4.083 -11.227   4.194
  544   3HG1  VAL  72          3HG1      VAL  72   2.445 -11.915   4.244
  545   1HG2  VAL  72          1HG2      VAL  72   0.865 -11.520   2.232
  546   2HG2  VAL  72          2HG2      VAL  72   1.460 -10.588   0.839
  547   3HG2  VAL  72          3HG2      VAL  72   2.160 -12.167   1.208
  548    H    ILE  73           H        ILE  73   2.768  -9.581   5.657
  549    HA   ILE  73           HA       ILE  73   4.752  -7.350   5.735
  550    HB   ILE  73           HB       ILE  73   2.865  -8.248   7.909
  551   1HG1  ILE  73          2HG1      ILE  73   2.298  -5.662   7.611
  552   2HG1  ILE  73          3HG1      ILE  73   2.936  -5.912   5.984
  553   1HG2  ILE  73          1HG2      ILE  73   3.731  -6.383   9.178
  554   2HG2  ILE  73          2HG2      ILE  73   5.071  -7.457   8.791
  555   3HG2  ILE  73          3HG2      ILE  73   4.865  -5.955   7.872
  556   1HD1  ILE  73          1HD1      ILE  73   0.461  -6.145   6.210
  557   2HD1  ILE  73          2HD1      ILE  73   1.227  -7.623   5.594
  558   3HD1  ILE  73          3HD1      ILE  73   0.729  -7.523   7.307
  559    H    GLU  74           H        GLU  74   6.376  -9.046   5.031
  560    HA   GLU  74           HA       GLU  74   7.140 -10.959   6.926
  561   1HB   GLU  74          2HB       GLU  74   8.446  -9.778   4.461
  562   2HB   GLU  74          3HB       GLU  74   9.146 -11.068   5.417
  563   1HG   GLU  74          2HG       GLU  74   7.040 -12.427   5.034
  564   2HG   GLU  74          3HG       GLU  74   6.513 -11.183   3.882
  565    H    GLY  75           H        GLY  75   7.278  -7.789   7.096
  566   1HA   GLY  75          2HA       GLY  75  10.084  -7.317   7.853
  567   2HA   GLY  75          3HA       GLY  75   8.800  -6.127   7.568
  568    H    ARG  76           H        ARG  76   6.998  -7.647   9.550
  569    HA   ARG  76           HA       ARG  76   8.123  -6.857  12.103
  570   1HB   ARG  76          2HB       ARG  76   7.561  -4.691  10.958
  571   2HB   ARG  76          3HB       ARG  76   5.882  -5.233  10.792
  572   1HG   ARG  76          2HG       ARG  76   5.510  -5.169  13.143
  573   2HG   ARG  76          3HG       ARG  76   7.247  -5.182  13.498
  574   1HD   ARG  76          2HD       ARG  76   7.466  -2.953  12.447
  575   2HD   ARG  76          3HD       ARG  76   5.694  -2.871  12.258
  576    HE   ARG  76           HE       ARG  76   5.909  -3.443  14.883
  577   1HH1  ARG  76          2HH2      ARG  76   7.482  -0.962  12.940
  578   2HH1  ARG  76          1HH2      ARG  76   7.914   0.060  14.275
  579   1HH2  ARG  76          2HH1      ARG  76   6.410  -2.094  16.689
  580   2HH2  ARG  76          1HH1      ARG  76   7.229  -0.585  16.466
  Start of MODEL   11
    1   1H    MET   1          H1        MET   1  -3.461  14.662  17.191
    2   2H    MET   1          H2        MET   1  -4.918  15.475  17.147
    3   3H    MET   1          H3        MET   1  -4.093  15.108  15.755
    4    HA   MET   1           HA       MET   1  -3.600  17.364  16.141
    5   1HB   MET   1          2HB       MET   1  -3.005  16.370  18.964
    6   2HB   MET   1          3HB       MET   1  -2.455  17.935  18.355
    7   1HG   MET   1          2HG       MET   1  -4.694  18.753  18.108
    8   2HG   MET   1          3HG       MET   1  -5.392  17.154  18.372
    9   1HE   MET   1          1HE       MET   1  -3.512  19.633  21.785
   10   2HE   MET   1          2HE       MET   1  -2.497  18.832  20.569
   11   3HE   MET   1          3HE       MET   1  -3.559  20.187  20.096
   12    H    LEU   2           H        LEU   2  -1.485  17.994  15.483
   13    HA   LEU   2           HA       LEU   2   0.504  17.688  14.535
   14   1HB   LEU   2          2HB       LEU   2   0.982  17.916  17.051
   15   2HB   LEU   2          3HB       LEU   2   1.305  16.184  17.036
   16    HG   LEU   2           HG       LEU   2   2.823  16.934  14.881
   17   1HD1  LEU   2          1HD1      LEU   2   2.163  19.339  15.140
   18   2HD1  LEU   2          2HD1      LEU   2   2.904  19.342  16.754
   19   3HD1  LEU   2          3HD1      LEU   2   3.909  19.082  15.314
   20   1HD2  LEU   2          1HD2      LEU   2   4.768  16.983  16.380
   21   2HD2  LEU   2          2HD2      LEU   2   3.689  17.132  17.788
   22   3HD2  LEU   2          3HD2      LEU   2   3.654  15.664  16.782
   23    H    SER   3           H        SER   3  -0.355  16.269  12.837
   24    HA   SER   3           HA       SER   3  -0.269  13.475  12.992
   25   1HB   SER   3          2HB       SER   3  -0.051  15.145  10.459
   26   2HB   SER   3          3HB       SER   3  -0.904  13.618  10.706
   27    HG   SER   3           HG       SER   3  -2.313  14.750  12.125
   28    H    GLU   4           H        GLU   4   1.593  12.422  13.373
   29    HA   GLU   4           HA       GLU   4   4.186  13.135  12.291
   30   1HB   GLU   4          2HB       GLU   4   3.162  10.985  13.955
   31   2HB   GLU   4          3HB       GLU   4   4.219  10.355  12.727
   32   1HG   GLU   4          2HG       GLU   4   5.653  12.536  13.655
   33   2HG   GLU   4          3HG       GLU   4   4.795  12.006  15.081
   34    H    GLN   5           H        GLN   5   5.337  11.418  10.848
   35    HA   GLN   5           HA       GLN   5   3.577  10.001   8.970
   36   1HB   GLN   5          2HB       GLN   5   5.979  11.714   8.322
   37   2HB   GLN   5          3HB       GLN   5   5.287  10.625   7.146
   38   1HG   GLN   5          2HG       GLN   5   3.662  12.879   8.474
   39   2HG   GLN   5          3HG       GLN   5   4.675  13.108   7.085
   40   1HE2  GLN   5          1HE2      GLN   5   3.414   9.939   6.873
   41   2HE2  GLN   5          2HE2      GLN   5   2.110  10.302   5.777
   42    H    LYS   6           H        LYS   6   4.481   7.975   8.470
   43    HA   LYS   6           HA       LYS   6   7.339   7.582   8.786
   44   1HB   LYS   6          2HB       LYS   6   5.418   5.677  10.168
   45   2HB   LYS   6          3HB       LYS   6   7.153   5.424   9.931
   46   1HG   LYS   6          2HG       LYS   6   7.573   7.591  11.173
   47   2HG   LYS   6          3HG       LYS   6   5.856   7.604  11.610
   48   1HD   LYS   6          2HD       LYS   6   6.291   5.210  12.552
   49   2HD   LYS   6          3HD       LYS   6   8.007   5.587  12.383
   50   1HE   LYS   6          2HE       LYS   6   5.919   6.925  14.168
   51   2HE   LYS   6          3HE       LYS   6   7.387   6.084  14.671
   52   1HZ   LYS   6          1HZ       LYS   6   7.300   8.672  13.206
   53   2HZ   LYS   6          2HZ       LYS   6   7.412   8.580  14.760
   54   3HZ   LYS   6          3HZ       LYS   6   8.658   7.968  13.823
   55    H    GLU   7           H        GLU   7   8.127   5.866   7.622
   56    HA   GLU   7           HA       GLU   7   6.600   5.366   5.152
   57   1HB   GLU   7          2HB       GLU   7   9.609   5.255   5.506
   58   2HB   GLU   7          3HB       GLU   7   8.607   5.491   4.073
   59   1HG   GLU   7          2HG       GLU   7   9.529   7.609   4.513
   60   2HG   GLU   7          3HG       GLU   7   7.929   7.755   5.259
   61    H    ILE   8           H        ILE   8   5.629   3.348   5.771
   62    HA   ILE   8           HA       ILE   8   7.347   1.289   6.916
   63    HB   ILE   8           HB       ILE   8   4.480   1.173   6.180
   64   1HG1  ILE   8          2HG1      ILE   8   5.987   2.426   8.490
   65   2HG1  ILE   8          3HG1      ILE   8   4.456   2.923   7.763
   66   1HG2  ILE   8          1HG2      ILE   8   4.544  -0.658   7.893
   67   2HG2  ILE   8          2HG2      ILE   8   5.496  -0.944   6.452
   68   3HG2  ILE   8          3HG2      ILE   8   6.315  -0.409   7.951
   69   1HD1  ILE   8          1HD1      ILE   8   4.995   0.704   9.762
   70   2HD1  ILE   8          2HD1      ILE   8   4.066   2.192  10.020
   71   3HD1  ILE   8          3HD1      ILE   8   3.419   0.918   8.961
   72    H    ALA   9           H        ALA   9   7.400  -0.810   5.824
   73    HA   ALA   9           HA       ALA   9   7.368  -0.742   2.861
   74   1HB   ALA   9          1HB       ALA   9   9.535  -1.943   4.622
   75   2HB   ALA   9          2HB       ALA   9   9.471  -2.001   2.847
   76   3HB   ALA   9          3HB       ALA   9   9.726  -0.454   3.685
   77    H    MET  10           H        MET  10   6.378  -2.630   2.059
   78    HA   MET  10           HA       MET  10   6.249  -5.020   3.828
   79   1HB   MET  10          2HB       MET  10   3.808  -4.021   2.321
   80   2HB   MET  10          3HB       MET  10   3.956  -5.408   3.395
   81   1HG   MET  10          2HG       MET  10   2.785  -3.892   4.619
   82   2HG   MET  10          3HG       MET  10   4.412  -3.742   5.288
   83   1HE   MET  10          1HE       MET  10   1.619  -1.831   5.365
   84   2HE   MET  10          2HE       MET  10   3.026  -1.708   6.443
   85   3HE   MET  10          3HE       MET  10   2.451  -0.273   5.557
   86    H    GLN  11           H        GLN  11   5.347  -6.904   2.515
   87    HA   GLN  11           HA       GLN  11   6.597  -6.999  -0.190
   88   1HB   GLN  11          2HB       GLN  11   5.774  -8.984   1.934
   89   2HB   GLN  11          3HB       GLN  11   5.693  -9.505   0.257
   90   1HG   GLN  11          2HG       GLN  11   8.248  -8.145   1.057
   91   2HG   GLN  11          3HG       GLN  11   7.897  -9.695   1.822
   92   1HE2  GLN  11          1HE2      GLN  11   7.927  -8.196  -1.553
   93   2HE2  GLN  11          2HE2      GLN  11   8.319  -9.725  -2.268
   94    H    VAL  12           H        VAL  12   5.264  -8.002  -1.899
   95    HA   VAL  12           HA       VAL  12   2.349  -7.367  -1.643
   96    HB   VAL  12           HB       VAL  12   4.165  -7.076  -4.076
   97   1HG1  VAL  12          1HG1      VAL  12   1.197  -6.496  -3.674
   98   2HG1  VAL  12          2HG1      VAL  12   2.150  -5.980  -5.082
   99   3HG1  VAL  12          3HG1      VAL  12   1.904  -7.699  -4.777
  100   1HG2  VAL  12          1HG2      VAL  12   4.591  -5.262  -2.485
  101   2HG2  VAL  12          2HG2      VAL  12   3.623  -4.637  -3.821
  102   3HG2  VAL  12          3HG2      VAL  12   2.844  -5.003  -2.273
  103    H    SER  13           H        SER  13   0.927  -8.879  -2.663
  104    HA   SER  13           HA       SER  13   2.039 -11.158  -4.129
  105   1HB   SER  13          2HB       SER  13   0.514 -11.410  -1.496
  106   2HB   SER  13          3HB       SER  13   0.710 -12.748  -2.643
  107    HG   SER  13           HG       SER  13   3.062 -11.435  -2.031
  108    H    GLY  14           H        GLY  14   0.026 -12.517  -4.892
  109   1HA   GLY  14          2HA       GLY  14  -2.066 -12.595  -5.862
  110   2HA   GLY  14          3HA       GLY  14  -2.477 -11.024  -5.169
  111    H    MET  15           H        MET  15  -0.259  -9.550  -6.208
  112    HA   MET  15           HA       MET  15  -1.118  -8.557  -8.556
  113   1HB   MET  15          2HB       MET  15   0.986  -7.429  -8.735
  114   2HB   MET  15          3HB       MET  15   0.598  -7.640  -7.033
  115   1HG   MET  15          2HG       MET  15   2.867  -8.055  -7.136
  116   2HG   MET  15          3HG       MET  15   2.149  -9.660  -7.023
  117   1HE   MET  15          1HE       MET  15   4.065  -7.883 -10.853
  118   2HE   MET  15          2HE       MET  15   2.379  -7.529 -10.442
  119   3HE   MET  15          3HE       MET  15   3.679  -6.940  -9.394
  120    H    THR  16           H        THR  16  -0.461  -8.549 -10.737
  121    HA   THR  16           HA       THR  16   0.847 -11.028 -11.797
  122    HB   THR  16           HB       THR  16  -0.437 -10.326 -13.925
  123    HG1  THR  16           1HG      THR  16  -2.232  -9.169 -12.087
  124   1HG2  THR  16          1HG2      THR  16  -1.005 -12.352 -12.683
  125   2HG2  THR  16          2HG2      THR  16  -1.974 -11.421 -11.523
  126   3HG2  THR  16          3HG2      THR  16  -2.483 -11.539 -13.226
  127    H    CYS  17           H        CYS  17   0.032  -7.748 -13.010
  128    HA   CYS  17           HA       CYS  17   2.833  -7.519 -13.965
  129   1HB   CYS  17          2HB       CYS  17   2.128  -6.046 -15.588
  130   2HB   CYS  17          3HB       CYS  17   0.868  -7.285 -15.553
  131    H    ALA  18           H        ALA  18   4.112  -5.717 -13.600
  132    HA   ALA  18           HA       ALA  18   3.762  -4.431 -11.002
  133   1HB   ALA  18          1HB       ALA  18   5.907  -4.112 -13.141
  134   2HB   ALA  18          2HB       ALA  18   5.986  -3.503 -11.473
  135   3HB   ALA  18          3HB       ALA  18   5.956  -5.251 -11.778
  136    H    ALA  19           H        ALA  19   1.591  -3.666 -12.349
  137    HA   ALA  19           HA       ALA  19   2.060  -0.761 -12.799
  138   1HB   ALA  19          1HB       ALA  19   0.450  -2.415 -14.776
  139   2HB   ALA  19          2HB       ALA  19   0.776  -0.675 -14.826
  140   3HB   ALA  19          3HB       ALA  19   2.104  -1.828 -15.053
  141    H    CYS  20           H        CYS  20  -0.557  -3.316 -12.661
  142    HA   CYS  20           HA       CYS  20  -2.488  -1.570 -11.537
  143   1HB   CYS  20          2HB       CYS  20  -2.096  -4.542 -10.887
  144   2HB   CYS  20          3HB       CYS  20  -3.577  -3.588 -10.689
  145    H    ALA  21           H        ALA  21   0.163  -3.363 -10.105
  146    HA   ALA  21           HA       ALA  21  -0.093  -2.928  -7.403
  147   1HB   ALA  21          1HB       ALA  21   1.732  -4.157  -8.721
  148   2HB   ALA  21          2HB       ALA  21   2.531  -2.580  -8.881
  149   3HB   ALA  21          3HB       ALA  21   2.227  -3.290  -7.275
  150    H    ALA  22           H        ALA  22   0.683  -0.475  -9.869
  151    HA   ALA  22           HA       ALA  22   1.392   1.588  -7.919
  152   1HB   ALA  22          1HB       ALA  22   2.209   1.627 -10.275
  153   2HB   ALA  22          2HB       ALA  22   0.533   1.847 -10.829
  154   3HB   ALA  22          3HB       ALA  22   1.304   3.087  -9.823
  155    H    ARG  23           H        ARG  23  -1.475   0.695  -9.903
  156    HA   ARG  23           HA       ARG  23  -3.054   2.965  -9.154
  157   1HB   ARG  23          2HB       ARG  23  -3.784   0.221 -10.272
  158   2HB   ARG  23          3HB       ARG  23  -5.010   1.351  -9.705
  159   1HG   ARG  23          2HG       ARG  23  -4.924   1.816 -11.954
  160   2HG   ARG  23          3HG       ARG  23  -4.008   3.130 -11.210
  161   1HD   ARG  23          2HD       ARG  23  -1.882   1.824 -11.799
  162   2HD   ARG  23          3HD       ARG  23  -2.943   0.652 -12.612
  163    HE   ARG  23           HE       ARG  23  -3.248   3.481 -13.389
  164   1HH1  ARG  23          2HH2      ARG  23  -1.622   0.442 -14.145
  165   2HH1  ARG  23          1HH2      ARG  23  -1.284   0.846 -15.799
  166   1HH2  ARG  23          2HH1      ARG  23  -2.747   4.091 -15.543
  167   2HH2  ARG  23          1HH1      ARG  23  -1.903   3.005 -16.595
  168    H    ILE  24           H        ILE  24  -2.939  -0.373  -7.835
  169    HA   ILE  24           HA       ILE  24  -4.848   0.069  -5.843
  170    HB   ILE  24           HB       ILE  24  -3.969  -1.825  -4.620
  171   1HG1  ILE  24          2HG1      ILE  24  -2.191  -2.995  -6.361
  172   2HG1  ILE  24          3HG1      ILE  24  -1.714  -1.305  -6.426
  173   1HG2  ILE  24          1HG2      ILE  24  -4.743  -3.337  -6.244
  174   2HG2  ILE  24          2HG2      ILE  24  -5.456  -1.828  -6.808
  175   3HG2  ILE  24          3HG2      ILE  24  -4.016  -2.447  -7.600
  176   1HD1  ILE  24          1HD1      ILE  24  -0.357  -2.581  -4.806
  177   2HD1  ILE  24          2HD1      ILE  24  -1.310  -1.345  -3.958
  178   3HD1  ILE  24          3HD1      ILE  24  -1.829  -3.039  -3.921
  179    H    GLU  25           H        GLU  25  -1.298   0.564  -5.569
  180    HA   GLU  25           HA       GLU  25  -1.458   1.626  -2.990
  181   1HB   GLU  25          2HB       GLU  25   0.564   0.905  -4.591
  182   2HB   GLU  25          3HB       GLU  25   0.685   2.649  -4.855
  183   1HG   GLU  25          2HG       GLU  25   2.162   1.711  -3.035
  184   2HG   GLU  25          3HG       GLU  25   1.033   2.944  -2.469
  185    H    LYS  26           H        LYS  26  -2.018   3.277  -6.038
  186    HA   LYS  26           HA       LYS  26  -1.952   5.928  -4.768
  187   1HB   LYS  26          2HB       LYS  26  -2.801   5.090  -7.548
  188   2HB   LYS  26          3HB       LYS  26  -2.681   6.763  -6.987
  189   1HG   LYS  26          2HG       LYS  26  -0.350   4.792  -7.022
  190   2HG   LYS  26          3HG       LYS  26  -0.687   5.958  -8.298
  191   1HD   LYS  26          2HD       LYS  26  -0.321   7.818  -6.721
  192   2HD   LYS  26          3HD       LYS  26  -0.068   6.674  -5.386
  193   1HE   LYS  26          2HE       LYS  26   1.854   5.662  -6.663
  194   2HE   LYS  26          3HE       LYS  26   1.708   6.987  -7.830
  195   1HZ   LYS  26          1HZ       LYS  26   2.352   7.188  -4.942
  196   2HZ   LYS  26          2HZ       LYS  26   3.352   7.489  -6.188
  197   3HZ   LYS  26          3HZ       LYS  26   2.095   8.504  -5.895
  198    H    GLY  27           H        GLY  27  -4.497   3.629  -5.690
  199   1HA   GLY  27          2HA       GLY  27  -6.687   5.343  -4.850
  200   2HA   GLY  27          3HA       GLY  27  -6.730   3.582  -4.995
  201    H    LEU  28           H        LEU  28  -4.561   2.927  -3.283
  202    HA   LEU  28           HA       LEU  28  -5.727   2.894  -0.666
  203   1HB   LEU  28          2HB       LEU  28  -4.135   1.326  -1.495
  204   2HB   LEU  28          3HB       LEU  28  -2.863   2.541  -1.554
  205    HG   LEU  28           HG       LEU  28  -4.271   1.807   1.025
  206   1HD1  LEU  28          1HD1      LEU  28  -3.336  -0.163  -0.088
  207   2HD1  LEU  28          2HD1      LEU  28  -1.751   0.620  -0.190
  208   3HD1  LEU  28          3HD1      LEU  28  -2.447   0.217   1.393
  209   1HD2  LEU  28          1HD2      LEU  28  -2.028   2.630   1.940
  210   2HD2  LEU  28          2HD2      LEU  28  -1.632   3.191   0.312
  211   3HD2  LEU  28          3HD2      LEU  28  -3.008   3.882   1.206
  212    H    LYS  29           H        LYS  29  -3.129   4.942  -2.030
  213    HA   LYS  29           HA       LYS  29  -2.660   6.626   0.054
  214   1HB   LYS  29          2HB       LYS  29  -1.674   6.485  -2.375
  215   2HB   LYS  29          3HB       LYS  29  -2.870   7.716  -2.765
  216   1HG   LYS  29          2HG       LYS  29  -1.461   8.562  -0.372
  217   2HG   LYS  29          3HG       LYS  29  -0.307   7.872  -1.494
  218   1HD   LYS  29          2HD       LYS  29  -0.351  10.188  -2.079
  219   2HD   LYS  29          3HD       LYS  29  -1.212   9.331  -3.333
  220   1HE   LYS  29          2HE       LYS  29  -2.239  11.441  -2.592
  221   2HE   LYS  29          3HE       LYS  29  -3.345  10.056  -2.442
  222   1HZ   LYS  29          1HZ       LYS  29  -3.325  11.613  -0.506
  223   2HZ   LYS  29          2HZ       LYS  29  -3.040  10.055  -0.107
  224   3HZ   LYS  29          3HZ       LYS  29  -1.785  11.134  -0.178
  225    H    ARG  30           H        ARG  30  -5.700   6.534  -1.657
  226    HA   ARG  30           HA       ARG  30  -6.385   9.325  -1.083
  227   1HB   ARG  30          2HB       ARG  30  -7.307   7.234  -2.849
  228   2HB   ARG  30          3HB       ARG  30  -8.674   7.794  -1.898
  229   1HG   ARG  30          2HG       ARG  30  -8.165  10.119  -2.605
  230   2HG   ARG  30          3HG       ARG  30  -6.699   9.544  -3.426
  231   1HD   ARG  30          2HD       ARG  30  -8.893   7.955  -4.398
  232   2HD   ARG  30          3HD       ARG  30  -9.446   9.614  -4.440
  233    HE   ARG  30           HE       ARG  30  -7.456   8.316  -6.104
  234   1HH1  ARG  30          2HH2      ARG  30  -8.273  11.426  -4.701
  235   2HH1  ARG  30          1HH2      ARG  30  -7.561  12.394  -5.957
  236   1HH2  ARG  30          2HH1      ARG  30  -6.462   9.541  -7.807
  237   2HH2  ARG  30          1HH1      ARG  30  -6.475  11.273  -7.761
  238    H    MET  31           H        MET  31  -6.321   6.486   0.840
  239    HA   MET  31           HA       MET  31  -8.717   6.991   2.334
  240   1HB   MET  31          2HB       MET  31  -7.867   5.362   3.903
  241   2HB   MET  31          3HB       MET  31  -7.431   4.868   2.266
  242   1HG   MET  31          2HG       MET  31  -5.140   5.748   2.638
  243   2HG   MET  31          3HG       MET  31  -5.567   6.235   4.264
  244   1HE   MET  31          1HE       MET  31  -5.900   3.152   1.972
  245   2HE   MET  31          2HE       MET  31  -5.619   1.813   3.098
  246   3HE   MET  31          3HE       MET  31  -7.097   2.771   3.261
  247    HA   PRO  32           HA       PRO  32  -7.272  10.246   5.163
  248   1HB   PRO  32          2HB       PRO  32  -8.380   9.430   7.555
  249   2HB   PRO  32          3HB       PRO  32  -9.317  10.214   6.251
  250   1HG   PRO  32          2HG       PRO  32  -9.042   7.246   6.795
  251   2HG   PRO  32          3HG       PRO  32 -10.549   8.172   6.530
  252   1HD   PRO  32          2HD       PRO  32  -9.410   6.804   4.525
  253   2HD   PRO  32          3HD       PRO  32 -10.064   8.429   4.200
  254    H    GLY  33           H        GLY  33  -5.350  10.390   6.308
  255   1HA   GLY  33          2HA       GLY  33  -3.801   9.716   7.910
  256   2HA   GLY  33          3HA       GLY  33  -4.295   8.029   7.759
  257    H    VAL  34           H        VAL  34  -4.061   8.030   4.730
  258    HA   VAL  34           HA       VAL  34  -1.106   7.786   4.657
  259    HB   VAL  34           HB       VAL  34  -3.157   6.917   2.624
  260   1HG1  VAL  34          1HG1      VAL  34  -0.142   6.460   2.868
  261   2HG1  VAL  34          2HG1      VAL  34  -1.208   5.649   1.703
  262   3HG1  VAL  34          3HG1      VAL  34  -0.948   7.396   1.603
  263   1HG2  VAL  34          1HG2      VAL  34  -1.484   5.298   4.622
  264   2HG2  VAL  34          2HG2      VAL  34  -3.197   5.641   4.816
  265   3HG2  VAL  34          3HG2      VAL  34  -2.621   4.660   3.446
  266    H    THR  35           H        THR  35   0.018   9.538   4.175
  267    HA   THR  35           HA       THR  35  -1.254  11.723   2.658
  268    HB   THR  35           HB       THR  35   0.965  11.458   4.524
  269    HG1  THR  35           1HG      THR  35  -0.638  12.742   5.105
  270   1HG2  THR  35          1HG2      THR  35   1.381  13.265   2.120
  271   2HG2  THR  35          2HG2      THR  35   2.215  13.413   3.681
  272   3HG2  THR  35          3HG2      THR  35   2.453  11.959   2.710
  273    H    ASP  36           H        ASP  36   1.553   9.399   2.235
  274    HA   ASP  36           HA       ASP  36   0.954   9.595  -0.571
  275   1HB   ASP  36          2HB       ASP  36   3.106  11.140   0.232
  276   2HB   ASP  36          3HB       ASP  36   3.878   9.624  -0.258
  277    H    ALA  37           H        ALA  37   2.071   8.047  -1.856
  278    HA   ALA  37           HA       ALA  37   3.038   5.673  -0.449
  279   1HB   ALA  37          1HB       ALA  37   0.461   5.639  -0.165
  280   2HB   ALA  37          2HB       ALA  37   0.407   5.223  -1.888
  281   3HB   ALA  37          3HB       ALA  37   1.259   4.172  -0.722
  282    H    ASN  38           H        ASN  38   3.914   3.973  -1.771
  283    HA   ASN  38           HA       ASN  38   4.319   4.620  -4.627
  284   1HB   ASN  38          2HB       ASN  38   6.949   4.475  -3.625
  285   2HB   ASN  38          3HB       ASN  38   6.134   5.884  -4.271
  286   1HD2  ASN  38          1HD2      ASN  38   5.896   4.173  -1.084
  287   2HD2  ASN  38          2HD2      ASN  38   6.283   5.621  -0.154
  288    H    VAL  39           H        VAL  39   4.184   2.573  -5.465
  289    HA   VAL  39           HA       VAL  39   4.965   0.311  -3.825
  290    HB   VAL  39           HB       VAL  39   2.989   0.412  -5.429
  291   1HG1  VAL  39          1HG1      VAL  39   4.214   1.299  -7.431
  292   2HG1  VAL  39          2HG1      VAL  39   5.096  -0.243  -7.533
  293   3HG1  VAL  39          3HG1      VAL  39   3.345  -0.214  -7.734
  294   1HG2  VAL  39          1HG2      VAL  39   5.019  -1.823  -5.338
  295   2HG2  VAL  39          2HG2      VAL  39   3.559  -1.591  -4.348
  296   3HG2  VAL  39          3HG2      VAL  39   3.401  -2.001  -6.055
  297    H    ASN  40           H        ASN  40   6.956  -0.783  -3.979
  298    HA   ASN  40           HA       ASN  40   8.978   0.319  -5.893
  299   1HB   ASN  40          2HB       ASN  40   9.383   0.870  -3.488
  300   2HB   ASN  40          3HB       ASN  40   9.408  -0.861  -3.120
  301   1HD2  ASN  40          1HD2      ASN  40  11.640   0.116  -2.331
  302   2HD2  ASN  40          2HD2      ASN  40  12.941  -0.016  -3.503
  303    H    LEU  41           H        LEU  41   7.332  -1.322  -6.944
  304    HA   LEU  41           HA       LEU  41   7.682  -4.081  -6.343
  305   1HB   LEU  41          2HB       LEU  41   5.818  -2.580  -7.703
  306   2HB   LEU  41          3HB       LEU  41   6.639  -3.362  -9.042
  307    HG   LEU  41           HG       LEU  41   4.566  -4.483  -8.222
  308   1HD1  LEU  41          1HD1      LEU  41   7.096  -6.163  -7.864
  309   2HD1  LEU  41          2HD1      LEU  41   5.480  -6.806  -8.096
  310   3HD1  LEU  41          3HD1      LEU  41   6.246  -5.857  -9.390
  311   1HD2  LEU  41          1HD2      LEU  41   6.015  -5.303  -5.688
  312   2HD2  LEU  41          2HD2      LEU  41   4.843  -3.982  -5.797
  313   3HD2  LEU  41          3HD2      LEU  41   4.360  -5.633  -6.194
  314    H    ALA  42           H        ALA  42   9.518  -1.876  -8.225
  315    HA   ALA  42           HA       ALA  42  11.123  -3.409  -9.889
  316   1HB   ALA  42          1HB       ALA  42  12.945  -1.900  -9.219
  317   2HB   ALA  42          2HB       ALA  42  11.437  -0.982  -9.453
  318   3HB   ALA  42          3HB       ALA  42  12.014  -1.371  -7.809
  319    H    THR  43           H        THR  43  11.046  -3.391  -6.292
  320    HA   THR  43           HA       THR  43  12.706  -5.860  -6.380
  321    HB   THR  43           HB       THR  43  14.171  -4.133  -5.587
  322    HG1  THR  43           1HG      THR  43  13.171  -5.834  -3.569
  323   1HG2  THR  43          1HG2      THR  43  12.581  -2.463  -4.774
  324   2HG2  THR  43          2HG2      THR  43  12.102  -3.522  -3.430
  325   3HG2  THR  43          3HG2      THR  43  13.751  -2.878  -3.515
  326    H    GLU  44           H        GLU  44   9.927  -5.726  -6.624
  327    HA   GLU  44           HA       GLU  44   7.973  -6.487  -5.772
  328   1HB   GLU  44          2HB       GLU  44  10.007  -8.398  -4.561
  329   2HB   GLU  44          3HB       GLU  44   8.263  -8.698  -4.636
  330   1HG   GLU  44          2HG       GLU  44   8.279  -8.471  -7.095
  331   2HG   GLU  44          3HG       GLU  44  10.033  -8.213  -7.065
  332    H    THR  45           H        THR  45   8.955  -4.231  -4.133
  333    HA   THR  45           HA       THR  45   7.805  -4.980  -1.484
  334    HB   THR  45           HB       THR  45   9.999  -2.994  -2.225
  335    HG1  THR  45           1HG      THR  45  10.588  -5.264  -2.311
  336   1HG2  THR  45          1HG2      THR  45   8.757  -2.314  -0.199
  337   2HG2  THR  45          2HG2      THR  45   8.967  -3.969   0.455
  338   3HG2  THR  45          3HG2      THR  45  10.375  -2.913   0.213
  339    H    VAL  46           H        VAL  46   6.549  -3.231  -0.490
  340    HA   VAL  46           HA       VAL  46   5.746  -1.025  -2.326
  341    HB   VAL  46           HB       VAL  46   3.945  -2.593  -2.375
  342   1HG1  VAL  46          1HG1      VAL  46   3.933  -2.502   0.669
  343   2HG1  VAL  46          2HG1      VAL  46   2.693  -3.266  -0.341
  344   3HG1  VAL  46          3HG1      VAL  46   4.330  -3.921  -0.335
  345   1HG2  VAL  46          1HG2      VAL  46   3.357  -0.191  -2.218
  346   2HG2  VAL  46          2HG2      VAL  46   2.134  -1.289  -1.554
  347   3HG2  VAL  46          3HG2      VAL  46   3.170  -0.363  -0.455
  348    H    ASN  47           H        ASN  47   5.511   1.056  -1.308
  349    HA   ASN  47           HA       ASN  47   6.265   1.093   1.546
  350   1HB   ASN  47          2HB       ASN  47   7.531   2.548  -0.803
  351   2HB   ASN  47          3HB       ASN  47   7.442   3.333   0.776
  352   1HD2  ASN  47          1HD2      ASN  47   8.127   1.811   2.706
  353   2HD2  ASN  47          2HD2      ASN  47   9.745   1.189   2.427
  354    H    VAL  48           H        VAL  48   5.199   2.717   2.752
  355    HA   VAL  48           HA       VAL  48   3.214   4.333   1.293
  356    HB   VAL  48           HB       VAL  48   2.092   2.251   1.571
  357   1HG1  VAL  48          1HG1      VAL  48   3.319   1.156   3.318
  358   2HG1  VAL  48          2HG1      VAL  48   2.810   2.355   4.516
  359   3HG1  VAL  48          3HG1      VAL  48   1.616   1.263   3.785
  360   1HG2  VAL  48          1HG2      VAL  48   0.152   2.978   2.854
  361   2HG2  VAL  48          2HG2      VAL  48   1.085   4.308   3.567
  362   3HG2  VAL  48          3HG2      VAL  48   0.788   4.263   1.822
  363    H    ILE  49           H        ILE  49   3.068   6.261   2.159
  364    HA   ILE  49           HA       ILE  49   4.822   6.824   4.447
  365    HB   ILE  49           HB       ILE  49   3.910   8.724   2.241
  366   1HG1  ILE  49          2HG1      ILE  49   5.024   6.985   1.045
  367   2HG1  ILE  49          3HG1      ILE  49   6.032   8.421   1.116
  368   1HG2  ILE  49          1HG2      ILE  49   5.904  10.011   2.918
  369   2HG2  ILE  49          2HG2      ILE  49   4.718   9.845   4.221
  370   3HG2  ILE  49          3HG2      ILE  49   6.188   8.861   4.240
  371   1HD1  ILE  49          1HD1      ILE  49   7.401   6.437   1.434
  372   2HD1  ILE  49          2HD1      ILE  49   7.393   7.388   2.921
  373   3HD1  ILE  49          3HD1      ILE  49   6.408   5.910   2.802
  374    H    TYR  50           H        TYR  50   3.327   6.758   6.198
  375    HA   TYR  50           HA       TYR  50   0.826   8.391   5.932
  376   1HB   TYR  50          2HB       TYR  50  -0.537   6.622   6.692
  377   2HB   TYR  50          3HB       TYR  50   0.389   6.077   5.316
  378    HD1  TYR  50           HD1      TYR  50  -0.108   5.795   8.963
  379    HD2  TYR  50           HD2      TYR  50   2.002   4.194   5.588
  380    HE1  TYR  50           HE1      TYR  50   0.321   3.708  10.213
  381    HE2  TYR  50           HE2      TYR  50   2.110   1.980   6.725
  382    HH   TYR  50           HH       TYR  50   1.131   1.499  10.032
  383    H    ASP  51           H        ASP  51  -0.339   8.592   7.890
  384    HA   ASP  51           HA       ASP  51   1.518   9.320  10.085
  385   1HB   ASP  51          2HB       ASP  51  -0.109  10.972   9.492
  386   2HB   ASP  51          3HB       ASP  51  -1.432   9.835   9.743
  387    HA   PRO  52           HA       PRO  52   0.393   5.264  11.790
  388   1HB   PRO  52          2HB       PRO  52   2.249   5.007  13.733
  389   2HB   PRO  52          3HB       PRO  52   2.660   4.910  11.996
  390   1HG   PRO  52          2HG       PRO  52   2.845   7.357  13.786
  391   2HG   PRO  52          3HG       PRO  52   4.122   6.653  12.746
  392   1HD   PRO  52          2HD       PRO  52   2.558   8.710  11.911
  393   2HD   PRO  52          3HD       PRO  52   3.065   7.417  10.781
  394    H    ALA  53           H        ALA  53  -0.278   8.352  13.085
  395    HA   ALA  53           HA       ALA  53  -1.438   7.277  15.589
  396   1HB   ALA  53          1HB       ALA  53  -0.336   9.517  15.558
  397   2HB   ALA  53          2HB       ALA  53  -1.521  10.050  14.343
  398   3HB   ALA  53          3HB       ALA  53  -2.066   9.588  15.964
  399    H    GLU  54           H        GLU  54  -2.148   7.910  12.196
  400    HA   GLU  54           HA       GLU  54  -5.031   8.154  12.770
  401   1HB   GLU  54          2HB       GLU  54  -3.756   9.954  11.471
  402   2HB   GLU  54          3HB       GLU  54  -3.634   8.782  10.158
  403   1HG   GLU  54          2HG       GLU  54  -5.608   9.758   9.507
  404   2HG   GLU  54          3HG       GLU  54  -6.338   8.653  10.673
  405    H    THR  55           H        THR  55  -2.687   6.643  10.595
  406    HA   THR  55           HA       THR  55  -4.334   4.205  10.432
  407    HB   THR  55           HB       THR  55  -2.777   3.723   8.281
  408    HG1  THR  55           1HG      THR  55  -3.006   6.520   8.478
  409   1HG2  THR  55          1HG2      THR  55  -4.627   4.591   6.958
  410   2HG2  THR  55          2HG2      THR  55  -5.180   3.670   8.383
  411   3HG2  THR  55          3HG2      THR  55  -5.273   5.465   8.373
  412    H    GLY  56           H        GLY  56  -2.634   2.416   9.742
  413   1HA   GLY  56          2HA       GLY  56  -0.552   1.604  11.342
  414   2HA   GLY  56          3HA       GLY  56  -1.932   1.823  12.443
  415    H    THR  57           H        THR  57  -0.885   0.360   9.652
  416    HA   THR  57           HA       THR  57  -1.691  -0.375   7.854
  417    HB   THR  57           HB       THR  57  -1.224  -2.819   7.780
  418    HG1  THR  57           1HG      THR  57  -0.643  -3.778   9.795
  419   1HG2  THR  57          1HG2      THR  57   1.093  -2.686   8.492
  420   2HG2  THR  57          2HG2      THR  57   0.636  -1.127   7.781
  421   3HG2  THR  57          3HG2      THR  57   0.755  -1.306   9.546
  422    H    ALA  58           H        ALA  58  -3.866  -1.311  10.365
  423    HA   ALA  58           HA       ALA  58  -5.988  -2.585   9.488
  424   1HB   ALA  58          1HB       ALA  58  -5.826   0.288  10.426
  425   2HB   ALA  58          2HB       ALA  58  -7.313  -0.705  10.487
  426   3HB   ALA  58          3HB       ALA  58  -5.882  -1.147  11.455
  427    H    ALA  59           H        ALA  59  -5.261   0.670   8.145
  428    HA   ALA  59           HA       ALA  59  -7.845   0.476   6.670
  429   1HB   ALA  59          1HB       ALA  59  -5.742   2.625   6.545
  430   2HB   ALA  59          2HB       ALA  59  -7.386   2.717   5.877
  431   3HB   ALA  59          3HB       ALA  59  -7.159   2.636   7.633
  432    H    ILE  60           H        ILE  60  -4.420   0.552   6.085
  433    HA   ILE  60           HA       ILE  60  -4.177   0.213   3.306
  434    HB   ILE  60           HB       ILE  60  -2.581  -0.314   5.781
  435   1HG1  ILE  60          2HG1      ILE  60  -1.621   0.970   3.317
  436   2HG1  ILE  60          3HG1      ILE  60  -2.951   1.798   4.101
  437   1HG2  ILE  60          1HG2      ILE  60  -0.661  -1.094   4.471
  438   2HG2  ILE  60          2HG2      ILE  60  -1.939  -2.305   4.608
  439   3HG2  ILE  60          3HG2      ILE  60  -1.734  -1.402   3.084
  440   1HD1  ILE  60          1HD1      ILE  60  -1.743   1.886   6.252
  441   2HD1  ILE  60          2HD1      ILE  60  -0.333   1.102   5.504
  442   3HD1  ILE  60          3HD1      ILE  60  -0.851   2.719   4.974
  443    H    GLN  61           H        GLN  61  -4.346  -2.464   5.752
  444    HA   GLN  61           HA       GLN  61  -4.427  -4.437   3.725
  445   1HB   GLN  61          2HB       GLN  61  -4.686  -4.378   6.590
  446   2HB   GLN  61          3HB       GLN  61  -6.010  -5.326   5.920
  447   1HG   GLN  61          2HG       GLN  61  -4.637  -7.060   5.910
  448   2HG   GLN  61          3HG       GLN  61  -3.855  -6.367   4.501
  449   1HE2  GLN  61          1HE2      GLN  61  -2.344  -4.274   5.543
  450   2HE2  GLN  61          2HE2      GLN  61  -1.203  -4.931   6.714
  451    H    GLU  62           H        GLU  62  -7.121  -2.741   5.418
  452    HA   GLU  62           HA       GLU  62  -9.246  -4.032   4.181
  453   1HB   GLU  62          2HB       GLU  62  -8.840  -1.584   5.715
  454   2HB   GLU  62          3HB       GLU  62  -9.949  -1.240   4.390
  455   1HG   GLU  62          2HG       GLU  62 -10.280  -3.550   6.347
  456   2HG   GLU  62          3HG       GLU  62 -11.102  -1.986   6.457
  457    H    LYS  63           H        LYS  63  -7.612  -1.048   2.937
  458    HA   LYS  63           HA       LYS  63  -9.203  -1.041   0.570
  459   1HB   LYS  63          2HB       LYS  63  -6.804   0.416   1.636
  460   2HB   LYS  63          3HB       LYS  63  -7.192   0.552  -0.045
  461   1HG   LYS  63          2HG       LYS  63  -9.155   1.201   2.211
  462   2HG   LYS  63          3HG       LYS  63  -8.097   2.367   1.417
  463   1HD   LYS  63          2HD       LYS  63 -10.112   2.789   0.510
  464   2HD   LYS  63          3HD       LYS  63  -9.165   2.006  -0.758
  465   1HE   LYS  63          2HE       LYS  63 -10.514   0.075  -0.736
  466   2HE   LYS  63          3HE       LYS  63 -11.068   0.343   0.938
  467   1HZ   LYS  63          1HZ       LYS  63 -12.407   2.141   0.142
  468   2HZ   LYS  63          2HZ       LYS  63 -11.871   1.935  -1.404
  469   3HZ   LYS  63          3HZ       LYS  63 -12.771   0.767  -0.678
  470    H    ILE  64           H        ILE  64  -6.010  -2.436   1.389
  471    HA   ILE  64           HA       ILE  64  -4.973  -2.961  -1.080
  472    HB   ILE  64           HB       ILE  64  -4.805  -4.072   1.628
  473   1HG1  ILE  64          2HG1      ILE  64  -3.432  -2.162   0.661
  474   2HG1  ILE  64          3HG1      ILE  64  -2.575  -3.447   1.488
  475   1HG2  ILE  64          1HG2      ILE  64  -4.937  -6.151   0.675
  476   2HG2  ILE  64          2HG2      ILE  64  -3.848  -5.696  -0.669
  477   3HG2  ILE  64          3HG2      ILE  64  -3.246  -5.801   1.010
  478   1HD1  ILE  64          1HD1      ILE  64  -1.932  -4.462  -0.645
  479   2HD1  ILE  64          2HD1      ILE  64  -2.808  -3.194  -1.528
  480   3HD1  ILE  64          3HD1      ILE  64  -1.403  -2.776  -0.524
  481    H    GLU  65           H        GLU  65  -7.100  -4.929   1.079
  482    HA   GLU  65           HA       GLU  65  -7.769  -7.062  -0.621
  483   1HB   GLU  65          2HB       GLU  65  -9.200  -5.769   1.737
  484   2HB   GLU  65          3HB       GLU  65  -9.805  -7.220   0.938
  485   1HG   GLU  65          2HG       GLU  65  -6.963  -7.134   1.961
  486   2HG   GLU  65          3HG       GLU  65  -8.316  -7.479   3.045
  487    H    LYS  66           H        LYS  66  -9.770  -4.118   0.093
  488    HA   LYS  66           HA       LYS  66 -11.822  -4.766  -1.735
  489   1HB   LYS  66          2HB       LYS  66 -10.902  -2.246  -0.401
  490   2HB   LYS  66          3HB       LYS  66 -11.875  -2.046  -1.859
  491   1HG   LYS  66          2HG       LYS  66 -13.421  -2.031  -0.102
  492   2HG   LYS  66          3HG       LYS  66 -13.599  -3.597  -0.898
  493   1HD   LYS  66          2HD       LYS  66 -12.096  -4.570   0.951
  494   2HD   LYS  66          3HD       LYS  66 -12.151  -2.977   1.720
  495   1HE   LYS  66          2HE       LYS  66 -14.774  -3.246   1.524
  496   2HE   LYS  66          3HE       LYS  66 -14.414  -4.962   1.252
  497   1HZ   LYS  66          1HZ       LYS  66 -13.720  -3.306   3.599
  498   2HZ   LYS  66          2HZ       LYS  66 -14.762  -4.593   3.593
  499   3HZ   LYS  66          3HZ       LYS  66 -13.113  -4.742   3.455
  500    H    LEU  67           H        LEU  67  -8.766  -3.085  -2.388
  501    HA   LEU  67           HA       LEU  67  -9.399  -2.462  -5.138
  502   1HB   LEU  67          2HB       LEU  67  -6.823  -2.496  -3.560
  503   2HB   LEU  67          3HB       LEU  67  -6.940  -1.955  -5.231
  504    HG   LEU  67           HG       LEU  67  -8.716  -0.727  -3.088
  505   1HD1  LEU  67          1HD1      LEU  67  -6.125   0.478  -4.019
  506   2HD1  LEU  67          2HD1      LEU  67  -7.144   0.973  -2.660
  507   3HD1  LEU  67          3HD1      LEU  67  -6.195  -0.523  -2.557
  508   1HD2  LEU  67          1HD2      LEU  67  -7.738   0.241  -5.816
  509   2HD2  LEU  67          2HD2      LEU  67  -9.394  -0.256  -5.417
  510   3HD2  LEU  67          3HD2      LEU  67  -8.706   1.196  -4.679
  511    H    GLY  68           H        GLY  68  -8.484  -5.391  -3.555
  512   1HA   GLY  68          2HA       GLY  68  -8.628  -7.454  -4.545
  513   2HA   GLY  68          3HA       GLY  68  -8.433  -6.754  -6.156
  514    H    TYR  69           H        TYR  69  -6.306  -6.185  -3.328
  515    HA   TYR  69           HA       TYR  69  -4.115  -7.784  -4.593
  516   1HB   TYR  69          2HB       TYR  69  -4.247  -4.896  -3.849
  517   2HB   TYR  69          3HB       TYR  69  -2.886  -5.750  -3.155
  518    HD1  TYR  69           HD1      TYR  69  -0.918  -5.502  -4.355
  519    HD2  TYR  69           HD2      TYR  69  -4.645  -5.752  -6.510
  520    HE1  TYR  69           HE1      TYR  69   0.293  -5.310  -6.484
  521    HE2  TYR  69           HE2      TYR  69  -3.421  -5.675  -8.642
  522    HH   TYR  69           HH       TYR  69   0.148  -5.545  -8.797
  523    H    HIS  70           H        HIS  70  -2.391  -8.266  -2.919
  524    HA   HIS  70           HA       HIS  70  -3.443  -8.405  -0.146
  525   1HB   HIS  70          2HB       HIS  70  -3.829 -10.572  -1.336
  526   2HB   HIS  70          3HB       HIS  70  -2.086 -10.723  -1.572
  527    HD1  HIS  70           1HD      HIS  70  -1.671  -9.636   1.719
  528    HD2  HIS  70           2HD      HIS  70  -3.794 -12.879   0.047
  529    HE1  HIS  70           1HE      HIS  70  -1.942 -11.341   3.546
  530    H    VAL  71           H        VAL  71  -2.003  -7.369   1.079
  531    HA   VAL  71           HA       VAL  71   0.822  -7.070   0.247
  532    HB   VAL  71           HB       VAL  71  -0.533  -5.100   0.996
  533   1HG1  VAL  71          1HG1      VAL  71  -0.349  -6.297   3.793
  534   2HG1  VAL  71          2HG1      VAL  71  -1.027  -4.728   3.329
  535   3HG1  VAL  71          3HG1      VAL  71  -1.843  -6.220   2.841
  536   1HG2  VAL  71          1HG2      VAL  71   1.865  -5.774   2.703
  537   2HG2  VAL  71          2HG2      VAL  71   1.890  -5.058   1.073
  538   3HG2  VAL  71          3HG2      VAL  71   1.204  -4.147   2.427
  539    H    VAL  72           H        VAL  72   2.509  -7.949   1.605
  540    HA   VAL  72           HA       VAL  72   1.622  -9.916   3.672
  541    HB   VAL  72           HB       VAL  72   3.854 -10.298   1.752
  542   1HG1  VAL  72          1HG1      VAL  72   4.363 -11.350   3.898
  543   2HG1  VAL  72          2HG1      VAL  72   2.751 -12.099   3.944
  544   3HG1  VAL  72          3HG1      VAL  72   3.942 -12.597   2.726
  545   1HG2  VAL  72          1HG2      VAL  72   1.686 -10.636   0.608
  546   2HG2  VAL  72          2HG2      VAL  72   2.437 -12.210   0.910
  547   3HG2  VAL  72          3HG2      VAL  72   1.118 -11.649   1.954
  548    H    ILE  73           H        ILE  73   2.850 -10.013   5.461
  549    HA   ILE  73           HA       ILE  73   4.486  -7.566   5.990
  550    HB   ILE  73           HB       ILE  73   2.796  -9.103   7.958
  551   1HG1  ILE  73          2HG1      ILE  73   1.258  -8.182   6.344
  552   2HG1  ILE  73          3HG1      ILE  73   1.242  -7.248   7.833
  553   1HG2  ILE  73          1HG2      ILE  73   4.227  -6.406   8.054
  554   2HG2  ILE  73          2HG2      ILE  73   3.094  -6.999   9.286
  555   3HG2  ILE  73          3HG2      ILE  73   4.617  -7.840   9.002
  556   1HD1  ILE  73          1HD1      ILE  73   2.590  -5.462   6.775
  557   2HD1  ILE  73          2HD1      ILE  73   2.599  -6.384   5.255
  558   3HD1  ILE  73          3HD1      ILE  73   1.079  -5.774   5.914
  559    H    GLU  74           H        GLU  74   6.343  -8.973   5.149
  560    HA   GLU  74           HA       GLU  74   7.222 -11.099   6.703
  561   1HB   GLU  74          2HB       GLU  74   8.421  -9.365   4.553
  562   2HB   GLU  74          3HB       GLU  74   9.403 -10.552   5.404
  563   1HG   GLU  74          2HG       GLU  74   6.809 -11.355   4.045
  564   2HG   GLU  74          3HG       GLU  74   8.388 -11.386   3.241
  565    H    GLY  75           H        GLY  75   7.062  -8.076   7.695
  566   1HA   GLY  75          2HA       GLY  75   8.030  -6.836   9.430
  567   2HA   GLY  75          3HA       GLY  75   8.846  -8.326   9.936
  568    H    ARG  76           H        ARG  76   9.052  -5.478   7.811
  569    HA   ARG  76           HA       ARG  76  11.392  -6.230   6.469
  570   1HB   ARG  76          2HB       ARG  76   9.850  -4.367   5.735
  571   2HB   ARG  76          3HB       ARG  76  10.421  -3.409   7.113
  572   1HG   ARG  76          2HG       ARG  76  11.629  -2.630   5.189
  573   2HG   ARG  76          3HG       ARG  76  12.762  -3.526   6.170
  574   1HD   ARG  76          2HD       ARG  76  12.027  -5.581   4.567
  575   2HD   ARG  76          3HD       ARG  76  11.441  -4.283   3.550
  576    HE   ARG  76           HE       ARG  76  13.600  -3.761   2.988
  577   1HH1  ARG  76          2HH2      ARG  76  13.888  -5.533   6.101
  578   2HH1  ARG  76          1HH2      ARG  76  15.370  -6.279   5.678
  579   1HH2  ARG  76          2HH1      ARG  76  15.704  -4.597   2.555
  580   2HH2  ARG  76          1HH1      ARG  76  16.508  -5.591   3.729
  Start of MODEL   12
    1   1H    MET   1          H1        MET   1  -3.767  17.537  16.914
    2   2H    MET   1          H2        MET   1  -4.048  18.414  18.288
    3   3H    MET   1          H3        MET   1  -3.371  19.134  16.961
    4    HA   MET   1           HA       MET   1  -1.719  18.762  18.610
    5   1HB   MET   1          2HB       MET   1  -2.562  15.867  18.231
    6   2HB   MET   1          3HB       MET   1  -0.990  16.326  18.911
    7   1HG   MET   1          2HG       MET   1  -2.014  17.474  20.766
    8   2HG   MET   1          3HG       MET   1  -3.616  17.346  20.034
    9   1HE   MET   1          1HE       MET   1  -5.147  16.234  21.551
   10   2HE   MET   1          2HE       MET   1  -4.613  15.097  22.806
   11   3HE   MET   1          3HE       MET   1  -3.933  16.744  22.754
   12    H    LEU   2           H        LEU   2  -1.108  15.925  16.555
   13    HA   LEU   2           HA       LEU   2  -0.188  17.517  14.309
   14   1HB   LEU   2          2HB       LEU   2   2.149  16.734  14.538
   15   2HB   LEU   2          3HB       LEU   2   1.706  17.873  15.799
   16    HG   LEU   2           HG       LEU   2   1.201  15.061  16.618
   17   1HD1  LEU   2          1HD1      LEU   2   3.551  14.422  16.842
   18   2HD1  LEU   2          2HD1      LEU   2   3.073  14.625  15.148
   19   3HD1  LEU   2          3HD1      LEU   2   4.050  15.879  15.950
   20   1HD2  LEU   2          1HD2      LEU   2   1.236  17.011  18.180
   21   2HD2  LEU   2          2HD2      LEU   2   2.407  15.754  18.614
   22   3HD2  LEU   2          3HD2      LEU   2   2.958  17.241  17.817
   23    H    SER   3           H        SER   3   0.783  16.020  12.662
   24    HA   SER   3           HA       SER   3   0.051  13.155  13.014
   25   1HB   SER   3          2HB       SER   3  -0.046  14.527  10.287
   26   2HB   SER   3          3HB       SER   3  -0.602  12.945  10.753
   27    HG   SER   3           HG       SER   3  -1.666  15.407  11.722
   28    H    GLU   4           H        GLU   4   2.140  12.419  13.524
   29    HA   GLU   4           HA       GLU   4   4.511  13.196  12.044
   30   1HB   GLU   4          2HB       GLU   4   3.666  10.988  13.857
   31   2HB   GLU   4          3HB       GLU   4   5.163  10.856  12.963
   32   1HG   GLU   4          2HG       GLU   4   6.208  12.473  14.107
   33   2HG   GLU   4          3HG       GLU   4   4.739  13.374  14.447
   34    H    GLN   5           H        GLN   5   5.514  11.405  10.625
   35    HA   GLN   5           HA       GLN   5   3.501   9.775   9.178
   36   1HB   GLN   5          2HB       GLN   5   5.689  11.467   7.906
   37   2HB   GLN   5          3HB       GLN   5   4.767  10.174   7.128
   38   1HG   GLN   5          2HG       GLN   5   2.735  11.790   8.136
   39   2HG   GLN   5          3HG       GLN   5   3.972  12.976   7.701
   40   1HE2  GLN   5          1HE2      GLN   5   2.200  10.140   6.530
   41   2HE2  GLN   5          2HE2      GLN   5   2.287  10.478   4.843
   42    H    LYS   6           H        LYS   6   4.377   7.814   8.362
   43    HA   LYS   6           HA       LYS   6   7.231   7.306   8.818
   44   1HB   LYS   6          2HB       LYS   6   5.061   5.438   9.791
   45   2HB   LYS   6          3HB       LYS   6   6.774   5.037   9.728
   46   1HG   LYS   6          2HG       LYS   6   5.667   7.307  11.428
   47   2HG   LYS   6          3HG       LYS   6   5.941   5.657  12.001
   48   1HD   LYS   6          2HD       LYS   6   8.335   5.819  11.429
   49   2HD   LYS   6          3HD       LYS   6   8.104   7.474  10.836
   50   1HE   LYS   6          2HE       LYS   6   7.352   8.224  13.059
   51   2HE   LYS   6          3HE       LYS   6   7.513   6.577  13.698
   52   1HZ   LYS   6          1HZ       LYS   6   9.865   6.700  13.254
   53   2HZ   LYS   6          2HZ       LYS   6   9.714   8.219  12.635
   54   3HZ   LYS   6          3HZ       LYS   6   9.401   7.946  14.228
   55    H    GLU   7           H        GLU   7   8.063   5.760   7.578
   56    HA   GLU   7           HA       GLU   7   6.645   5.145   5.062
   57   1HB   GLU   7          2HB       GLU   7   9.610   4.810   5.288
   58   2HB   GLU   7          3HB       GLU   7   8.585   5.396   3.996
   59   1HG   GLU   7          2HG       GLU   7   9.820   7.260   4.637
   60   2HG   GLU   7          3HG       GLU   7   8.341   7.544   5.559
   61    H    ILE   8           H        ILE   8   5.596   3.203   5.659
   62    HA   ILE   8           HA       ILE   8   7.121   1.114   7.004
   63    HB   ILE   8           HB       ILE   8   4.407   0.940   5.847
   64   1HG1  ILE   8          2HG1      ILE   8   3.969   2.886   6.988
   65   2HG1  ILE   8          3HG1      ILE   8   3.423   1.555   8.018
   66   1HG2  ILE   8          1HG2      ILE   8   5.428  -1.087   6.718
   67   2HG2  ILE   8          2HG2      ILE   8   5.746  -0.270   8.252
   68   3HG2  ILE   8          3HG2      ILE   8   4.065  -0.604   7.743
   69   1HD1  ILE   8          1HD1      ILE   8   5.898   3.214   8.316
   70   2HD1  ILE   8          2HD1      ILE   8   4.537   3.030   9.448
   71   3HD1  ILE   8          3HD1      ILE   8   5.666   1.677   9.165
   72    H    ALA   9           H        ALA   9   7.289  -1.067   5.901
   73    HA   ALA   9           HA       ALA   9   7.336  -0.967   2.940
   74   1HB   ALA   9          1HB       ALA   9   9.653  -0.540   3.807
   75   2HB   ALA   9          2HB       ALA   9   9.571  -2.074   4.686
   76   3HB   ALA   9          3HB       ALA   9   9.502  -2.067   2.911
   77    H    MET  10           H        MET  10   6.325  -2.819   2.124
   78    HA   MET  10           HA       MET  10   6.382  -5.303   3.759
   79   1HB   MET  10          2HB       MET  10   3.830  -4.228   2.472
   80   2HB   MET  10          3HB       MET  10   4.047  -5.762   3.296
   81   1HG   MET  10          2HG       MET  10   3.017  -4.477   4.893
   82   2HG   MET  10          3HG       MET  10   4.708  -4.426   5.375
   83   1HE   MET  10          1HE       MET  10   1.592  -2.540   3.990
   84   2HE   MET  10          2HE       MET  10   2.222  -0.907   3.670
   85   3HE   MET  10          3HE       MET  10   2.694  -2.255   2.617
   86    H    GLN  11           H        GLN  11   5.575  -7.189   2.389
   87    HA   GLN  11           HA       GLN  11   6.837  -7.036  -0.298
   88   1HB   GLN  11          2HB       GLN  11   6.098  -9.257   1.660
   89   2HB   GLN  11          3HB       GLN  11   6.289  -9.633  -0.044
   90   1HG   GLN  11          2HG       GLN  11   8.385  -8.439   1.824
   91   2HG   GLN  11          3HG       GLN  11   8.359 -10.086   1.172
   92   1HE2  GLN  11          1HE2      GLN  11   7.728  -9.741  -1.481
   93   2HE2  GLN  11          2HE2      GLN  11   8.680  -8.496  -2.258
   94    H    VAL  12           H        VAL  12   5.670  -8.075  -2.104
   95    HA   VAL  12           HA       VAL  12   2.719  -7.584  -1.927
   96    HB   VAL  12           HB       VAL  12   4.636  -7.216  -4.262
   97   1HG1  VAL  12          1HG1      VAL  12   2.457  -7.939  -5.102
   98   2HG1  VAL  12          2HG1      VAL  12   1.622  -6.791  -4.028
   99   3HG1  VAL  12          3HG1      VAL  12   2.621  -6.207  -5.371
  100   1HG2  VAL  12          1HG2      VAL  12   4.897  -5.422  -2.633
  101   2HG2  VAL  12          2HG2      VAL  12   3.953  -4.796  -3.986
  102   3HG2  VAL  12          3HG2      VAL  12   3.130  -5.246  -2.486
  103    H    SER  13           H        SER  13   1.320  -9.099  -2.834
  104    HA   SER  13           HA       SER  13   2.317 -11.314  -4.437
  105   1HB   SER  13          2HB       SER  13   1.026 -11.661  -1.696
  106   2HB   SER  13          3HB       SER  13   0.893 -12.908  -2.942
  107    HG   SER  13           HG       SER  13   2.712 -13.285  -1.639
  108    H    GLY  14           H        GLY  14   0.279 -12.630  -5.091
  109   1HA   GLY  14          2HA       GLY  14  -1.735 -12.688  -6.177
  110   2HA   GLY  14          3HA       GLY  14  -2.343 -11.693  -4.839
  111    H    MET  15           H        MET  15  -0.080 -11.199  -7.585
  112    HA   MET  15           HA       MET  15  -1.434  -8.626  -8.240
  113   1HB   MET  15          2HB       MET  15   0.708  -7.592  -8.422
  114   2HB   MET  15          3HB       MET  15   0.691  -8.462  -6.882
  115   1HG   MET  15          2HG       MET  15   2.779  -9.020  -7.698
  116   2HG   MET  15          3HG       MET  15   1.834 -10.374  -8.322
  117   1HE   MET  15          1HE       MET  15   4.190 -10.594  -9.832
  118   2HE   MET  15          2HE       MET  15   2.664 -11.200 -10.535
  119   3HE   MET  15          3HE       MET  15   3.786 -10.255 -11.535
  120    H    THR  16           H        THR  16  -1.438  -8.045 -10.459
  121    HA   THR  16           HA       THR  16  -0.906 -10.204 -12.407
  122    HB   THR  16           HB       THR  16  -1.843  -8.134 -13.872
  123    HG1  THR  16           1HG      THR  16  -3.344  -7.806 -11.535
  124   1HG2  THR  16          1HG2      THR  16  -3.512 -10.028 -12.143
  125   2HG2  THR  16          2HG2      THR  16  -4.123  -9.097 -13.535
  126   3HG2  THR  16          3HG2      THR  16  -2.885 -10.340 -13.775
  127    H    CYS  17           H        CYS  17  -0.075  -6.668 -11.997
  128    HA   CYS  17           HA       CYS  17   2.677  -7.312 -12.611
  129   1HB   CYS  17          2HB       CYS  17   2.929  -6.020 -14.616
  130   2HB   CYS  17          3HB       CYS  17   1.636  -7.186 -14.903
  131    H    ALA  18           H        ALA  18   3.998  -5.307 -12.711
  132    HA   ALA  18           HA       ALA  18   3.754  -3.853 -10.339
  133   1HB   ALA  18          1HB       ALA  18   5.879  -4.232 -11.530
  134   2HB   ALA  18          2HB       ALA  18   5.342  -3.169 -12.848
  135   3HB   ALA  18          3HB       ALA  18   5.620  -2.503 -11.225
  136    H    ALA  19           H        ALA  19   2.527  -3.095 -13.584
  137    HA   ALA  19           HA       ALA  19   2.020  -0.313 -13.080
  138   1HB   ALA  19          1HB       ALA  19   0.622  -0.381 -15.048
  139   2HB   ALA  19          2HB       ALA  19   2.100  -1.316 -15.354
  140   3HB   ALA  19          3HB       ALA  19   0.565  -2.151 -15.022
  141    H    CYS  20           H        CYS  20  -0.087  -3.266 -12.812
  142    HA   CYS  20           HA       CYS  20  -2.288  -1.826 -11.682
  143   1HB   CYS  20          2HB       CYS  20  -1.519  -4.768 -11.363
  144   2HB   CYS  20          3HB       CYS  20  -3.086  -4.041 -10.964
  145    H    ALA  21           H        ALA  21   0.556  -3.437 -10.245
  146    HA   ALA  21           HA       ALA  21  -0.098  -2.949  -7.556
  147   1HB   ALA  21          1HB       ALA  21   1.905  -4.246  -8.614
  148   2HB   ALA  21          2HB       ALA  21   2.746  -2.683  -8.507
  149   3HB   ALA  21          3HB       ALA  21   2.092  -3.462  -7.047
  150    H    ALA  22           H        ALA  22   0.788  -0.542 -10.013
  151    HA   ALA  22           HA       ALA  22   1.326   1.571  -8.064
  152   1HB   ALA  22          1HB       ALA  22   0.364   1.889 -10.925
  153   2HB   ALA  22          2HB       ALA  22   1.195   3.072  -9.911
  154   3HB   ALA  22          3HB       ALA  22   2.069   1.633 -10.479
  155    H    ARG  23           H        ARG  23  -1.519   0.341  -9.829
  156    HA   ARG  23           HA       ARG  23  -3.283   2.493  -9.255
  157   1HB   ARG  23          2HB       ARG  23  -3.918  -0.461  -9.639
  158   2HB   ARG  23          3HB       ARG  23  -5.101   0.848  -9.644
  159   1HG   ARG  23          2HG       ARG  23  -4.078   1.887 -11.576
  160   2HG   ARG  23          3HG       ARG  23  -2.744   0.722 -11.570
  161   1HD   ARG  23          2HD       ARG  23  -3.913  -0.679 -12.896
  162   2HD   ARG  23          3HD       ARG  23  -5.087  -0.878 -11.614
  163    HE   ARG  23           HE       ARG  23  -6.585   0.295 -12.840
  164   1HH1  ARG  23          2HH2      ARG  23  -3.372   1.298 -13.809
  165   2HH1  ARG  23          1HH2      ARG  23  -3.867   2.252 -15.176
  166   1HH2  ARG  23          2HH1      ARG  23  -7.331   1.520 -14.671
  167   2HH2  ARG  23          1HH1      ARG  23  -6.203   2.382 -15.664
  168    H    ILE  24           H        ILE  24  -2.523  -0.494  -7.401
  169    HA   ILE  24           HA       ILE  24  -4.414   0.092  -5.378
  170    HB   ILE  24           HB       ILE  24  -3.598  -1.566  -4.041
  171   1HG1  ILE  24          2HG1      ILE  24  -1.031  -1.266  -5.504
  172   2HG1  ILE  24          3HG1      ILE  24  -1.374  -1.098  -3.768
  173   1HG2  ILE  24          1HG2      ILE  24  -3.798  -3.368  -5.460
  174   2HG2  ILE  24          2HG2      ILE  24  -4.600  -2.095  -6.372
  175   3HG2  ILE  24          3HG2      ILE  24  -2.952  -2.584  -6.821
  176   1HD1  ILE  24          1HD1      ILE  24  -1.841  -3.562  -3.690
  177   2HD1  ILE  24          2HD1      ILE  24  -1.293  -3.634  -5.391
  178   3HD1  ILE  24          3HD1      ILE  24  -0.163  -3.156  -4.120
  179    H    GLU  25           H        GLU  25  -0.832   0.684  -5.113
  180    HA   GLU  25           HA       GLU  25  -1.008   2.183  -2.781
  181   1HB   GLU  25          2HB       GLU  25   0.974   1.990  -5.000
  182   2HB   GLU  25          3HB       GLU  25   1.091   3.429  -3.966
  183   1HG   GLU  25          2HG       GLU  25   2.481   1.534  -3.130
  184   2HG   GLU  25          3HG       GLU  25   1.291   2.085  -1.952
  185    H    LYS  26           H        LYS  26  -1.590   3.366  -6.091
  186    HA   LYS  26           HA       LYS  26  -1.695   6.152  -5.226
  187   1HB   LYS  26          2HB       LYS  26  -2.412   4.702  -7.779
  188   2HB   LYS  26          3HB       LYS  26  -2.955   6.355  -7.497
  189   1HG   LYS  26          2HG       LYS  26  -0.904   6.447  -8.729
  190   2HG   LYS  26          3HG       LYS  26  -0.648   7.125  -7.113
  191   1HD   LYS  26          2HD       LYS  26   0.502   5.083  -6.407
  192   2HD   LYS  26          3HD       LYS  26   0.182   4.358  -8.001
  193   1HE   LYS  26          2HE       LYS  26   1.537   5.946  -9.156
  194   2HE   LYS  26          3HE       LYS  26   1.746   6.941  -7.703
  195   1HZ   LYS  26          1HZ       LYS  26   2.752   4.188  -7.987
  196   2HZ   LYS  26          2HZ       LYS  26   3.653   5.549  -8.189
  197   3HZ   LYS  26          3HZ       LYS  26   3.007   5.210  -6.715
  198    H    GLY  27           H        GLY  27  -4.266   3.696  -5.937
  199   1HA   GLY  27          2HA       GLY  27  -6.427   5.442  -5.142
  200   2HA   GLY  27          3HA       GLY  27  -6.493   3.686  -5.311
  201    H    LEU  28           H        LEU  28  -4.171   3.400  -3.387
  202    HA   LEU  28           HA       LEU  28  -5.595   3.328  -0.910
  203   1HB   LEU  28          2HB       LEU  28  -3.883   1.690  -1.561
  204   2HB   LEU  28          3HB       LEU  28  -2.642   2.942  -1.544
  205    HG   LEU  28           HG       LEU  28  -2.737   1.307   0.381
  206   1HD1  LEU  28          1HD1      LEU  28  -2.929   4.230   1.236
  207   2HD1  LEU  28          2HD1      LEU  28  -2.071   2.914   2.038
  208   3HD1  LEU  28          3HD1      LEU  28  -1.509   3.496   0.466
  209   1HD2  LEU  28          1HD2      LEU  28  -5.130   1.274   0.579
  210   2HD2  LEU  28          2HD2      LEU  28  -4.354   1.624   2.120
  211   3HD2  LEU  28          3HD2      LEU  28  -5.163   2.927   1.243
  212    H    LYS  29           H        LYS  29  -2.934   5.411  -2.233
  213    HA   LYS  29           HA       LYS  29  -2.499   7.048  -0.088
  214   1HB   LYS  29          2HB       LYS  29  -1.443   7.197  -2.427
  215   2HB   LYS  29          3HB       LYS  29  -2.836   8.198  -2.883
  216   1HG   LYS  29          2HG       LYS  29  -2.225   9.628  -0.767
  217   2HG   LYS  29          3HG       LYS  29  -0.725   8.723  -0.763
  218   1HD   LYS  29          2HD       LYS  29  -1.821  10.544  -2.965
  219   2HD   LYS  29          3HD       LYS  29  -0.534  10.925  -1.825
  220   1HE   LYS  29          2HE       LYS  29   0.606   8.738  -2.918
  221   2HE   LYS  29          3HE       LYS  29  -0.477   9.144  -4.255
  222   1HZ   LYS  29          1HZ       LYS  29   1.821  10.554  -3.182
  223   2HZ   LYS  29          2HZ       LYS  29   1.414  10.348  -4.727
  224   3HZ   LYS  29          3HZ       LYS  29   0.642  11.505  -3.826
  225    H    ARG  30           H        ARG  30  -5.270   7.200  -2.283
  226    HA   ARG  30           HA       ARG  30  -6.310   9.648  -1.272
  227   1HB   ARG  30          2HB       ARG  30  -6.983   7.746  -3.347
  228   2HB   ARG  30          3HB       ARG  30  -8.429   8.019  -2.391
  229   1HG   ARG  30          2HG       ARG  30  -7.868  10.553  -2.593
  230   2HG   ARG  30          3HG       ARG  30  -6.687  10.061  -3.829
  231   1HD   ARG  30          2HD       ARG  30  -8.557   9.011  -5.122
  232   2HD   ARG  30          3HD       ARG  30  -9.679   9.499  -3.822
  233    HE   ARG  30           HE       ARG  30  -8.147  11.724  -4.874
  234   1HH1  ARG  30          2HH2      ARG  30 -10.980   9.731  -5.511
  235   2HH1  ARG  30          1HH2      ARG  30 -11.881  10.969  -6.330
  236   1HH2  ARG  30          2HH1      ARG  30  -9.296  13.402  -5.972
  237   2HH2  ARG  30          1HH1      ARG  30 -10.875  13.106  -6.619
  238    H    MET  31           H        MET  31  -6.170   6.785   0.473
  239    HA   MET  31           HA       MET  31  -8.785   6.819   1.690
  240   1HB   MET  31          2HB       MET  31  -7.900   5.053   3.035
  241   2HB   MET  31          3HB       MET  31  -7.160   4.872   1.456
  242   1HG   MET  31          2HG       MET  31  -5.158   4.892   2.445
  243   2HG   MET  31          3HG       MET  31  -5.390   6.545   2.940
  244   1HE   MET  31          1HE       MET  31  -6.280   2.800   3.828
  245   2HE   MET  31          2HE       MET  31  -4.531   3.157   3.828
  246   3HE   MET  31          3HE       MET  31  -5.332   2.759   5.335
  247    HA   PRO  32           HA       PRO  32  -7.847   9.858   4.898
  248   1HB   PRO  32          2HB       PRO  32  -9.213   9.033   7.084
  249   2HB   PRO  32          3HB       PRO  32 -10.035   9.624   5.610
  250   1HG   PRO  32          2HG       PRO  32  -9.541   6.747   6.416
  251   2HG   PRO  32          3HG       PRO  32 -11.051   7.497   5.836
  252   1HD   PRO  32          2HD       PRO  32  -9.344   6.111   4.212
  253   2HD   PRO  32          3HD       PRO  32 -10.303   7.485   3.597
  254    H    GLY  33           H        GLY  33  -5.856   9.939   5.708
  255   1HA   GLY  33          2HA       GLY  33  -4.538   9.624   7.630
  256   2HA   GLY  33          3HA       GLY  33  -4.929   7.907   7.692
  257    H    VAL  34           H        VAL  34  -4.325   7.989   4.540
  258    HA   VAL  34           HA       VAL  34  -1.356   7.859   4.823
  259    HB   VAL  34           HB       VAL  34  -3.161   7.037   2.543
  260   1HG1  VAL  34          1HG1      VAL  34  -1.055   6.030   1.614
  261   2HG1  VAL  34          2HG1      VAL  34  -1.017   7.795   1.636
  262   3HG1  VAL  34          3HG1      VAL  34  -0.133   6.877   2.871
  263   1HG2  VAL  34          1HG2      VAL  34  -3.125   4.942   3.426
  264   2HG2  VAL  34          2HG2      VAL  34  -1.415   5.012   3.799
  265   3HG2  VAL  34          3HG2      VAL  34  -2.590   5.661   4.946
  266    H    THR  35           H        THR  35  -0.013   9.260   3.684
  267    HA   THR  35           HA       THR  35  -1.358  11.585   2.361
  268    HB   THR  35           HB       THR  35   0.666  11.526   4.492
  269    HG1  THR  35           1HG      THR  35  -1.196  12.256   5.136
  270   1HG2  THR  35          1HG2      THR  35   1.395  13.811   3.904
  271   2HG2  THR  35          2HG2      THR  35   1.995  12.602   2.760
  272   3HG2  THR  35          3HG2      THR  35   0.614  13.646   2.312
  273    H    ASP  36           H        ASP  36   1.461   9.275   2.218
  274    HA   ASP  36           HA       ASP  36   1.241   9.692  -0.612
  275   1HB   ASP  36          2HB       ASP  36   3.324  11.092   0.484
  276   2HB   ASP  36          3HB       ASP  36   4.115   9.550   0.095
  277    H    ALA  37           H        ALA  37   2.589   8.055  -1.796
  278    HA   ALA  37           HA       ALA  37   3.039   5.555  -0.446
  279   1HB   ALA  37          1HB       ALA  37   1.178   4.232  -1.336
  280   2HB   ALA  37          2HB       ALA  37   0.539   5.562  -0.360
  281   3HB   ALA  37          3HB       ALA  37   0.504   5.671  -2.133
  282    H    ASN  38           H        ASN  38   4.025   3.916  -1.745
  283    HA   ASN  38           HA       ASN  38   4.672   4.636  -4.529
  284   1HB   ASN  38          2HB       ASN  38   7.213   4.355  -3.328
  285   2HB   ASN  38          3HB       ASN  38   6.505   5.783  -4.054
  286   1HD2  ASN  38          1HD2      ASN  38   5.920   4.142  -0.869
  287   2HD2  ASN  38          2HD2      ASN  38   6.328   5.582   0.063
  288    H    VAL  39           H        VAL  39   4.296   2.659  -5.370
  289    HA   VAL  39           HA       VAL  39   4.948   0.256  -3.912
  290    HB   VAL  39           HB       VAL  39   2.984   0.378  -5.222
  291   1HG1  VAL  39          1HG1      VAL  39   4.714   0.862  -7.695
  292   2HG1  VAL  39          2HG1      VAL  39   3.086   0.258  -7.723
  293   3HG1  VAL  39          3HG1      VAL  39   3.408   1.861  -7.037
  294   1HG2  VAL  39          1HG2      VAL  39   4.248  -1.761  -4.895
  295   2HG2  VAL  39          2HG2      VAL  39   3.131  -1.717  -6.263
  296   3HG2  VAL  39          3HG2      VAL  39   4.873  -1.545  -6.553
  297    H    ASN  40           H        ASN  40   7.104  -0.289  -3.641
  298    HA   ASN  40           HA       ASN  40   9.065   0.369  -5.757
  299   1HB   ASN  40          2HB       ASN  40   9.543   0.835  -3.380
  300   2HB   ASN  40          3HB       ASN  40   9.442  -0.893  -3.024
  301   1HD2  ASN  40          1HD2      ASN  40  11.748  -0.180  -2.238
  302   2HD2  ASN  40          2HD2      ASN  40  13.026  -0.362  -3.428
  303    H    LEU  41           H        LEU  41   7.424  -1.191  -6.954
  304    HA   LEU  41           HA       LEU  41   7.755  -4.006  -6.512
  305   1HB   LEU  41          2HB       LEU  41   6.131  -2.338  -8.173
  306   2HB   LEU  41          3HB       LEU  41   6.965  -3.422  -9.255
  307    HG   LEU  41           HG       LEU  41   4.711  -4.129  -8.395
  308   1HD1  LEU  41          1HD1      LEU  41   5.333  -6.527  -8.185
  309   2HD1  LEU  41          2HD1      LEU  41   6.125  -5.713  -9.546
  310   3HD1  LEU  41          3HD1      LEU  41   7.036  -6.041  -8.065
  311   1HD2  LEU  41          1HD2      LEU  41   5.944  -5.273  -5.917
  312   2HD2  LEU  41          2HD2      LEU  41   5.399  -3.598  -5.886
  313   3HD2  LEU  41          3HD2      LEU  41   4.269  -4.894  -6.312
  314    H    ALA  42           H        ALA  42   9.711  -1.706  -8.127
  315    HA   ALA  42           HA       ALA  42  11.346  -3.164  -9.834
  316   1HB   ALA  42          1HB       ALA  42  13.154  -1.713  -9.088
  317   2HB   ALA  42          2HB       ALA  42  11.657  -0.753  -9.204
  318   3HB   ALA  42          3HB       ALA  42  12.266  -1.300  -7.616
  319    H    THR  43           H        THR  43  11.067  -3.428  -6.269
  320    HA   THR  43           HA       THR  43  12.707  -5.878  -6.481
  321    HB   THR  43           HB       THR  43  14.086  -4.062  -5.664
  322    HG1  THR  43           1HG      THR  43  14.482  -6.212  -5.064
  323   1HG2  THR  43          1HG2      THR  43  12.290  -2.853  -4.328
  324   2HG2  THR  43          2HG2      THR  43  12.496  -4.097  -3.077
  325   3HG2  THR  43          3HG2      THR  43  13.855  -3.058  -3.516
  326    H    GLU  44           H        GLU  44   9.992  -5.768  -6.780
  327    HA   GLU  44           HA       GLU  44   7.943  -6.260  -5.957
  328   1HB   GLU  44          2HB       GLU  44   9.635  -8.544  -4.897
  329   2HB   GLU  44          3HB       GLU  44   7.866  -8.537  -4.972
  330   1HG   GLU  44          2HG       GLU  44   8.050  -8.018  -7.466
  331   2HG   GLU  44          3HG       GLU  44   9.760  -8.464  -7.327
  332    H    THR  45           H        THR  45   8.911  -4.237  -4.280
  333    HA   THR  45           HA       THR  45   7.850  -5.026  -1.601
  334    HB   THR  45           HB       THR  45  10.021  -3.052  -2.440
  335    HG1  THR  45           1HG      THR  45  10.570  -5.330  -2.365
  336   1HG2  THR  45          1HG2      THR  45   8.840  -2.159  -0.478
  337   2HG2  THR  45          2HG2      THR  45   8.942  -3.761   0.312
  338   3HG2  THR  45          3HG2      THR  45  10.414  -2.817   0.001
  339    H    VAL  46           H        VAL  46   6.589  -3.331  -0.541
  340    HA   VAL  46           HA       VAL  46   5.654  -1.099  -2.297
  341    HB   VAL  46           HB       VAL  46   3.816  -2.531  -2.352
  342   1HG1  VAL  46          1HG1      VAL  46   2.810  -3.605  -0.320
  343   2HG1  VAL  46          2HG1      VAL  46   4.426  -4.226  -0.651
  344   3HG1  VAL  46          3HG1      VAL  46   4.189  -3.025   0.634
  345   1HG2  VAL  46          1HG2      VAL  46   2.099  -1.429  -1.073
  346   2HG2  VAL  46          2HG2      VAL  46   3.266  -0.758   0.066
  347   3HG2  VAL  46          3HG2      VAL  46   3.279  -0.214  -1.628
  348    H    ASN  47           H        ASN  47   5.537   0.953  -1.265
  349    HA   ASN  47           HA       ASN  47   6.164   0.966   1.623
  350   1HB   ASN  47          2HB       ASN  47   7.414   2.588  -0.639
  351   2HB   ASN  47          3HB       ASN  47   7.363   3.190   1.021
  352   1HD2  ASN  47          1HD2      ASN  47   8.210   1.584   2.743
  353   2HD2  ASN  47          2HD2      ASN  47   9.797   0.965   2.314
  354    H    VAL  48           H        VAL  48   4.950   2.525   2.788
  355    HA   VAL  48           HA       VAL  48   3.013   4.135   1.230
  356    HB   VAL  48           HB       VAL  48   2.275   2.366   3.582
  357   1HG1  VAL  48          1HG1      VAL  48   0.535   4.033   1.708
  358   2HG1  VAL  48          2HG1      VAL  48   0.016   3.141   3.156
  359   3HG1  VAL  48          3HG1      VAL  48   1.039   4.579   3.313
  360   1HG2  VAL  48          1HG2      VAL  48   0.834   1.154   1.948
  361   2HG2  VAL  48          2HG2      VAL  48   1.614   2.043   0.625
  362   3HG2  VAL  48          3HG2      VAL  48   2.557   0.925   1.636
  363    H    ILE  49           H        ILE  49   3.080   6.178   2.000
  364    HA   ILE  49           HA       ILE  49   4.713   6.679   4.395
  365    HB   ILE  49           HB       ILE  49   3.941   8.686   2.241
  366   1HG1  ILE  49          2HG1      ILE  49   5.153   7.000   1.047
  367   2HG1  ILE  49          3HG1      ILE  49   6.185   8.406   1.286
  368   1HG2  ILE  49          1HG2      ILE  49   6.034   8.683   4.453
  369   2HG2  ILE  49          2HG2      ILE  49   5.955   9.879   3.141
  370   3HG2  ILE  49          3HG2      ILE  49   4.623   9.729   4.291
  371   1HD1  ILE  49          1HD1      ILE  49   7.499   6.417   1.729
  372   2HD1  ILE  49          2HD1      ILE  49   7.223   7.266   3.267
  373   3HD1  ILE  49          3HD1      ILE  49   6.286   5.812   2.873
  374    H    TYR  50           H        TYR  50   3.127   6.434   5.981
  375    HA   TYR  50           HA       TYR  50   0.653   8.107   5.702
  376   1HB   TYR  50          2HB       TYR  50  -0.703   6.409   6.526
  377   2HB   TYR  50          3HB       TYR  50   0.168   5.779   5.168
  378    HD1  TYR  50           HD1      TYR  50   0.140   5.829   8.941
  379    HD2  TYR  50           HD2      TYR  50   1.187   3.623   5.392
  380    HE1  TYR  50           HE1      TYR  50   0.564   3.847  10.306
  381    HE2  TYR  50           HE2      TYR  50   1.260   1.548   6.731
  382    HH   TYR  50           HH       TYR  50   1.190   1.549  10.227
  383    H    ASP  51           H        ASP  51  -0.490   8.403   7.617
  384    HA   ASP  51           HA       ASP  51   1.401   9.349   9.631
  385   1HB   ASP  51          2HB       ASP  51  -1.538   9.983   9.305
  386   2HB   ASP  51          3HB       ASP  51  -0.334  10.782  10.339
  387    HA   PRO  52           HA       PRO  52   0.021   5.685  11.880
  388   1HB   PRO  52          2HB       PRO  52   1.840   5.548  13.878
  389   2HB   PRO  52          3HB       PRO  52   2.255   5.221  12.171
  390   1HG   PRO  52          2HG       PRO  52   2.553   7.858  13.652
  391   2HG   PRO  52          3HG       PRO  52   3.823   6.968  12.766
  392   1HD   PRO  52          2HD       PRO  52   2.419   8.957  11.600
  393   2HD   PRO  52          3HD       PRO  52   2.810   7.486  10.658
  394    H    ALA  53           H        ALA  53  -0.639   8.825  12.671
  395    HA   ALA  53           HA       ALA  53  -1.700   8.349  15.381
  396   1HB   ALA  53          1HB       ALA  53  -0.683  10.546  14.862
  397   2HB   ALA  53          2HB       ALA  53  -1.804  10.746  13.495
  398   3HB   ALA  53          3HB       ALA  53  -2.428  10.692  15.156
  399    H    GLU  54           H        GLU  54  -2.469   8.163  11.952
  400    HA   GLU  54           HA       GLU  54  -5.354   8.140  12.553
  401   1HB   GLU  54          2HB       GLU  54  -4.365  10.119  11.303
  402   2HB   GLU  54          3HB       GLU  54  -4.122   9.045   9.927
  403   1HG   GLU  54          2HG       GLU  54  -6.543   8.643   9.786
  404   2HG   GLU  54          3HG       GLU  54  -6.807   9.448  11.343
  405    H    THR  55           H        THR  55  -2.882   6.867  10.281
  406    HA   THR  55           HA       THR  55  -4.363   4.324  10.169
  407    HB   THR  55           HB       THR  55  -2.433   3.836   8.316
  408    HG1  THR  55           1HG      THR  55  -3.006   6.573   8.139
  409   1HG2  THR  55          1HG2      THR  55  -4.794   3.545   8.070
  410   2HG2  THR  55          2HG2      THR  55  -5.078   5.314   7.926
  411   3HG2  THR  55          3HG2      THR  55  -4.105   4.440   6.699
  412    H    GLY  56           H        GLY  56  -2.499   2.559   9.792
  413   1HA   GLY  56          2HA       GLY  56  -0.575   1.902  11.564
  414   2HA   GLY  56          3HA       GLY  56  -1.968   2.206  12.624
  415    H    THR  57           H        THR  57  -0.981   0.592   9.900
  416    HA   THR  57           HA       THR  57  -1.584  -0.409   8.208
  417    HB   THR  57           HB       THR  57  -1.335  -2.884   8.491
  418    HG1  THR  57           1HG      THR  57  -1.457  -2.180  11.237
  419   1HG2  THR  57          1HG2      THR  57   0.730  -1.491   8.489
  420   2HG2  THR  57          2HG2      THR  57   0.614  -1.315  10.254
  421   3HG2  THR  57          3HG2      THR  57   0.869  -2.913   9.542
  422    H    ALA  58           H        ALA  58  -3.887  -1.058  10.753
  423    HA   ALA  58           HA       ALA  58  -5.940  -2.426   9.964
  424   1HB   ALA  58          1HB       ALA  58  -5.910  -0.882  11.868
  425   2HB   ALA  58          2HB       ALA  58  -5.887   0.505  10.777
  426   3HB   ALA  58          3HB       ALA  58  -7.348  -0.515  10.881
  427    H    ALA  59           H        ALA  59  -5.443   0.809   8.501
  428    HA   ALA  59           HA       ALA  59  -7.950   0.229   6.977
  429   1HB   ALA  59          1HB       ALA  59  -7.935   2.496   6.145
  430   2HB   ALA  59          2HB       ALA  59  -8.021   2.370   7.909
  431   3HB   ALA  59          3HB       ALA  59  -6.515   2.859   7.133
  432    H    ILE  60           H        ILE  60  -4.541   0.127   6.637
  433    HA   ILE  60           HA       ILE  60  -4.454   0.238   3.761
  434    HB   ILE  60           HB       ILE  60  -2.525  -0.404   6.002
  435   1HG1  ILE  60          2HG1      ILE  60  -1.157   1.045   4.238
  436   2HG1  ILE  60          3HG1      ILE  60  -2.746   1.455   3.649
  437   1HG2  ILE  60          1HG2      ILE  60  -0.794  -1.142   4.559
  438   2HG2  ILE  60          2HG2      ILE  60  -2.109  -2.307   4.521
  439   3HG2  ILE  60          3HG2      ILE  60  -1.897  -1.183   3.153
  440   1HD1  ILE  60          1HD1      ILE  60  -3.259   2.189   6.093
  441   2HD1  ILE  60          2HD1      ILE  60  -1.584   1.774   6.488
  442   3HD1  ILE  60          3HD1      ILE  60  -1.916   3.094   5.358
  443    H    GLN  61           H        GLN  61  -4.540  -2.434   6.168
  444    HA   GLN  61           HA       GLN  61  -4.385  -4.416   4.075
  445   1HB   GLN  61          2HB       GLN  61  -4.762  -4.428   6.972
  446   2HB   GLN  61          3HB       GLN  61  -5.841  -5.554   6.136
  447   1HG   GLN  61          2HG       GLN  61  -4.054  -6.893   6.591
  448   2HG   GLN  61          3HG       GLN  61  -3.825  -6.482   4.893
  449   1HE2  GLN  61          1HE2      GLN  61  -2.898  -3.634   6.154
  450   2HE2  GLN  61          2HE2      GLN  61  -1.234  -4.002   6.566
  451    H    GLU  62           H        GLU  62  -7.154  -2.914   5.831
  452    HA   GLU  62           HA       GLU  62  -9.318  -4.109   4.555
  453   1HB   GLU  62          2HB       GLU  62  -8.761  -1.321   5.635
  454   2HB   GLU  62          3HB       GLU  62 -10.307  -1.700   4.869
  455   1HG   GLU  62          2HG       GLU  62 -10.627  -3.576   6.481
  456   2HG   GLU  62          3HG       GLU  62  -9.130  -3.092   7.303
  457    H    LYS  63           H        LYS  63  -7.631  -1.098   3.415
  458    HA   LYS  63           HA       LYS  63  -9.184  -1.002   1.064
  459   1HB   LYS  63          2HB       LYS  63  -6.753   0.370   2.143
  460   2HB   LYS  63          3HB       LYS  63  -7.016   0.382   0.421
  461   1HG   LYS  63          2HG       LYS  63  -9.147   1.253   2.382
  462   2HG   LYS  63          3HG       LYS  63  -7.953   2.372   1.702
  463   1HD   LYS  63          2HD       LYS  63  -9.753   0.711  -0.110
  464   2HD   LYS  63          3HD       LYS  63 -10.258   2.269   0.551
  465   1HE   LYS  63          2HE       LYS  63  -8.488   3.462  -0.535
  466   2HE   LYS  63          3HE       LYS  63  -7.617   1.983  -0.940
  467   1HZ   LYS  63          1HZ       LYS  63 -10.207   2.731  -2.090
  468   2HZ   LYS  63          2HZ       LYS  63  -8.733   2.917  -2.800
  469   3HZ   LYS  63          3HZ       LYS  63  -9.306   1.404  -2.476
  470    H    ILE  64           H        ILE  64  -6.055  -2.580   1.775
  471    HA   ILE  64           HA       ILE  64  -5.021  -3.040  -0.757
  472    HB   ILE  64           HB       ILE  64  -4.824  -4.140   1.950
  473   1HG1  ILE  64          2HG1      ILE  64  -3.476  -2.259   1.178
  474   2HG1  ILE  64          3HG1      ILE  64  -2.562  -3.666   1.719
  475   1HG2  ILE  64          1HG2      ILE  64  -3.956  -5.821  -0.366
  476   2HG2  ILE  64          2HG2      ILE  64  -3.279  -5.928   1.282
  477   3HG2  ILE  64          3HG2      ILE  64  -4.995  -6.241   1.018
  478   1HD1  ILE  64          1HD1      ILE  64  -2.411  -4.307  -0.771
  479   2HD1  ILE  64          2HD1      ILE  64  -2.933  -2.640  -1.094
  480   3HD1  ILE  64          3HD1      ILE  64  -1.449  -2.933  -0.168
  481    H    GLU  65           H        GLU  65  -7.230  -5.070   1.303
  482    HA   GLU  65           HA       GLU  65  -7.905  -7.060  -0.602
  483   1HB   GLU  65          2HB       GLU  65  -9.412  -5.886   1.770
  484   2HB   GLU  65          3HB       GLU  65 -10.034  -7.233   0.814
  485   1HG   GLU  65          2HG       GLU  65  -7.219  -7.558   1.786
  486   2HG   GLU  65          3HG       GLU  65  -8.488  -7.553   3.018
  487    H    LYS  66           H        LYS  66  -9.694  -4.042   0.232
  488    HA   LYS  66           HA       LYS  66 -11.719  -4.342  -1.679
  489   1HB   LYS  66          2HB       LYS  66 -10.650  -2.175  -0.016
  490   2HB   LYS  66          3HB       LYS  66 -11.260  -1.538  -1.538
  491   1HG   LYS  66          2HG       LYS  66 -12.832  -3.394   0.288
  492   2HG   LYS  66          3HG       LYS  66 -12.902  -1.627   0.383
  493   1HD   LYS  66          2HD       LYS  66 -13.662  -1.497  -1.984
  494   2HD   LYS  66          3HD       LYS  66 -13.602  -3.259  -2.100
  495   1HE   LYS  66          2HE       LYS  66 -15.199  -3.061   0.088
  496   2HE   LYS  66          3HE       LYS  66 -15.552  -1.482  -0.627
  497   1HZ   LYS  66          1HZ       LYS  66 -17.075  -3.159  -1.377
  498   2HZ   LYS  66          2HZ       LYS  66 -16.168  -2.673  -2.662
  499   3HZ   LYS  66          3HZ       LYS  66 -15.859  -4.114  -1.926
  500    H    LEU  67           H        LEU  67  -8.496  -3.020  -2.155
  501    HA   LEU  67           HA       LEU  67  -8.885  -2.099  -4.870
  502   1HB   LEU  67          2HB       LEU  67  -6.464  -2.609  -3.129
  503   2HB   LEU  67          3HB       LEU  67  -6.337  -2.019  -4.784
  504    HG   LEU  67           HG       LEU  67  -8.089  -0.569  -2.762
  505   1HD1  LEU  67          1HD1      LEU  67  -5.123  -0.163  -3.240
  506   2HD1  LEU  67          2HD1      LEU  67  -6.162   0.931  -2.329
  507   3HD1  LEU  67          3HD1      LEU  67  -5.875  -0.718  -1.744
  508   1HD2  LEU  67          1HD2      LEU  67  -6.699   0.252  -5.351
  509   2HD2  LEU  67          2HD2      LEU  67  -8.443   0.112  -5.077
  510   3HD2  LEU  67          3HD2      LEU  67  -7.515   1.379  -4.261
  511    H    GLY  68           H        GLY  68  -8.437  -5.226  -3.450
  512   1HA   GLY  68          2HA       GLY  68  -8.731  -7.211  -4.569
  513   2HA   GLY  68          3HA       GLY  68  -8.356  -6.450  -6.120
  514    H    TYR  69           H        TYR  69  -6.367  -6.251  -3.105
  515    HA   TYR  69           HA       TYR  69  -4.256  -7.931  -4.407
  516   1HB   TYR  69          2HB       TYR  69  -4.245  -5.072  -3.679
  517   2HB   TYR  69          3HB       TYR  69  -2.948  -5.963  -2.912
  518    HD1  TYR  69           HD1      TYR  69  -4.632  -5.571  -6.235
  519    HD2  TYR  69           HD2      TYR  69  -0.985  -6.470  -4.124
  520    HE1  TYR  69           HE1      TYR  69  -3.395  -5.308  -8.294
  521    HE2  TYR  69           HE2      TYR  69   0.282  -6.114  -6.174
  522    HH   TYR  69           HH       TYR  69   0.178  -5.547  -8.476
  523    H    HIS  70           H        HIS  70  -2.526  -8.478  -2.767
  524    HA   HIS  70           HA       HIS  70  -3.331  -8.316   0.037
  525   1HB   HIS  70          2HB       HIS  70  -4.322 -10.456  -0.956
  526   2HB   HIS  70          3HB       HIS  70  -2.667 -11.051  -1.107
  527    HD1  HIS  70           1HD      HIS  70  -1.584 -10.059   1.795
  528    HD2  HIS  70           2HD      HIS  70  -5.291 -11.891   0.961
  529    HE1  HIS  70           1HE      HIS  70  -2.421 -11.034   3.977
  530    H    VAL  71           H        VAL  71  -1.521  -7.420   0.944
  531    HA   VAL  71           HA       VAL  71   1.112  -7.826  -0.216
  532    HB   VAL  71           HB       VAL  71   1.802  -6.275   1.503
  533   1HG1  VAL  71          1HG1      VAL  71   0.554  -4.322   0.834
  534   2HG1  VAL  71          2HG1      VAL  71   0.689  -5.410  -0.563
  535   3HG1  VAL  71          3HG1      VAL  71  -0.825  -5.329   0.362
  536   1HG2  VAL  71          1HG2      VAL  71   0.496  -6.989   3.432
  537   2HG2  VAL  71          2HG2      VAL  71   0.261  -5.266   3.122
  538   3HG2  VAL  71          3HG2      VAL  71  -1.003  -6.422   2.669
  539    H    VAL  72           H        VAL  72   2.922  -8.433   1.360
  540    HA   VAL  72           HA       VAL  72   2.094 -10.628   3.202
  541    HB   VAL  72           HB       VAL  72   4.494 -10.748   1.450
  542   1HG1  VAL  72          1HG1      VAL  72   3.053 -12.861   3.107
  543   2HG1  VAL  72          2HG1      VAL  72   4.494 -13.130   2.107
  544   3HG1  VAL  72          3HG1      VAL  72   4.601 -12.099   3.536
  545   1HG2  VAL  72          1HG2      VAL  72   2.633 -10.879  -0.073
  546   2HG2  VAL  72          2HG2      VAL  72   3.221 -12.525   0.211
  547   3HG2  VAL  72          3HG2      VAL  72   1.742 -11.969   1.020
  548    H    ILE  73           H        ILE  73   3.264 -10.757   5.064
  549    HA   ILE  73           HA       ILE  73   4.926  -8.365   5.722
  550    HB   ILE  73           HB       ILE  73   3.284  -9.968   7.652
  551   1HG1  ILE  73          2HG1      ILE  73   1.681  -9.049   6.077
  552   2HG1  ILE  73          3HG1      ILE  73   1.683  -8.201   7.615
  553   1HG2  ILE  73          1HG2      ILE  73   5.196  -8.622   8.507
  554   2HG2  ILE  73          2HG2      ILE  73   4.556  -7.184   7.742
  555   3HG2  ILE  73          3HG2      ILE  73   3.639  -7.968   9.050
  556   1HD1  ILE  73          1HD1      ILE  73   2.844  -6.281   6.663
  557   2HD1  ILE  73          2HD1      ILE  73   2.975  -7.112   5.095
  558   3HD1  ILE  73          3HD1      ILE  73   1.390  -6.661   5.739
  559    H    GLU  74           H        GLU  74   6.701  -9.865   4.718
  560    HA   GLU  74           HA       GLU  74   7.543 -12.031   6.259
  561   1HB   GLU  74          2HB       GLU  74   8.704 -10.478   3.954
  562   2HB   GLU  74          3HB       GLU  74   9.666 -11.654   4.835
  563   1HG   GLU  74          2HG       GLU  74   7.959 -13.411   4.421
  564   2HG   GLU  74          3HG       GLU  74   7.046 -12.264   3.419
  565    H    GLY  75           H        GLY  75   7.665  -8.907   6.942
  566   1HA   GLY  75          2HA       GLY  75   9.865  -9.176   8.973
  567   2HA   GLY  75          3HA       GLY  75   9.601  -7.672   8.071
  568    H    ARG  76           H        ARG  76   7.663 -10.119   9.833
  569    HA   ARG  76           HA       ARG  76   5.778  -8.087  10.751
  570   1HB   ARG  76          2HB       ARG  76   5.173 -10.445   9.907
  571   2HB   ARG  76          3HB       ARG  76   5.812 -11.053  11.428
  572   1HG   ARG  76          2HG       ARG  76   3.926  -8.800  11.798
  573   2HG   ARG  76          3HG       ARG  76   3.198 -10.113  10.873
  574   1HD   ARG  76          2HD       ARG  76   3.578 -11.713  12.596
  575   2HD   ARG  76          3HD       ARG  76   4.672 -10.660  13.484
  576    HE   ARG  76           HE       ARG  76   1.748 -10.635  13.491
  577   1HH1  ARG  76          2HH2      ARG  76   4.641  -8.645  14.114
  578   2HH1  ARG  76          1HH2      ARG  76   3.891  -7.670  15.323
  579   1HH2  ARG  76          2HH1      ARG  76   0.707  -9.267  15.033
  580   2HH2  ARG  76          1HH1      ARG  76   1.591  -7.995  15.814
  Start of MODEL   13
    1   1H    MET   1          H1        MET   1  -4.350  17.226  14.515
    2   2H    MET   1          H2        MET   1  -5.306  18.463  15.063
    3   3H    MET   1          H3        MET   1  -3.856  18.784  14.330
    4    HA   MET   1           HA       MET   1  -3.639  19.116  16.627
    5   1HB   MET   1          2HB       MET   1  -4.923  16.400  16.704
    6   2HB   MET   1          3HB       MET   1  -3.627  16.671  17.882
    7   1HG   MET   1          2HG       MET   1  -5.896  18.631  17.533
    8   2HG   MET   1          3HG       MET   1  -5.916  17.312  18.711
    9   1HE   MET   1          1HE       MET   1  -5.807  20.823  18.818
   10   2HE   MET   1          2HE       MET   1  -6.483  19.785  20.103
   11   3HE   MET   1          3HE       MET   1  -5.166  20.928  20.472
   12    H    LEU   2           H        LEU   2  -2.496  15.760  16.303
   13    HA   LEU   2           HA       LEU   2   0.010  16.703  15.076
   14   1HB   LEU   2          2HB       LEU   2   0.375  16.680  17.542
   15   2HB   LEU   2          3HB       LEU   2  -0.248  15.026  17.613
   16    HG   LEU   2           HG       LEU   2   1.659  14.258  16.184
   17   1HD1  LEU   2          1HD1      LEU   2   2.592  17.153  16.487
   18   2HD1  LEU   2          2HD1      LEU   2   3.614  15.812  15.934
   19   3HD1  LEU   2          3HD1      LEU   2   2.230  16.312  14.962
   20   1HD2  LEU   2          1HD2      LEU   2   1.763  14.155  18.645
   21   2HD2  LEU   2          2HD2      LEU   2   3.360  14.457  17.943
   22   3HD2  LEU   2          3HD2      LEU   2   2.455  15.792  18.694
   23    H    SER   3           H        SER   3   0.377  15.369  13.390
   24    HA   SER   3           HA       SER   3  -0.413  12.541  13.546
   25   1HB   SER   3          2HB       SER   3  -0.836  14.301  11.093
   26   2HB   SER   3          3HB       SER   3  -1.117  12.563  11.186
   27    HG   SER   3           HG       SER   3  -3.044  12.949  12.061
   28    H    GLU   4           H        GLU   4   1.489  11.452  13.198
   29    HA   GLU   4           HA       GLU   4   3.973  12.910  12.522
   30   1HB   GLU   4          2HB       GLU   4   3.236  10.364  13.885
   31   2HB   GLU   4          3HB       GLU   4   4.854  10.608  13.281
   32   1HG   GLU   4          2HG       GLU   4   5.207  12.452  14.655
   33   2HG   GLU   4          3HG       GLU   4   3.500  12.549  15.094
   34    H    GLN   5           H        GLN   5   5.426  11.273  11.052
   35    HA   GLN   5           HA       GLN   5   3.722   9.728   9.183
   36   1HB   GLN   5          2HB       GLN   5   5.938  11.665   8.529
   37   2HB   GLN   5          3HB       GLN   5   5.269  10.592   7.333
   38   1HG   GLN   5          2HG       GLN   5   3.531  12.641   8.838
   39   2HG   GLN   5          3HG       GLN   5   4.437  13.014   7.406
   40   1HE2  GLN   5          1HE2      GLN   5   3.444   9.751   7.125
   41   2HE2  GLN   5          2HE2      GLN   5   2.086  10.055   6.078
   42    H    LYS   6           H        LYS   6   4.612   7.826   8.691
   43    HA   LYS   6           HA       LYS   6   7.520   7.460   8.963
   44   1HB   LYS   6          2HB       LYS   6   5.609   5.415  10.088
   45   2HB   LYS   6          3HB       LYS   6   7.352   5.260   9.939
   46   1HG   LYS   6          2HG       LYS   6   6.967   7.669  11.427
   47   2HG   LYS   6          3HG       LYS   6   5.766   6.547  12.038
   48   1HD   LYS   6          2HD       LYS   6   7.697   6.255  13.369
   49   2HD   LYS   6          3HD       LYS   6   7.712   4.863  12.264
   50   1HE   LYS   6          2HE       LYS   6   9.309   6.201  10.756
   51   2HE   LYS   6          3HE       LYS   6   9.290   7.490  11.964
   52   1HZ   LYS   6          1HZ       LYS   6  10.227   5.932  13.540
   53   2HZ   LYS   6          2HZ       LYS   6  10.276   4.755  12.385
   54   3HZ   LYS   6          3HZ       LYS   6  11.188   6.115  12.216
   55    H    GLU   7           H        GLU   7   8.386   5.930   7.654
   56    HA   GLU   7           HA       GLU   7   6.885   5.374   5.181
   57   1HB   GLU   7          2HB       GLU   7   9.872   5.037   5.451
   58   2HB   GLU   7          3HB       GLU   7   8.864   5.533   4.097
   59   1HG   GLU   7          2HG       GLU   7  10.079   7.425   4.664
   60   2HG   GLU   7          3HG       GLU   7   8.542   7.757   5.467
   61    H    ILE   8           H        ILE   8   5.824   3.425   5.666
   62    HA   ILE   8           HA       ILE   8   7.297   1.307   7.023
   63    HB   ILE   8           HB       ILE   8   4.612   1.160   5.802
   64   1HG1  ILE   8          2HG1      ILE   8   4.133   3.118   6.880
   65   2HG1  ILE   8          3HG1      ILE   8   3.575   1.797   7.916
   66   1HG2  ILE   8          1HG2      ILE   8   5.664  -0.846   6.782
   67   2HG2  ILE   8          2HG2      ILE   8   5.809   0.012   8.316
   68   3HG2  ILE   8          3HG2      ILE   8   4.192  -0.369   7.654
   69   1HD1  ILE   8          1HD1      ILE   8   6.010   3.492   8.288
   70   2HD1  ILE   8          2HD1      ILE   8   4.592   3.323   9.349
   71   3HD1  ILE   8          3HD1      ILE   8   5.744   1.973   9.159
   72    H    ALA   9           H        ALA   9   7.471  -0.869   5.876
   73    HA   ALA   9           HA       ALA   9   7.493  -0.713   2.920
   74   1HB   ALA   9          1HB       ALA   9   9.738  -1.906   4.585
   75   2HB   ALA   9          2HB       ALA   9   9.636  -1.829   2.818
   76   3HB   ALA   9          3HB       ALA   9   9.836  -0.343   3.774
   77    H    MET  10           H        MET  10   6.410  -2.485   2.105
   78    HA   MET  10           HA       MET  10   6.368  -5.018   3.651
   79   1HB   MET  10          2HB       MET  10   3.888  -3.623   2.519
   80   2HB   MET  10          3HB       MET  10   3.966  -5.254   3.187
   81   1HG   MET  10          2HG       MET  10   3.204  -4.156   5.003
   82   2HG   MET  10          3HG       MET  10   4.924  -4.093   5.324
   83   1HE   MET  10          1HE       MET  10   1.611  -2.295   4.846
   84   2HE   MET  10          2HE       MET  10   2.043  -0.639   4.384
   85   3HE   MET  10          3HE       MET  10   2.240  -1.962   3.210
   86    H    GLN  11           H        GLN  11   5.283  -6.742   2.231
   87    HA   GLN  11           HA       GLN  11   6.341  -6.613  -0.556
   88   1HB   GLN  11          2HB       GLN  11   6.434  -8.594   1.577
   89   2HB   GLN  11          3HB       GLN  11   5.506  -9.256   0.240
   90   1HG   GLN  11          2HG       GLN  11   8.219  -7.994  -0.280
   91   2HG   GLN  11          3HG       GLN  11   8.060  -9.640   0.356
   92   1HE2  GLN  11          1HE2      GLN  11   7.368  -7.608  -2.461
   93   2HE2  GLN  11          2HE2      GLN  11   6.743  -8.905  -3.466
   94    H    VAL  12           H        VAL  12   4.891  -7.742  -2.197
   95    HA   VAL  12           HA       VAL  12   1.998  -7.588  -1.465
   96    HB   VAL  12           HB       VAL  12   1.655  -7.108  -3.918
   97   1HG1  VAL  12          1HG1      VAL  12   1.893  -4.675  -3.602
   98   2HG1  VAL  12          2HG1      VAL  12   1.211  -5.452  -2.160
   99   3HG1  VAL  12          3HG1      VAL  12   2.921  -4.964  -2.183
  100   1HG2  VAL  12          1HG2      VAL  12   3.371  -5.993  -5.143
  101   2HG2  VAL  12          2HG2      VAL  12   4.495  -6.049  -3.770
  102   3HG2  VAL  12          3HG2      VAL  12   4.035  -7.551  -4.615
  103    H    SER  13           H        SER  13   0.601  -9.045  -2.432
  104    HA   SER  13           HA       SER  13   1.707 -11.340  -3.913
  105   1HB   SER  13          2HB       SER  13   0.261 -11.540  -1.244
  106   2HB   SER  13          3HB       SER  13   0.420 -12.896  -2.373
  107    HG   SER  13           HG       SER  13   2.109 -12.823  -0.785
  108    H    GLY  14           H        GLY  14  -0.079 -12.667  -4.762
  109   1HA   GLY  14          2HA       GLY  14  -2.073 -12.979  -5.850
  110   2HA   GLY  14          3HA       GLY  14  -2.825 -11.920  -4.644
  111    H    MET  15           H        MET  15  -0.650 -11.754  -7.524
  112    HA   MET  15           HA       MET  15  -2.119  -9.375  -8.509
  113   1HB   MET  15          2HB       MET  15  -0.010  -8.273  -8.994
  114   2HB   MET  15          3HB       MET  15  -0.181  -8.550  -7.248
  115   1HG   MET  15          2HG       MET  15   1.487 -10.343  -9.054
  116   2HG   MET  15          3HG       MET  15   2.111  -8.907  -8.255
  117   1HE   MET  15          1HE       MET  15   3.153 -12.037  -8.042
  118   2HE   MET  15          2HE       MET  15   4.033 -10.611  -7.430
  119   3HE   MET  15          3HE       MET  15   3.696 -11.984  -6.348
  120    H    THR  16           H        THR  16  -1.846  -8.979 -10.764
  121    HA   THR  16           HA       THR  16  -0.861 -11.150 -12.486
  122    HB   THR  16           HB       THR  16  -1.274  -9.038 -14.117
  123    HG1  THR  16           1HG      THR  16  -3.350  -8.443 -12.432
  124   1HG2  THR  16          1HG2      THR  16  -2.486 -11.138 -14.299
  125   2HG2  THR  16          2HG2      THR  16  -3.482 -10.747 -12.881
  126   3HG2  THR  16          3HG2      THR  16  -3.630  -9.789 -14.378
  127    H    CYS  17           H        CYS  17  -0.160  -7.590 -12.227
  128    HA   CYS  17           HA       CYS  17   2.733  -8.128 -12.228
  129   1HB   CYS  17          2HB       CYS  17   2.952  -7.071 -14.492
  130   2HB   CYS  17          3HB       CYS  17   2.042  -8.575 -14.522
  131    H    ALA  18           H        ALA  18   3.801  -5.962 -12.937
  132    HA   ALA  18           HA       ALA  18   3.322  -3.942 -10.963
  133   1HB   ALA  18          1HB       ALA  18   5.058  -2.707 -12.225
  134   2HB   ALA  18          2HB       ALA  18   5.538  -4.399 -12.005
  135   3HB   ALA  18          3HB       ALA  18   4.905  -3.852 -13.573
  136    H    ALA  19           H        ALA  19   3.121  -1.558 -11.886
  137    HA   ALA  19           HA       ALA  19   1.823   0.058 -12.751
  138   1HB   ALA  19          1HB       ALA  19   0.679  -1.875 -14.807
  139   2HB   ALA  19          2HB       ALA  19   0.696  -0.109 -14.835
  140   3HB   ALA  19          3HB       ALA  19   2.222  -1.006 -14.987
  141    H    CYS  20           H        CYS  20  -0.066  -3.030 -12.780
  142    HA   CYS  20           HA       CYS  20  -2.419  -1.852 -11.664
  143   1HB   CYS  20          2HB       CYS  20  -1.347  -4.704 -11.208
  144   2HB   CYS  20          3HB       CYS  20  -3.043  -4.194 -11.108
  145    H    ALA  21           H        ALA  21   0.388  -3.440 -10.179
  146    HA   ALA  21           HA       ALA  21  -0.129  -3.045  -7.476
  147   1HB   ALA  21          1HB       ALA  21   2.284  -3.170  -7.183
  148   2HB   ALA  21          2HB       ALA  21   1.797  -4.310  -8.440
  149   3HB   ALA  21          3HB       ALA  21   2.544  -2.779  -8.904
  150    H    ALA  22           H        ALA  22   0.483  -0.521  -9.864
  151    HA   ALA  22           HA       ALA  22   1.235   1.512  -7.888
  152   1HB   ALA  22          1HB       ALA  22   1.124   3.045  -9.704
  153   2HB   ALA  22          2HB       ALA  22   1.848   1.571 -10.387
  154   3HB   ALA  22          3HB       ALA  22   0.137   1.955 -10.686
  155    H    ARG  23           H        ARG  23  -1.682   0.450  -9.672
  156    HA   ARG  23           HA       ARG  23  -3.254   2.711  -8.947
  157   1HB   ARG  23          2HB       ARG  23  -4.124  -0.126  -9.660
  158   2HB   ARG  23          3HB       ARG  23  -5.220   1.254  -9.566
  159   1HG   ARG  23          2HG       ARG  23  -2.808   1.138 -11.425
  160   2HG   ARG  23          3HG       ARG  23  -4.409   0.607 -11.902
  161   1HD   ARG  23          2HD       ARG  23  -4.248   3.381 -10.737
  162   2HD   ARG  23          3HD       ARG  23  -3.441   3.114 -12.294
  163    HE   ARG  23           HE       ARG  23  -6.029   1.984 -12.450
  164   1HH1  ARG  23          2HH2      ARG  23  -4.523   5.146 -12.102
  165   2HH1  ARG  23          1HH2      ARG  23  -5.710   6.012 -13.027
  166   1HH2  ARG  23          2HH1      ARG  23  -7.628   3.091 -13.733
  167   2HH2  ARG  23          1HH1      ARG  23  -7.524   4.804 -13.970
  168    H    ILE  24           H        ILE  24  -2.811  -0.459  -7.378
  169    HA   ILE  24           HA       ILE  24  -4.657   0.027  -5.312
  170    HB   ILE  24           HB       ILE  24  -3.726  -1.716  -4.053
  171   1HG1  ILE  24          2HG1      ILE  24  -1.316  -1.294  -5.736
  172   2HG1  ILE  24          3HG1      ILE  24  -1.445  -1.196  -3.961
  173   1HG2  ILE  24          1HG2      ILE  24  -3.260  -2.518  -6.953
  174   2HG2  ILE  24          2HG2      ILE  24  -3.960  -3.463  -5.624
  175   3HG2  ILE  24          3HG2      ILE  24  -4.878  -2.138  -6.338
  176   1HD1  ILE  24          1HD1      ILE  24  -1.879  -3.658  -3.915
  177   2HD1  ILE  24          2HD1      ILE  24  -1.537  -3.680  -5.667
  178   3HD1  ILE  24          3HD1      ILE  24  -0.267  -3.219  -4.523
  179    H    GLU  25           H        GLU  25  -1.120   0.662  -5.237
  180    HA   GLU  25           HA       GLU  25  -1.029   1.920  -2.750
  181   1HB   GLU  25          2HB       GLU  25   0.668   1.948  -5.224
  182   2HB   GLU  25          3HB       GLU  25   0.960   3.225  -4.035
  183   1HG   GLU  25          2HG       GLU  25   0.828   0.308  -3.211
  184   2HG   GLU  25          3HG       GLU  25   2.318   1.109  -3.730
  185    H    LYS  26           H        LYS  26  -1.852   3.328  -5.906
  186    HA   LYS  26           HA       LYS  26  -1.756   6.055  -4.860
  187   1HB   LYS  26          2HB       LYS  26  -2.427   4.833  -7.520
  188   2HB   LYS  26          3HB       LYS  26  -2.956   6.478  -7.153
  189   1HG   LYS  26          2HG       LYS  26  -0.801   6.516  -8.281
  190   2HG   LYS  26          3HG       LYS  26  -0.703   7.215  -6.661
  191   1HD   LYS  26          2HD       LYS  26   0.334   5.043  -5.838
  192   2HD   LYS  26          3HD       LYS  26   0.180   4.425  -7.483
  193   1HE   LYS  26          2HE       LYS  26   2.422   5.016  -7.291
  194   2HE   LYS  26          3HE       LYS  26   1.694   6.295  -8.268
  195   1HZ   LYS  26          1HZ       LYS  26   2.403   6.445  -5.376
  196   2HZ   LYS  26          2HZ       LYS  26   3.162   7.182  -6.610
  197   3HZ   LYS  26          3HZ       LYS  26   1.640   7.642  -6.212
  198    H    GLY  27           H        GLY  27  -4.425   3.728  -5.561
  199   1HA   GLY  27          2HA       GLY  27  -6.523   5.486  -4.629
  200   2HA   GLY  27          3HA       GLY  27  -6.581   3.721  -4.680
  201    H    LEU  28           H        LEU  28  -4.302   3.185  -3.063
  202    HA   LEU  28           HA       LEU  28  -5.346   3.295  -0.398
  203   1HB   LEU  28          2HB       LEU  28  -4.054   1.558  -1.307
  204   2HB   LEU  28          3HB       LEU  28  -2.654   2.606  -1.516
  205    HG   LEU  28           HG       LEU  28  -3.881   1.923   1.182
  206   1HD1  LEU  28          1HD1      LEU  28  -3.221  -0.097   0.055
  207   2HD1  LEU  28          2HD1      LEU  28  -1.652   0.596  -0.410
  208   3HD1  LEU  28          3HD1      LEU  28  -2.014   0.276   1.296
  209   1HD2  LEU  28          1HD2      LEU  28  -2.502   3.813   1.458
  210   2HD2  LEU  28          2HD2      LEU  28  -1.337   2.503   1.704
  211   3HD2  LEU  28          3HD2      LEU  28  -1.373   3.347   0.161
  212    H    LYS  29           H        LYS  29  -2.969   5.371  -2.148
  213    HA   LYS  29           HA       LYS  29  -2.407   7.063   0.019
  214   1HB   LYS  29          2HB       LYS  29  -1.483   7.015  -2.495
  215   2HB   LYS  29          3HB       LYS  29  -2.690   8.276  -2.714
  216   1HG   LYS  29          2HG       LYS  29  -1.386   9.046  -0.315
  217   2HG   LYS  29          3HG       LYS  29  -0.129   8.261  -1.238
  218   1HD   LYS  29          2HD       LYS  29   0.190  10.318  -2.121
  219   2HD   LYS  29          3HD       LYS  29  -1.121   9.890  -3.206
  220   1HE   LYS  29          2HE       LYS  29  -1.280  11.449  -0.567
  221   2HE   LYS  29          3HE       LYS  29  -1.371  12.142  -2.184
  222   1HZ   LYS  29          1HZ       LYS  29  -3.448  10.819  -2.423
  223   2HZ   LYS  29          2HZ       LYS  29  -3.309  10.364  -0.844
  224   3HZ   LYS  29          3HZ       LYS  29  -3.519  11.941  -1.211
  225    H    ARG  30           H        ARG  30  -5.413   6.804  -1.778
  226    HA   ARG  30           HA       ARG  30  -6.270   9.554  -1.165
  227   1HB   ARG  30          2HB       ARG  30  -7.282   7.266  -2.774
  228   2HB   ARG  30          3HB       ARG  30  -8.527   8.210  -2.012
  229   1HG   ARG  30          2HG       ARG  30  -6.270   9.492  -3.609
  230   2HG   ARG  30          3HG       ARG  30  -7.698   8.796  -4.389
  231   1HD   ARG  30          2HD       ARG  30  -9.184  10.217  -3.042
  232   2HD   ARG  30          3HD       ARG  30  -7.780  11.019  -2.302
  233    HE   ARG  30           HE       ARG  30  -7.401  11.229  -5.058
  234   1HH1  ARG  30          2HH2      ARG  30  -9.860  12.265  -2.758
  235   2HH1  ARG  30          1HH2      ARG  30 -10.428  13.604  -3.706
  236   1HH2  ARG  30          2HH1      ARG  30  -8.103  13.024  -6.347
  237   2HH2  ARG  30          1HH1      ARG  30  -9.380  14.051  -5.791
  238    H    MET  31           H        MET  31  -5.874   6.832   0.785
  239    HA   MET  31           HA       MET  31  -8.419   7.072   2.176
  240   1HB   MET  31          2HB       MET  31  -5.912   5.484   2.854
  241   2HB   MET  31          3HB       MET  31  -7.507   5.238   3.557
  242   1HG   MET  31          2HG       MET  31  -6.678   4.777   0.675
  243   2HG   MET  31          3HG       MET  31  -7.119   3.590   1.871
  244   1HE   MET  31          1HE       MET  31  -9.936   5.316   2.918
  245   2HE   MET  31          2HE       MET  31 -11.073   4.364   1.961
  246   3HE   MET  31          3HE       MET  31  -9.733   3.555   2.814
  247    HA   PRO  32           HA       PRO  32  -7.262  10.161   5.070
  248   1HB   PRO  32          2HB       PRO  32  -8.504   9.367   7.404
  249   2HB   PRO  32          3HB       PRO  32  -9.379  10.028   5.992
  250   1HG   PRO  32          2HG       PRO  32  -8.960   7.119   6.709
  251   2HG   PRO  32          3HG       PRO  32 -10.491   7.922   6.252
  252   1HD   PRO  32          2HD       PRO  32  -9.021   6.536   4.484
  253   2HD   PRO  32          3HD       PRO  32  -9.826   8.048   3.961
  254    H    GLY  33           H        GLY  33  -5.442  10.498   6.314
  255   1HA   GLY  33          2HA       GLY  33  -3.824   9.971   7.936
  256   2HA   GLY  33          3HA       GLY  33  -4.234   8.255   7.831
  257    H    VAL  34           H        VAL  34  -4.128   8.530   4.695
  258    HA   VAL  34           HA       VAL  34  -1.245   7.897   4.660
  259    HB   VAL  34           HB       VAL  34  -3.283   7.416   2.476
  260   1HG1  VAL  34          1HG1      VAL  34  -1.507   5.801   1.742
  261   2HG1  VAL  34          2HG1      VAL  34  -0.899   7.458   1.754
  262   3HG1  VAL  34          3HG1      VAL  34  -0.473   6.353   3.064
  263   1HG2  VAL  34          1HG2      VAL  34  -3.981   6.159   4.468
  264   2HG2  VAL  34          2HG2      VAL  34  -3.234   5.052   3.315
  265   3HG2  VAL  34          3HG2      VAL  34  -2.318   5.599   4.735
  266    H    THR  35           H        THR  35   0.251   9.107   3.693
  267    HA   THR  35           HA       THR  35  -0.642  11.694   2.493
  268    HB   THR  35           HB       THR  35   1.561  10.909   4.301
  269    HG1  THR  35           1HG      THR  35   0.551  12.508   5.531
  270   1HG2  THR  35          1HG2      THR  35   1.362  13.501   2.736
  271   2HG2  THR  35          2HG2      THR  35   2.378  13.251   4.176
  272   3HG2  THR  35          3HG2      THR  35   2.699  12.322   2.705
  273    H    ASP  36           H        ASP  36   1.739   8.964   2.123
  274    HA   ASP  36           HA       ASP  36   1.759   9.609  -0.714
  275   1HB   ASP  36          2HB       ASP  36   4.100  10.195   1.026
  276   2HB   ASP  36          3HB       ASP  36   4.457   9.197  -0.390
  277    H    ALA  37           H        ALA  37   2.668   7.962  -1.976
  278    HA   ALA  37           HA       ALA  37   2.739   5.246  -0.772
  279   1HB   ALA  37          1HB       ALA  37   0.330   5.843  -0.966
  280   2HB   ALA  37          2HB       ALA  37   0.569   6.106  -2.715
  281   3HB   ALA  37          3HB       ALA  37   0.781   4.494  -2.011
  282    H    ASN  38           H        ASN  38   3.933   3.835  -1.969
  283    HA   ASN  38           HA       ASN  38   4.996   4.706  -4.593
  284   1HB   ASN  38          2HB       ASN  38   7.103   4.079  -2.563
  285   2HB   ASN  38          3HB       ASN  38   7.159   5.080  -4.004
  286   1HD2  ASN  38          1HD2      ASN  38   5.769   4.877  -0.735
  287   2HD2  ASN  38          2HD2      ASN  38   5.940   6.597  -0.355
  288    H    VAL  39           H        VAL  39   4.576   2.892  -5.673
  289    HA   VAL  39           HA       VAL  39   4.795   0.234  -4.491
  290    HB   VAL  39           HB       VAL  39   2.971   0.692  -5.937
  291   1HG1  VAL  39          1HG1      VAL  39   3.379   1.113  -8.438
  292   2HG1  VAL  39          2HG1      VAL  39   3.484   2.486  -7.332
  293   3HG1  VAL  39          3HG1      VAL  39   4.950   1.747  -7.986
  294   1HG2  VAL  39          1HG2      VAL  39   3.238  -1.038  -7.630
  295   2HG2  VAL  39          2HG2      VAL  39   4.967  -1.104  -7.342
  296   3HG2  VAL  39          3HG2      VAL  39   3.830  -1.535  -6.034
  297    H    ASN  40           H        ASN  40   7.048   0.041  -3.943
  298    HA   ASN  40           HA       ASN  40   9.054   0.585  -6.030
  299   1HB   ASN  40          2HB       ASN  40   9.377   1.212  -3.649
  300   2HB   ASN  40          3HB       ASN  40   9.391  -0.502  -3.218
  301   1HD2  ASN  40          1HD2      ASN  40  11.605   0.445  -2.385
  302   2HD2  ASN  40          2HD2      ASN  40  12.938   0.299  -3.519
  303    H    LEU  41           H        LEU  41   7.524  -1.117  -7.161
  304    HA   LEU  41           HA       LEU  41   8.023  -3.918  -6.667
  305   1HB   LEU  41          2HB       LEU  41   6.513  -2.266  -8.601
  306   2HB   LEU  41          3HB       LEU  41   7.217  -3.679  -9.350
  307    HG   LEU  41           HG       LEU  41   4.872  -3.862  -8.441
  308   1HD1  LEU  41          1HD1      LEU  41   6.943  -5.952  -7.670
  309   2HD1  LEU  41          2HD1      LEU  41   5.194  -6.232  -7.802
  310   3HD1  LEU  41          3HD1      LEU  41   6.133  -5.785  -9.236
  311   1HD2  LEU  41          1HD2      LEU  41   6.075  -4.621  -5.772
  312   2HD2  LEU  41          2HD2      LEU  41   5.643  -2.934  -6.070
  313   3HD2  LEU  41          3HD2      LEU  41   4.410  -4.200  -6.191
  314    H    ALA  42           H        ALA  42   9.835  -1.452  -8.278
  315    HA   ALA  42           HA       ALA  42  11.579  -2.857  -9.940
  316   1HB   ALA  42          1HB       ALA  42  12.099  -0.689  -7.878
  317   2HB   ALA  42          2HB       ALA  42  13.327  -1.278  -9.007
  318   3HB   ALA  42          3HB       ALA  42  11.858  -0.484  -9.637
  319    H    THR  43           H        THR  43  11.289  -3.084  -6.381
  320    HA   THR  43           HA       THR  43  13.182  -5.344  -6.566
  321    HB   THR  43           HB       THR  43  14.548  -3.592  -5.700
  322    HG1  THR  43           1HG      THR  43  13.633  -5.365  -3.718
  323   1HG2  THR  43          1HG2      THR  43  12.302  -3.032  -3.732
  324   2HG2  THR  43          2HG2      THR  43  13.961  -2.426  -3.542
  325   3HG2  THR  43          3HG2      THR  43  13.001  -1.947  -4.949
  326    H    GLU  44           H        GLU  44  10.328  -5.359  -6.717
  327    HA   GLU  44           HA       GLU  44   8.405  -6.089  -5.699
  328   1HB   GLU  44          2HB       GLU  44  10.611  -8.022  -5.075
  329   2HB   GLU  44          3HB       GLU  44   9.014  -8.322  -4.402
  330   1HG   GLU  44          2HG       GLU  44   9.223  -9.522  -6.480
  331   2HG   GLU  44          3HG       GLU  44   7.965  -8.288  -6.594
  332    H    THR  45           H        THR  45   9.045  -3.879  -4.243
  333    HA   THR  45           HA       THR  45   8.009  -4.689  -1.605
  334    HB   THR  45           HB       THR  45   9.882  -2.323  -1.964
  335    HG1  THR  45           1HG      THR  45  11.609  -3.775  -1.439
  336   1HG2  THR  45          1HG2      THR  45   8.711  -2.726   0.171
  337   2HG2  THR  45          2HG2      THR  45   9.351  -4.392   0.181
  338   3HG2  THR  45          3HG2      THR  45  10.459  -3.002   0.365
  339    H    VAL  46           H        VAL  46   6.743  -2.975  -0.573
  340    HA   VAL  46           HA       VAL  46   5.920  -0.698  -2.319
  341    HB   VAL  46           HB       VAL  46   4.113  -2.226  -2.549
  342   1HG1  VAL  46          1HG1      VAL  46   4.190  -2.610   0.476
  343   2HG1  VAL  46          2HG1      VAL  46   2.872  -3.158  -0.569
  344   3HG1  VAL  46          3HG1      VAL  46   4.487  -3.845  -0.768
  345   1HG2  VAL  46          1HG2      VAL  46   3.619   0.147  -2.011
  346   2HG2  VAL  46          2HG2      VAL  46   2.301  -0.978  -1.604
  347   3HG2  VAL  46          3HG2      VAL  46   3.324  -0.311  -0.319
  348    H    ASN  47           H        ASN  47   5.825   1.205  -1.286
  349    HA   ASN  47           HA       ASN  47   6.486   1.245   1.605
  350   1HB   ASN  47          2HB       ASN  47   7.746   2.751  -0.729
  351   2HB   ASN  47          3HB       ASN  47   7.730   3.440   0.895
  352   1HD2  ASN  47          1HD2      ASN  47   8.451   1.780   2.697
  353   2HD2  ASN  47          2HD2      ASN  47  10.042   1.136   2.317
  354    H    VAL  48           H        VAL  48   5.178   2.698   2.761
  355    HA   VAL  48           HA       VAL  48   3.458   4.506   1.210
  356    HB   VAL  48           HB       VAL  48   2.118   2.514   1.363
  357   1HG1  VAL  48          1HG1      VAL  48   2.712   2.459   4.344
  358   2HG1  VAL  48          2HG1      VAL  48   1.483   1.489   3.509
  359   3HG1  VAL  48          3HG1      VAL  48   3.193   1.264   3.126
  360   1HG2  VAL  48          1HG2      VAL  48   1.356   4.767   3.240
  361   2HG2  VAL  48          2HG2      VAL  48   0.825   4.444   1.584
  362   3HG2  VAL  48          3HG2      VAL  48   0.280   3.406   2.919
  363    H    ILE  49           H        ILE  49   3.329   6.380   2.216
  364    HA   ILE  49           HA       ILE  49   4.666   6.639   4.822
  365    HB   ILE  49           HB       ILE  49   4.429   8.508   2.450
  366   1HG1  ILE  49          2HG1      ILE  49   6.948   8.842   3.253
  367   2HG1  ILE  49          3HG1      ILE  49   6.687   7.323   4.104
  368   1HG2  ILE  49          1HG2      ILE  49   3.768   9.938   4.282
  369   2HG2  ILE  49          2HG2      ILE  49   5.131   9.343   5.274
  370   3HG2  ILE  49          3HG2      ILE  49   5.415  10.313   3.809
  371   1HD1  ILE  49          1HD1      ILE  49   6.060   6.285   1.915
  372   2HD1  ILE  49          2HD1      ILE  49   6.267   7.893   1.160
  373   3HD1  ILE  49          3HD1      ILE  49   7.671   7.035   1.849
  374    H    TYR  50           H        TYR  50   3.183   6.766   6.415
  375    HA   TYR  50           HA       TYR  50   0.737   8.373   6.028
  376   1HB   TYR  50          2HB       TYR  50  -0.720   6.634   6.790
  377   2HB   TYR  50          3HB       TYR  50   0.077   6.142   5.327
  378    HD1  TYR  50           HD1      TYR  50   1.196   3.987   5.273
  379    HD2  TYR  50           HD2      TYR  50   0.117   5.740   9.022
  380    HE1  TYR  50           HE1      TYR  50   1.548   1.813   6.411
  381    HE2  TYR  50           HE2      TYR  50   0.907   3.725  10.200
  382    HH   TYR  50           HH       TYR  50   1.406   1.471   9.934
  383    H    ASP  51           H        ASP  51  -0.427   8.587   8.002
  384    HA   ASP  51           HA       ASP  51   1.376   8.962  10.307
  385   1HB   ASP  51          2HB       ASP  51  -0.039  10.822   9.964
  386   2HB   ASP  51          3HB       ASP  51  -1.480   9.797   9.848
  387    HA   PRO  52           HA       PRO  52  -0.125   5.012  11.864
  388   1HB   PRO  52          2HB       PRO  52   1.621   4.614  13.897
  389   2HB   PRO  52          3HB       PRO  52   2.146   4.628  12.191
  390   1HG   PRO  52          2HG       PRO  52   2.234   6.944  14.153
  391   2HG   PRO  52          3HG       PRO  52   3.578   6.306  13.160
  392   1HD   PRO  52          2HD       PRO  52   2.059   8.430  12.371
  393   2HD   PRO  52          3HD       PRO  52   2.663   7.230  11.185
  394    H    ALA  53           H        ALA  53  -1.106   7.921  13.100
  395    HA   ALA  53           HA       ALA  53  -2.360   6.711  15.506
  396   1HB   ALA  53          1HB       ALA  53  -1.220   8.950  15.721
  397   2HB   ALA  53          2HB       ALA  53  -2.410   9.609  14.582
  398   3HB   ALA  53          3HB       ALA  53  -2.950   8.936  16.123
  399    H    GLU  54           H        GLU  54  -2.872   8.080  12.248
  400    HA   GLU  54           HA       GLU  54  -5.792   7.865  12.472
  401   1HB   GLU  54          2HB       GLU  54  -3.842   9.367  10.808
  402   2HB   GLU  54          3HB       GLU  54  -5.043   8.509   9.844
  403   1HG   GLU  54          2HG       GLU  54  -6.061  10.509  10.062
  404   2HG   GLU  54          3HG       GLU  54  -6.837   9.583  11.343
  405    H    THR  55           H        THR  55  -3.127   6.662  10.390
  406    HA   THR  55           HA       THR  55  -4.613   4.123  10.047
  407    HB   THR  55           HB       THR  55  -3.023   3.648   8.053
  408    HG1  THR  55           1HG      THR  55  -3.117   6.423   8.099
  409   1HG2  THR  55          1HG2      THR  55  -5.367   3.846   7.924
  410   2HG2  THR  55          2HG2      THR  55  -5.307   5.619   7.999
  411   3HG2  THR  55          3HG2      THR  55  -4.611   4.767   6.595
  412    H    GLY  56           H        GLY  56  -2.086   2.734   9.474
  413   1HA   GLY  56          2HA       GLY  56  -0.623   1.686  11.283
  414   2HA   GLY  56          3HA       GLY  56  -1.986   2.038  12.359
  415    H    THR  57           H        THR  57  -1.071   0.454   9.628
  416    HA   THR  57           HA       THR  57  -1.686  -0.413   7.878
  417    HB   THR  57           HB       THR  57  -1.600  -2.897   8.000
  418    HG1  THR  57           1HG      THR  57  -1.750  -2.387  10.789
  419   1HG2  THR  57          1HG2      THR  57   0.542  -1.646   8.132
  420   2HG2  THR  57          2HG2      THR  57   0.403  -1.598   9.906
  421   3HG2  THR  57          3HG2      THR  57   0.568  -3.151   9.073
  422    H    ALA  58           H        ALA  58  -4.151  -0.981  10.283
  423    HA   ALA  58           HA       ALA  58  -6.239  -2.246   9.379
  424   1HB   ALA  58          1HB       ALA  58  -6.224  -0.683  11.250
  425   2HB   ALA  58          2HB       ALA  58  -6.037   0.687  10.154
  426   3HB   ALA  58          3HB       ALA  58  -7.571  -0.234  10.170
  427    H    ALA  59           H        ALA  59  -5.389   0.928   7.888
  428    HA   ALA  59           HA       ALA  59  -7.940   0.625   6.304
  429   1HB   ALA  59          1HB       ALA  59  -7.294   2.883   7.190
  430   2HB   ALA  59          2HB       ALA  59  -5.935   2.876   6.015
  431   3HB   ALA  59          3HB       ALA  59  -7.609   2.815   5.447
  432    H    ILE  60           H        ILE  60  -4.487   0.741   5.852
  433    HA   ILE  60           HA       ILE  60  -4.300   0.364   3.061
  434    HB   ILE  60           HB       ILE  60  -2.599  -0.145   5.528
  435   1HG1  ILE  60          2HG1      ILE  60  -1.181   1.158   3.542
  436   2HG1  ILE  60          3HG1      ILE  60  -2.807   1.744   3.279
  437   1HG2  ILE  60          1HG2      ILE  60  -0.714  -0.973   4.197
  438   2HG2  ILE  60          2HG2      ILE  60  -2.012  -2.142   4.396
  439   3HG2  ILE  60          3HG2      ILE  60  -1.823  -1.301   2.844
  440   1HD1  ILE  60          1HD1      ILE  60  -1.563   3.203   4.845
  441   2HD1  ILE  60          2HD1      ILE  60  -2.941   2.448   5.668
  442   3HD1  ILE  60          3HD1      ILE  60  -1.290   1.832   5.935
  443    H    GLN  61           H        GLN  61  -4.484  -2.101   5.654
  444    HA   GLN  61           HA       GLN  61  -4.287  -4.201   3.746
  445   1HB   GLN  61          2HB       GLN  61  -3.844  -4.034   6.300
  446   2HB   GLN  61          3HB       GLN  61  -5.499  -4.650   6.457
  447   1HG   GLN  61          2HG       GLN  61  -4.863  -6.666   5.205
  448   2HG   GLN  61          3HG       GLN  61  -3.299  -5.958   4.767
  449   1HE2  GLN  61          1HE2      GLN  61  -2.001  -5.099   6.804
  450   2HE2  GLN  61          2HE2      GLN  61  -1.929  -6.244   8.132
  451    H    GLU  62           H        GLU  62  -7.100  -2.725   5.462
  452    HA   GLU  62           HA       GLU  62  -9.243  -4.144   4.364
  453   1HB   GLU  62          2HB       GLU  62  -8.751  -1.280   5.215
  454   2HB   GLU  62          3HB       GLU  62 -10.217  -1.607   4.337
  455   1HG   GLU  62          2HG       GLU  62 -10.769  -3.409   6.023
  456   2HG   GLU  62          3HG       GLU  62  -9.379  -2.843   6.974
  457    H    LYS  63           H        LYS  63  -7.648  -1.232   2.925
  458    HA   LYS  63           HA       LYS  63  -9.242  -1.405   0.596
  459   1HB   LYS  63          2HB       LYS  63  -6.872   0.198   1.540
  460   2HB   LYS  63          3HB       LYS  63  -7.443   0.336  -0.090
  461   1HG   LYS  63          2HG       LYS  63  -9.362   0.577   2.281
  462   2HG   LYS  63          3HG       LYS  63  -8.375   1.909   1.743
  463   1HD   LYS  63          2HD       LYS  63 -10.469   2.261   0.795
  464   2HD   LYS  63          3HD       LYS  63  -9.392   1.818  -0.532
  465   1HE   LYS  63          2HE       LYS  63 -10.488  -0.299  -0.796
  466   2HE   LYS  63          3HE       LYS  63 -11.216  -0.217   0.832
  467   1HZ   LYS  63          1HZ       LYS  63 -12.809   0.219  -0.873
  468   2HZ   LYS  63          2HZ       LYS  63 -12.605   1.558   0.052
  469   3HZ   LYS  63          3HZ       LYS  63 -11.938   1.486  -1.454
  470    H    ILE  64           H        ILE  64  -5.968  -2.541   1.351
  471    HA   ILE  64           HA       ILE  64  -4.952  -3.069  -1.101
  472    HB   ILE  64           HB       ILE  64  -4.607  -4.044   1.610
  473   1HG1  ILE  64          2HG1      ILE  64  -3.257  -2.317   0.371
  474   2HG1  ILE  64          3HG1      ILE  64  -2.356  -3.564   1.223
  475   1HG2  ILE  64          1HG2      ILE  64  -4.848  -6.223   0.927
  476   2HG2  ILE  64          2HG2      ILE  64  -3.950  -5.955  -0.594
  477   3HG2  ILE  64          3HG2      ILE  64  -3.116  -5.920   0.976
  478   1HD1  ILE  64          1HD1      ILE  64  -1.939  -4.783  -0.855
  479   2HD1  ILE  64          2HD1      ILE  64  -2.931  -3.633  -1.769
  480   3HD1  ILE  64          3HD1      ILE  64  -1.413  -3.099  -1.010
  481    H    GLU  65           H        GLU  65  -6.976  -5.108   1.095
  482    HA   GLU  65           HA       GLU  65  -7.598  -7.294  -0.571
  483   1HB   GLU  65          2HB       GLU  65  -9.077  -5.999   1.762
  484   2HB   GLU  65          3HB       GLU  65  -9.611  -7.493   0.993
  485   1HG   GLU  65          2HG       GLU  65  -6.807  -7.217   2.089
  486   2HG   GLU  65          3HG       GLU  65  -8.174  -7.687   3.108
  487    H    LYS  66           H        LYS  66  -9.650  -4.414   0.141
  488    HA   LYS  66           HA       LYS  66 -11.703  -5.138  -1.664
  489   1HB   LYS  66          2HB       LYS  66 -10.883  -2.662  -0.217
  490   2HB   LYS  66          3HB       LYS  66 -11.982  -2.417  -1.577
  491   1HG   LYS  66          2HG       LYS  66 -12.544  -4.582   0.465
  492   2HG   LYS  66          3HG       LYS  66 -12.945  -2.905   0.834
  493   1HD   LYS  66          2HD       LYS  66 -14.413  -2.654  -0.996
  494   2HD   LYS  66          3HD       LYS  66 -13.860  -4.107  -1.818
  495   1HE   LYS  66          2HE       LYS  66 -15.233  -4.208   0.911
  496   2HE   LYS  66          3HE       LYS  66 -16.154  -4.159  -0.598
  497   1HZ   LYS  66          1HZ       LYS  66 -15.098  -6.163  -1.302
  498   2HZ   LYS  66          2HZ       LYS  66 -14.165  -6.235   0.051
  499   3HZ   LYS  66          3HZ       LYS  66 -15.798  -6.402   0.163
  500    H    LEU  67           H        LEU  67  -8.706  -3.440  -2.384
  501    HA   LEU  67           HA       LEU  67  -9.437  -2.669  -5.080
  502   1HB   LEU  67          2HB       LEU  67  -6.860  -2.852  -3.493
  503   2HB   LEU  67          3HB       LEU  67  -6.837  -2.505  -5.216
  504    HG   LEU  67           HG       LEU  67  -8.670  -0.850  -3.476
  505   1HD1  LEU  67          1HD1      LEU  67  -6.761  -0.489  -2.178
  506   2HD1  LEU  67          2HD1      LEU  67  -5.661  -0.686  -3.527
  507   3HD1  LEU  67          3HD1      LEU  67  -6.626   0.797  -3.378
  508   1HD2  LEU  67          1HD2      LEU  67  -8.712  -0.657  -5.971
  509   2HD2  LEU  67          2HD2      LEU  67  -8.183   0.842  -5.191
  510   3HD2  LEU  67          3HD2      LEU  67  -6.991  -0.228  -5.952
  511    H    GLY  68           H        GLY  68  -8.584  -5.692  -3.614
  512   1HA   GLY  68          2HA       GLY  68  -8.716  -7.748  -4.638
  513   2HA   GLY  68          3HA       GLY  68  -8.611  -7.012  -6.243
  514    H    TYR  69           H        TYR  69  -6.473  -6.664  -3.336
  515    HA   TYR  69           HA       TYR  69  -4.255  -8.084  -4.731
  516   1HB   TYR  69          2HB       TYR  69  -4.501  -5.241  -4.221
  517   2HB   TYR  69          3HB       TYR  69  -3.262  -5.882  -3.171
  518    HD1  TYR  69           HD1      TYR  69  -4.399  -5.810  -6.737
  519    HD2  TYR  69           HD2      TYR  69  -1.124  -6.518  -4.024
  520    HE1  TYR  69           HE1      TYR  69  -2.833  -5.692  -8.612
  521    HE2  TYR  69           HE2      TYR  69   0.464  -6.267  -5.882
  522    HH   TYR  69           HH       TYR  69  -0.530  -5.765  -9.287
  523    H    HIS  70           H        HIS  70  -2.452  -8.452  -2.964
  524    HA   HIS  70           HA       HIS  70  -3.504  -8.274  -0.218
  525   1HB   HIS  70          2HB       HIS  70  -3.855 -10.629  -1.182
  526   2HB   HIS  70          3HB       HIS  70  -2.096 -10.793  -1.141
  527    HD1  HIS  70           1HD      HIS  70  -4.872  -9.649   1.382
  528    HD2  HIS  70           2HD      HIS  70  -1.524 -12.178   1.039
  529    HE1  HIS  70           1HE      HIS  70  -4.531 -10.699   3.654
  530    H    VAL  71           H        VAL  71  -1.752  -8.307   1.385
  531    HA   VAL  71           HA       VAL  71   0.862  -7.416   0.317
  532    HB   VAL  71           HB       VAL  71  -0.506  -5.470   0.778
  533   1HG1  VAL  71          1HG1      VAL  71  -0.437  -6.286   3.733
  534   2HG1  VAL  71          2HG1      VAL  71  -1.253  -4.882   3.028
  535   3HG1  VAL  71          3HG1      VAL  71  -1.870  -6.515   2.723
  536   1HG2  VAL  71          1HG2      VAL  71   1.817  -5.119   1.025
  537   2HG2  VAL  71          2HG2      VAL  71   1.017  -4.284   2.353
  538   3HG2  VAL  71          3HG2      VAL  71   1.825  -5.832   2.662
  539    H    VAL  72           H        VAL  72   2.605  -8.121   1.518
  540    HA   VAL  72           HA       VAL  72   2.011 -10.060   3.703
  541    HB   VAL  72           HB       VAL  72   4.399 -10.085   1.952
  542   1HG1  VAL  72          1HG1      VAL  72   3.194 -12.179   3.802
  543   2HG1  VAL  72          2HG1      VAL  72   4.648 -12.388   2.803
  544   3HG1  VAL  72          3HG1      VAL  72   4.650 -11.216   4.121
  545   1HG2  VAL  72          1HG2      VAL  72   1.842 -11.719   1.651
  546   2HG2  VAL  72          2HG2      VAL  72   2.473 -10.533   0.481
  547   3HG2  VAL  72          3HG2      VAL  72   3.369 -12.028   0.791
  548    H    ILE  73           H        ILE  73   3.099  -9.838   5.547
  549    HA   ILE  73           HA       ILE  73   4.447  -7.228   6.000
  550    HB   ILE  73           HB       ILE  73   3.159  -9.053   8.027
  551   1HG1  ILE  73          2HG1      ILE  73   1.390  -8.394   6.533
  552   2HG1  ILE  73          3HG1      ILE  73   1.304  -7.468   8.024
  553   1HG2  ILE  73          1HG2      ILE  73   4.806  -7.519   8.982
  554   2HG2  ILE  73          2HG2      ILE  73   4.129  -6.159   8.085
  555   3HG2  ILE  73          3HG2      ILE  73   3.184  -6.938   9.377
  556   1HD1  ILE  73          1HD1      ILE  73   2.352  -6.416   5.370
  557   2HD1  ILE  73          2HD1      ILE  73   0.793  -6.054   6.120
  558   3HD1  ILE  73          3HD1      ILE  73   2.282  -5.495   6.894
  559    H    GLU  74           H        GLU  74   6.399  -8.346   4.978
  560    HA   GLU  74           HA       GLU  74   7.707 -10.336   6.399
  561   1HB   GLU  74          2HB       GLU  74   8.269  -8.790   4.039
  562   2HB   GLU  74          3HB       GLU  74   9.718  -9.032   5.027
  563   1HG   GLU  74          2HG       GLU  74   9.537 -10.847   3.433
  564   2HG   GLU  74          3HG       GLU  74   9.285 -11.479   5.064
  565    H    GLY  75           H        GLY  75   7.238  -7.354   7.431
  566   1HA   GLY  75          2HA       GLY  75   7.964  -6.248   9.372
  567   2HA   GLY  75          3HA       GLY  75   9.143  -7.542   9.644
  568    H    ARG  76           H        ARG  76   8.453  -4.891   7.320
  569    HA   ARG  76           HA       ARG  76   9.652  -3.564   6.075
  570   1HB   ARG  76          2HB       ARG  76  10.120  -2.593   8.150
  571   2HB   ARG  76          3HB       ARG  76  11.453  -3.696   8.491
  572   1HG   ARG  76          2HG       ARG  76  12.867  -2.699   6.854
  573   2HG   ARG  76          3HG       ARG  76  11.525  -1.798   6.119
  574   1HD   ARG  76          2HD       ARG  76  11.354  -0.395   8.119
  575   2HD   ARG  76          3HD       ARG  76  12.610  -1.375   8.930
  576    HE   ARG  76           HE       ARG  76  13.658  -0.487   6.467
  577   1HH1  ARG  76          2HH2      ARG  76  12.652   0.890   9.531
  578   2HH1  ARG  76          1HH2      ARG  76  13.757   2.235   9.501
  579   1HH2  ARG  76          2HH1      ARG  76  15.158   1.271   6.364
  580   2HH2  ARG  76          1HH1      ARG  76  15.221   2.453   7.629
  Start of MODEL   14
    1   1H    MET   1          H1        MET   1  -3.506  19.523  14.049
    2   2H    MET   1          H2        MET   1  -4.488  20.334  15.114
    3   3H    MET   1          H3        MET   1  -2.852  20.191  15.394
    4    HA   MET   1           HA       MET   1  -4.088  18.738  16.809
    5   1HB   MET   1          2HB       MET   1  -4.807  17.449  14.130
    6   2HB   MET   1          3HB       MET   1  -4.918  16.620  15.695
    7   1HG   MET   1          2HG       MET   1  -6.455  18.247  16.568
    8   2HG   MET   1          3HG       MET   1  -6.553  19.042  14.982
    9   1HE   MET   1          1HE       MET   1  -9.903  16.891  15.705
   10   2HE   MET   1          2HE       MET   1  -8.825  17.488  16.985
   11   3HE   MET   1          3HE       MET   1  -9.258  18.550  15.617
   12    H    LEU   2           H        LEU   2  -3.209  15.997  15.290
   13    HA   LEU   2           HA       LEU   2  -0.289  16.269  15.524
   14   1HB   LEU   2          2HB       LEU   2  -0.892  15.786  17.772
   15   2HB   LEU   2          3HB       LEU   2  -2.212  14.725  17.304
   16    HG   LEU   2           HG       LEU   2   0.359  13.692  16.299
   17   1HD1  LEU   2          1HD1      LEU   2   1.264  13.048  18.496
   18   2HD1  LEU   2          2HD1      LEU   2   1.284  14.807  18.275
   19   3HD1  LEU   2          3HD1      LEU   2   0.044  14.053  19.305
   20   1HD2  LEU   2          1HD2      LEU   2  -0.454  11.649  17.435
   21   2HD2  LEU   2          2HD2      LEU   2  -1.731  12.582  18.240
   22   3HD2  LEU   2          3HD2      LEU   2  -1.759  12.363  16.481
   23    H    SER   3           H        SER   3   0.260  15.416  13.554
   24    HA   SER   3           HA       SER   3  -0.658  12.753  12.973
   25   1HB   SER   3          2HB       SER   3  -0.718  14.363  10.466
   26   2HB   SER   3          3HB       SER   3  -1.746  13.035  10.979
   27    HG   SER   3           HG       SER   3  -1.929  15.670  12.024
   28    H    GLU   4           H        GLU   4   1.394  11.840  12.982
   29    HA   GLU   4           HA       GLU   4   3.685  13.394  11.944
   30   1HB   GLU   4          2HB       GLU   4   3.311  11.013  13.661
   31   2HB   GLU   4          3HB       GLU   4   4.701  10.981  12.605
   32   1HG   GLU   4          2HG       GLU   4   5.187  13.318  13.529
   33   2HG   GLU   4          3HG       GLU   4   4.049  12.866  14.802
   34    H    GLN   5           H        GLN   5   5.172  11.684  10.571
   35    HA   GLN   5           HA       GLN   5   3.478  10.120   8.728
   36   1HB   GLN   5          2HB       GLN   5   5.718  12.045   8.062
   37   2HB   GLN   5          3HB       GLN   5   5.058  10.951   6.874
   38   1HG   GLN   5          2HG       GLN   5   3.345  13.055   8.339
   39   2HG   GLN   5          3HG       GLN   5   4.245  13.373   6.886
   40   1HE2  GLN   5          1HE2      GLN   5   3.232  10.139   6.713
   41   2HE2  GLN   5          2HE2      GLN   5   1.839  10.382   5.707
   42    H    LYS   6           H        LYS   6   4.476   8.212   8.122
   43    HA   LYS   6           HA       LYS   6   7.341   8.010   8.254
   44   1HB   LYS   6          2HB       LYS   6   5.617   6.165   9.964
   45   2HB   LYS   6          3HB       LYS   6   7.175   5.665   9.295
   46   1HG   LYS   6          2HG       LYS   6   8.080   7.910  10.290
   47   2HG   LYS   6          3HG       LYS   6   6.662   7.831  11.344
   48   1HD   LYS   6          2HD       LYS   6   7.409   5.678  12.229
   49   2HD   LYS   6          3HD       LYS   6   8.647   5.539  10.955
   50   1HE   LYS   6          2HE       LYS   6   9.765   7.608  11.816
   51   2HE   LYS   6          3HE       LYS   6   8.620   7.646  13.168
   52   1HZ   LYS   6          1HZ       LYS   6  10.705   6.604  13.730
   53   2HZ   LYS   6          2HZ       LYS   6   9.488   5.501  13.841
   54   3HZ   LYS   6          3HZ       LYS   6  10.520   5.473  12.551
   55    H    GLU   7           H        GLU   7   8.165   6.156   7.277
   56    HA   GLU   7           HA       GLU   7   6.728   5.524   4.783
   57   1HB   GLU   7          2HB       GLU   7   9.687   5.208   4.935
   58   2HB   GLU   7          3HB       GLU   7   8.649   5.871   3.702
   59   1HG   GLU   7          2HG       GLU   7   9.970   7.669   4.397
   60   2HG   GLU   7          3HG       GLU   7   8.507   7.973   5.332
   61    H    ILE   8           H        ILE   8   5.729   3.641   5.536
   62    HA   ILE   8           HA       ILE   8   7.333   1.641   6.980
   63    HB   ILE   8           HB       ILE   8   4.483   1.710   6.141
   64   1HG1  ILE   8          2HG1      ILE   8   4.134   1.842   8.729
   65   2HG1  ILE   8          3HG1      ILE   8   5.855   2.182   8.869
   66   1HG2  ILE   8          1HG2      ILE   8   5.179  -0.509   6.357
   67   2HG2  ILE   8          2HG2      ILE   8   6.030  -0.105   7.899
   68   3HG2  ILE   8          3HG2      ILE   8   4.239  -0.074   7.795
   69   1HD1  ILE   8          1HD1      ILE   8   4.104   3.856   7.092
   70   2HD1  ILE   8          2HD1      ILE   8   4.061   4.086   8.860
   71   3HD1  ILE   8          3HD1      ILE   8   5.588   4.292   7.983
   72    H    ALA   9           H        ALA   9   7.218  -0.573   6.007
   73    HA   ALA   9           HA       ALA   9   7.310  -0.651   3.059
   74   1HB   ALA   9          1HB       ALA   9   9.436  -1.844   3.072
   75   2HB   ALA   9          2HB       ALA   9   9.669  -0.267   3.858
   76   3HB   ALA   9          3HB       ALA   9   9.535  -1.734   4.843
   77    H    MET  10           H        MET  10   6.552  -2.665   2.308
   78    HA   MET  10           HA       MET  10   6.616  -4.995   4.001
   79   1HB   MET  10          2HB       MET  10   4.118  -5.419   3.826
   80   2HB   MET  10          3HB       MET  10   4.656  -4.276   5.044
   81   1HG   MET  10          2HG       MET  10   3.901  -3.095   2.418
   82   2HG   MET  10          3HG       MET  10   2.606  -3.837   3.353
   83   1HE   MET  10          1HE       MET  10   2.738  -0.823   2.390
   84   2HE   MET  10          2HE       MET  10   1.355  -1.575   3.216
   85   3HE   MET  10          3HE       MET  10   2.015  -0.034   3.817
   86    H    GLN  11           H        GLN  11   5.235  -6.782   2.732
   87    HA   GLN  11           HA       GLN  11   6.428  -6.812  -0.001
   88   1HB   GLN  11          2HB       GLN  11   5.661  -8.888   2.108
   89   2HB   GLN  11          3HB       GLN  11   5.975  -9.355   0.434
   90   1HG   GLN  11          2HG       GLN  11   7.899  -7.987   2.389
   91   2HG   GLN  11          3HG       GLN  11   7.950  -9.672   1.857
   92   1HE2  GLN  11          1HE2      GLN  11   7.645  -9.704  -0.792
   93   2HE2  GLN  11          2HE2      GLN  11   8.669  -8.529  -1.611
   94    H    VAL  12           H        VAL  12   5.049  -7.705  -1.728
   95    HA   VAL  12           HA       VAL  12   2.142  -7.257  -1.182
   96    HB   VAL  12           HB       VAL  12   3.122  -5.526  -2.542
   97   1HG1  VAL  12          1HG1      VAL  12   3.786  -6.136  -4.896
   98   2HG1  VAL  12          2HG1      VAL  12   4.965  -6.567  -3.639
   99   3HG1  VAL  12          3HG1      VAL  12   3.928  -7.816  -4.367
  100   1HG2  VAL  12          1HG2      VAL  12   1.521  -5.520  -4.316
  101   2HG2  VAL  12          2HG2      VAL  12   1.318  -7.276  -4.242
  102   3HG2  VAL  12          3HG2      VAL  12   0.758  -6.251  -2.898
  103    H    SER  13           H        SER  13   0.618  -8.631  -2.370
  104    HA   SER  13           HA       SER  13   1.743 -11.052  -3.657
  105   1HB   SER  13          2HB       SER  13  -0.265 -10.948  -1.376
  106   2HB   SER  13          3HB       SER  13  -0.269 -12.283  -2.531
  107    HG   SER  13           HG       SER  13   2.094 -12.396  -1.994
  108    H    GLY  14           H        GLY  14  -0.019 -12.186  -4.864
  109   1HA   GLY  14          2HA       GLY  14  -1.532 -12.156  -6.582
  110   2HA   GLY  14          3HA       GLY  14  -2.439 -10.963  -5.633
  111    H    MET  15           H        MET  15   0.727 -10.998  -7.373
  112    HA   MET  15           HA       MET  15  -0.060  -8.570  -8.882
  113   1HB   MET  15          2HB       MET  15   2.059  -7.511  -8.394
  114   2HB   MET  15          3HB       MET  15   1.288  -7.954  -6.872
  115   1HG   MET  15          2HG       MET  15   3.462  -8.572  -6.485
  116   2HG   MET  15          3HG       MET  15   2.779 -10.112  -6.996
  117   1HE   MET  15          1HE       MET  15   5.869  -9.583  -6.726
  118   2HE   MET  15          2HE       MET  15   5.210 -11.113  -7.351
  119   3HE   MET  15          3HE       MET  15   6.492 -10.265  -8.240
  120    H    THR  16           H        THR  16   1.267  -8.215 -10.735
  121    HA   THR  16           HA       THR  16   3.249 -10.139 -11.565
  122    HB   THR  16           HB       THR  16   1.867 -10.233 -13.926
  123    HG1  THR  16           1HG      THR  16  -0.042 -10.601 -11.870
  124   1HG2  THR  16          1HG2      THR  16   1.686 -12.294 -11.667
  125   2HG2  THR  16          2HG2      THR  16   1.224 -12.555 -13.352
  126   3HG2  THR  16          3HG2      THR  16   2.908 -12.187 -12.944
  127    H    CYS  17           H        CYS  17   1.077  -7.596 -12.875
  128    HA   CYS  17           HA       CYS  17   3.357  -6.328 -14.245
  129   1HB   CYS  17          2HB       CYS  17   1.651  -4.621 -14.911
  130   2HB   CYS  17          3HB       CYS  17   1.323  -6.265 -15.484
  131    H    ALA  18           H        ALA  18   4.533  -4.685 -13.450
  132    HA   ALA  18           HA       ALA  18   4.064  -3.591 -10.777
  133   1HB   ALA  18          1HB       ALA  18   6.093  -2.275 -11.287
  134   2HB   ALA  18          2HB       ALA  18   6.339  -3.997 -11.648
  135   3HB   ALA  18          3HB       ALA  18   6.053  -2.844 -12.967
  136    H    ALA  19           H        ALA  19   1.760  -3.141 -11.920
  137    HA   ALA  19           HA       ALA  19   1.626  -0.258 -12.620
  138   1HB   ALA  19          1HB       ALA  19   0.414  -0.705 -14.708
  139   2HB   ALA  19          2HB       ALA  19   2.050  -1.388 -14.774
  140   3HB   ALA  19          3HB       ALA  19   0.653  -2.453 -14.502
  141    H    CYS  20           H        CYS  20  -0.429  -3.282 -12.593
  142    HA   CYS  20           HA       CYS  20  -2.692  -1.898 -11.489
  143   1HB   CYS  20          2HB       CYS  20  -1.846  -4.832 -11.558
  144   2HB   CYS  20          3HB       CYS  20  -3.341  -4.301 -10.808
  145    H    ALA  21           H        ALA  21   0.022  -3.682 -10.034
  146    HA   ALA  21           HA       ALA  21  -0.530  -3.206  -7.337
  147   1HB   ALA  21          1HB       ALA  21   1.897  -3.464  -7.014
  148   2HB   ALA  21          2HB       ALA  21   1.259  -4.671  -8.135
  149   3HB   ALA  21          3HB       ALA  21   2.140  -3.276  -8.774
  150    H    ALA  22           H        ALA  22   0.185  -0.746  -9.747
  151    HA   ALA  22           HA       ALA  22   1.069   1.234  -7.766
  152   1HB   ALA  22          1HB       ALA  22   0.034   1.758 -10.565
  153   2HB   ALA  22          2HB       ALA  22   1.021   2.801  -9.537
  154   3HB   ALA  22          3HB       ALA  22   1.723   1.316 -10.214
  155    H    ARG  23           H        ARG  23  -1.923   0.330  -9.544
  156    HA   ARG  23           HA       ARG  23  -3.486   2.578  -8.806
  157   1HB   ARG  23          2HB       ARG  23  -4.201  -0.273  -9.580
  158   2HB   ARG  23          3HB       ARG  23  -5.402   0.734  -8.806
  159   1HG   ARG  23          2HG       ARG  23  -5.886   1.060 -10.950
  160   2HG   ARG  23          3HG       ARG  23  -5.005   2.531 -10.555
  161   1HD   ARG  23          2HD       ARG  23  -3.249   2.007 -11.978
  162   2HD   ARG  23          3HD       ARG  23  -3.382   0.265 -11.665
  163    HE   ARG  23           HE       ARG  23  -5.719   1.090 -13.035
  164   1HH1  ARG  23          2HH2      ARG  23  -2.292   0.608 -13.638
  165   2HH1  ARG  23          1HH2      ARG  23  -2.479   0.153 -15.308
  166   1HH2  ARG  23          2HH1      ARG  23  -6.038   0.409 -15.199
  167   2HH2  ARG  23          1HH1      ARG  23  -4.688   0.030 -16.212
  168    H    ILE  24           H        ILE  24  -2.967  -0.525  -7.103
  169    HA   ILE  24           HA       ILE  24  -4.847  -0.009  -5.109
  170    HB   ILE  24           HB       ILE  24  -3.945  -1.794  -3.834
  171   1HG1  ILE  24          2HG1      ILE  24  -1.508  -1.291  -5.481
  172   2HG1  ILE  24          3HG1      ILE  24  -1.679  -1.318  -3.712
  173   1HG2  ILE  24          1HG2      ILE  24  -4.225  -3.471  -5.439
  174   2HG2  ILE  24          2HG2      ILE  24  -5.079  -2.111  -6.161
  175   3HG2  ILE  24          3HG2      ILE  24  -3.464  -2.543  -6.744
  176   1HD1  ILE  24          1HD1      ILE  24  -1.781  -3.730  -5.548
  177   2HD1  ILE  24          2HD1      ILE  24  -0.419  -3.270  -4.528
  178   3HD1  ILE  24          3HD1      ILE  24  -1.957  -3.767  -3.775
  179    H    GLU  25           H        GLU  25  -1.315   0.607  -4.874
  180    HA   GLU  25           HA       GLU  25  -1.364   2.047  -2.467
  181   1HB   GLU  25          2HB       GLU  25   0.493   1.717  -4.773
  182   2HB   GLU  25          3HB       GLU  25   0.694   3.224  -3.865
  183   1HG   GLU  25          2HG       GLU  25   2.095   1.383  -2.973
  184   2HG   GLU  25          3HG       GLU  25   0.964   2.029  -1.778
  185    H    LYS  26           H        LYS  26  -1.972   3.224  -5.771
  186    HA   LYS  26           HA       LYS  26  -1.858   6.027  -4.979
  187   1HB   LYS  26          2HB       LYS  26  -2.690   4.549  -7.476
  188   2HB   LYS  26          3HB       LYS  26  -3.243   6.205  -7.232
  189   1HG   LYS  26          2HG       LYS  26  -1.258   6.312  -8.520
  190   2HG   LYS  26          3HG       LYS  26  -0.923   6.998  -6.921
  191   1HD   LYS  26          2HD       LYS  26   0.285   4.998  -6.260
  192   2HD   LYS  26          3HD       LYS  26  -0.162   4.201  -7.788
  193   1HE   LYS  26          2HE       LYS  26   1.091   5.724  -9.129
  194   2HE   LYS  26          3HE       LYS  26   1.389   6.814  -7.765
  195   1HZ   LYS  26          1HZ       LYS  26   2.445   4.072  -7.949
  196   2HZ   LYS  26          2HZ       LYS  26   3.283   5.438  -8.321
  197   3HZ   LYS  26          3HZ       LYS  26   2.776   5.190  -6.777
  198    H    GLY  27           H        GLY  27  -4.549   3.731  -5.538
  199   1HA   GLY  27          2HA       GLY  27  -6.674   5.517  -4.791
  200   2HA   GLY  27          3HA       GLY  27  -6.712   3.743  -4.769
  201    H    LEU  28           H        LEU  28  -4.521   3.274  -2.996
  202    HA   LEU  28           HA       LEU  28  -5.885   3.539  -0.488
  203   1HB   LEU  28          2HB       LEU  28  -4.506   1.666  -0.987
  204   2HB   LEU  28          3HB       LEU  28  -3.080   2.670  -1.232
  205    HG   LEU  28           HG       LEU  28  -3.377   1.253   0.895
  206   1HD1  LEU  28          1HD1      LEU  28  -2.062   2.961   2.199
  207   2HD1  LEU  28          2HD1      LEU  28  -1.479   2.651   0.556
  208   3HD1  LEU  28          3HD1      LEU  28  -2.399   4.122   0.909
  209   1HD2  LEU  28          1HD2      LEU  28  -4.550   2.124   2.737
  210   2HD2  LEU  28          2HD2      LEU  28  -4.766   3.697   2.027
  211   3HD2  LEU  28          3HD2      LEU  28  -5.668   2.294   1.402
  212    H    LYS  29           H        LYS  29  -3.229   5.396  -1.990
  213    HA   LYS  29           HA       LYS  29  -2.648   7.145   0.059
  214   1HB   LYS  29          2HB       LYS  29  -1.782   6.994  -2.436
  215   2HB   LYS  29          3HB       LYS  29  -3.028   8.208  -2.727
  216   1HG   LYS  29          2HG       LYS  29  -1.682   9.266  -0.493
  217   2HG   LYS  29          3HG       LYS  29  -0.441   8.332  -1.298
  218   1HD   LYS  29          2HD       LYS  29  -0.126  10.279  -2.481
  219   2HD   LYS  29          3HD       LYS  29  -1.387   9.613  -3.495
  220   1HE   LYS  29          2HE       LYS  29  -1.581  11.709  -1.281
  221   2HE   LYS  29          3HE       LYS  29  -1.862  11.941  -3.001
  222   1HZ   LYS  29          1HZ       LYS  29  -3.534  10.410  -1.096
  223   2HZ   LYS  29          2HZ       LYS  29  -3.903  11.851  -1.774
  224   3HZ   LYS  29          3HZ       LYS  29  -3.827  10.494  -2.714
  225    H    ARG  30           H        ARG  30  -5.763   6.865  -1.468
  226    HA   ARG  30           HA       ARG  30  -6.547   9.638  -0.806
  227   1HB   ARG  30          2HB       ARG  30  -7.271   7.682  -2.779
  228   2HB   ARG  30          3HB       ARG  30  -8.708   8.012  -1.825
  229   1HG   ARG  30          2HG       ARG  30  -8.689  10.306  -2.432
  230   2HG   ARG  30          3HG       ARG  30  -6.974  10.273  -2.904
  231   1HD   ARG  30          2HD       ARG  30  -7.417   8.847  -4.794
  232   2HD   ARG  30          3HD       ARG  30  -9.149   8.747  -4.378
  233    HE   ARG  30           HE       ARG  30  -8.673  11.453  -4.594
  234   1HH1  ARG  30          2HH2      ARG  30  -8.275   8.689  -6.744
  235   2HH1  ARG  30          1HH2      ARG  30  -8.494   9.583  -8.215
  236   1HH2  ARG  30          2HH1      ARG  30  -9.000  12.685  -6.531
  237   2HH2  ARG  30          1HH1      ARG  30  -8.934  11.913  -8.079
  238    H    MET  31           H        MET  31  -6.218   6.855   1.028
  239    HA   MET  31           HA       MET  31  -8.689   7.210   2.559
  240   1HB   MET  31          2HB       MET  31  -6.182   5.499   2.849
  241   2HB   MET  31          3HB       MET  31  -7.217   5.750   4.229
  242   1HG   MET  31          2HG       MET  31  -9.145   5.093   2.462
  243   2HG   MET  31          3HG       MET  31  -7.786   4.247   1.742
  244   1HE   MET  31          1HE       MET  31 -10.433   4.524   4.572
  245   2HE   MET  31          2HE       MET  31 -10.761   3.351   3.270
  246   3HE   MET  31          3HE       MET  31 -10.516   2.786   4.938
  247    HA   PRO  32           HA       PRO  32  -7.306  10.231   5.504
  248   1HB   PRO  32          2HB       PRO  32  -8.121   9.147   7.917
  249   2HB   PRO  32          3HB       PRO  32  -9.233   9.900   6.737
  250   1HG   PRO  32          2HG       PRO  32  -8.581   6.952   7.022
  251   2HG   PRO  32          3HG       PRO  32 -10.203   7.709   6.965
  252   1HD   PRO  32          2HD       PRO  32  -9.154   6.659   4.758
  253   2HD   PRO  32          3HD       PRO  32  -9.936   8.252   4.640
  254    H    GLY  33           H        GLY  33  -5.470  10.590   6.768
  255   1HA   GLY  33          2HA       GLY  33  -3.624  10.127   8.045
  256   2HA   GLY  33          3HA       GLY  33  -4.028   8.411   8.046
  257    H    VAL  34           H        VAL  34  -4.127   8.410   4.944
  258    HA   VAL  34           HA       VAL  34  -1.226   8.059   4.620
  259    HB   VAL  34           HB       VAL  34  -3.388   7.501   2.579
  260   1HG1  VAL  34          1HG1      VAL  34  -1.111   7.718   1.648
  261   2HG1  VAL  34          2HG1      VAL  34  -0.451   6.690   2.917
  262   3HG1  VAL  34          3HG1      VAL  34  -1.528   6.001   1.705
  263   1HG2  VAL  34          1HG2      VAL  34  -3.861   6.124   4.546
  264   2HG2  VAL  34          2HG2      VAL  34  -3.118   5.119   3.297
  265   3HG2  VAL  34          3HG2      VAL  34  -2.151   5.664   4.683
  266    H    THR  35           H        THR  35   0.091   9.364   3.472
  267    HA   THR  35           HA       THR  35  -1.104  11.858   2.309
  268    HB   THR  35           HB       THR  35   1.005  11.325   4.254
  269    HG1  THR  35           1HG      THR  35   0.296  13.208   5.042
  270   1HG2  THR  35          1HG2      THR  35   2.554  12.033   2.618
  271   2HG2  THR  35          2HG2      THR  35   1.512  13.396   2.110
  272   3HG2  THR  35          3HG2      THR  35   2.272  13.384   3.718
  273    H    ASP  36           H        ASP  36   1.479   9.317   1.922
  274    HA   ASP  36           HA       ASP  36   1.300   9.810  -0.932
  275   1HB   ASP  36          2HB       ASP  36   3.643  10.712   0.635
  276   2HB   ASP  36          3HB       ASP  36   4.064   9.560  -0.638
  277    H    ALA  37           H        ALA  37   2.428   8.116  -2.133
  278    HA   ALA  37           HA       ALA  37   3.066   5.681  -0.684
  279   1HB   ALA  37          1HB       ALA  37   1.266   4.283  -1.593
  280   2HB   ALA  37          2HB       ALA  37   0.559   5.599  -0.643
  281   3HB   ALA  37          3HB       ALA  37   0.550   5.685  -2.418
  282    H    ASN  38           H        ASN  38   4.144   4.075  -1.888
  283    HA   ASN  38           HA       ASN  38   4.811   4.724  -4.686
  284   1HB   ASN  38          2HB       ASN  38   7.324   4.461  -3.421
  285   2HB   ASN  38          3HB       ASN  38   6.641   5.862  -4.221
  286   1HD2  ASN  38          1HD2      ASN  38   5.985   4.370  -0.970
  287   2HD2  ASN  38          2HD2      ASN  38   6.377   5.857  -0.105
  288    H    VAL  39           H        VAL  39   4.230   2.728  -5.372
  289    HA   VAL  39           HA       VAL  39   5.003   0.352  -3.861
  290    HB   VAL  39           HB       VAL  39   2.872   0.724  -5.218
  291   1HG1  VAL  39          1HG1      VAL  39   3.691   1.604  -7.276
  292   2HG1  VAL  39          2HG1      VAL  39   4.728   0.210  -7.577
  293   3HG1  VAL  39          3HG1      VAL  39   2.980   0.014  -7.599
  294   1HG2  VAL  39          1HG2      VAL  39   2.870  -1.699  -5.923
  295   2HG2  VAL  39          2HG2      VAL  39   4.543  -1.774  -5.313
  296   3HG2  VAL  39          3HG2      VAL  39   3.208  -1.316  -4.246
  297    H    ASN  40           H        ASN  40   6.749  -1.142  -4.494
  298    HA   ASN  40           HA       ASN  40   8.666  -0.092  -6.519
  299   1HB   ASN  40          2HB       ASN  40   9.214   0.824  -4.278
  300   2HB   ASN  40          3HB       ASN  40   9.324  -0.826  -3.640
  301   1HD2  ASN  40          1HD2      ASN  40  11.572   0.281  -3.152
  302   2HD2  ASN  40          2HD2      ASN  40  12.799   0.007  -4.375
  303    H    LEU  41           H        LEU  41   7.384  -1.916  -7.517
  304    HA   LEU  41           HA       LEU  41   7.777  -4.598  -6.563
  305   1HB   LEU  41          2HB       LEU  41   6.886  -3.697  -9.335
  306   2HB   LEU  41          3HB       LEU  41   6.782  -5.301  -8.643
  307    HG   LEU  41           HG       LEU  41   4.622  -4.457  -8.477
  308   1HD1  LEU  41          1HD1      LEU  41   5.411  -5.410  -6.332
  309   2HD1  LEU  41          2HD1      LEU  41   5.772  -3.774  -5.740
  310   3HD1  LEU  41          3HD1      LEU  41   4.105  -4.217  -6.135
  311   1HD2  LEU  41          1HD2      LEU  41   3.935  -2.283  -7.878
  312   2HD2  LEU  41          2HD2      LEU  41   5.533  -1.830  -7.309
  313   3HD2  LEU  41          3HD2      LEU  41   5.245  -2.083  -9.041
  314    H    ALA  42           H        ALA  42   9.682  -2.497  -8.504
  315    HA   ALA  42           HA       ALA  42  11.337  -4.145  -9.994
  316   1HB   ALA  42          1HB       ALA  42  11.536  -1.669  -9.863
  317   2HB   ALA  42          2HB       ALA  42  12.209  -1.830  -8.220
  318   3HB   ALA  42          3HB       ALA  42  13.095  -2.486  -9.607
  319    H    THR  43           H        THR  43  11.342  -3.700  -6.441
  320    HA   THR  43           HA       THR  43  13.215  -6.020  -6.247
  321    HB   THR  43           HB       THR  43  14.389  -4.021  -5.588
  322    HG1  THR  43           1HG      THR  43  13.620  -5.746  -3.491
  323   1HG2  THR  43          1HG2      THR  43  13.754  -2.714  -3.619
  324   2HG2  THR  43          2HG2      THR  43  12.476  -2.609  -4.841
  325   3HG2  THR  43          3HG2      THR  43  12.269  -3.657  -3.422
  326    H    GLU  44           H        GLU  44  10.316  -6.001  -6.511
  327    HA   GLU  44           HA       GLU  44   8.348  -6.583  -5.515
  328   1HB   GLU  44          2HB       GLU  44  10.316  -8.569  -4.330
  329   2HB   GLU  44          3HB       GLU  44   8.553  -8.735  -4.308
  330   1HG   GLU  44          2HG       GLU  44   8.504  -8.607  -6.806
  331   2HG   GLU  44          3HG       GLU  44  10.277  -8.609  -6.812
  332    H    THR  45           H        THR  45   8.850  -4.310  -4.185
  333    HA   THR  45           HA       THR  45   7.940  -4.963  -1.448
  334    HB   THR  45           HB       THR  45  10.262  -3.159  -2.280
  335    HG1  THR  45           1HG      THR  45  10.079  -5.741  -1.382
  336   1HG2  THR  45          1HG2      THR  45  10.584  -2.880   0.181
  337   2HG2  THR  45          2HG2      THR  45   9.152  -2.071  -0.482
  338   3HG2  THR  45          3HG2      THR  45   8.976  -3.611   0.418
  339    H    VAL  46           H        VAL  46   6.913  -3.020  -0.438
  340    HA   VAL  46           HA       VAL  46   6.139  -0.874  -2.338
  341    HB   VAL  46           HB       VAL  46   4.290  -2.294  -2.579
  342   1HG1  VAL  46          1HG1      VAL  46   3.090  -3.394  -0.673
  343   2HG1  VAL  46          2HG1      VAL  46   4.699  -4.043  -0.995
  344   3HG1  VAL  46          3HG1      VAL  46   4.452  -2.921   0.360
  345   1HG2  VAL  46          1HG2      VAL  46   2.445  -1.244  -1.398
  346   2HG2  VAL  46          2HG2      VAL  46   3.520  -0.540  -0.195
  347   3HG2  VAL  46          3HG2      VAL  46   3.611   0.006  -1.886
  348    H    ASN  47           H        ASN  47   5.800   1.188  -1.325
  349    HA   ASN  47           HA       ASN  47   6.322   1.238   1.590
  350   1HB   ASN  47          2HB       ASN  47   7.603   2.867  -0.652
  351   2HB   ASN  47          3HB       ASN  47   7.488   3.482   1.000
  352   1HD2  ASN  47          1HD2      ASN  47   8.300   1.885   2.767
  353   2HD2  ASN  47          2HD2      ASN  47   9.902   1.267   2.387
  354    H    VAL  48           H        VAL  48   5.028   2.778   2.680
  355    HA   VAL  48           HA       VAL  48   3.170   4.374   1.025
  356    HB   VAL  48           HB       VAL  48   2.289   2.655   3.361
  357   1HG1  VAL  48          1HG1      VAL  48   0.572   4.177   1.350
  358   2HG1  VAL  48          2HG1      VAL  48   0.094   3.483   2.913
  359   3HG1  VAL  48          3HG1      VAL  48   1.102   4.936   2.849
  360   1HG2  VAL  48          1HG2      VAL  48   1.762   2.322   0.377
  361   2HG2  VAL  48          2HG2      VAL  48   2.685   1.213   1.400
  362   3HG2  VAL  48          3HG2      VAL  48   0.945   1.412   1.665
  363    H    ILE  49           H        ILE  49   3.074   6.397   1.828
  364    HA   ILE  49           HA       ILE  49   4.711   6.955   4.198
  365    HB   ILE  49           HB       ILE  49   3.838   8.937   2.081
  366   1HG1  ILE  49          2HG1      ILE  49   5.105   7.333   0.843
  367   2HG1  ILE  49          3HG1      ILE  49   6.069   8.784   1.091
  368   1HG2  ILE  49          1HG2      ILE  49   5.783  10.225   2.984
  369   2HG2  ILE  49          2HG2      ILE  49   4.489   9.965   4.163
  370   3HG2  ILE  49          3HG2      ILE  49   5.967   8.999   4.256
  371   1HD1  ILE  49          1HD1      ILE  49   7.493   6.864   1.429
  372   2HD1  ILE  49          2HD1      ILE  49   7.235   7.638   3.001
  373   3HD1  ILE  49          3HD1      ILE  49   6.357   6.149   2.584
  374    H    TYR  50           H        TYR  50   3.290   6.964   5.946
  375    HA   TYR  50           HA       TYR  50   0.753   8.493   5.726
  376   1HB   TYR  50          2HB       TYR  50  -0.590   6.664   6.545
  377   2HB   TYR  50          3HB       TYR  50   0.150   6.236   5.022
  378    HD1  TYR  50           HD1      TYR  50   0.172   5.596   8.673
  379    HD2  TYR  50           HD2      TYR  50   1.740   4.388   4.871
  380    HE1  TYR  50           HE1      TYR  50   1.028   3.487   9.660
  381    HE2  TYR  50           HE2      TYR  50   2.155   2.118   5.756
  382    HH   TYR  50           HH       TYR  50   1.894   0.711   7.576
  383    H    ASP  51           H        ASP  51  -0.359   8.558   7.773
  384    HA   ASP  51           HA       ASP  51   1.554   9.146   9.952
  385   1HB   ASP  51          2HB       ASP  51  -0.207  10.756   9.532
  386   2HB   ASP  51          3HB       ASP  51  -1.440   9.508   9.701
  387    HA   PRO  52           HA       PRO  52   0.488   4.930  11.328
  388   1HB   PRO  52          2HB       PRO  52   2.495   4.406  13.030
  389   2HB   PRO  52          3HB       PRO  52   2.760   4.499  11.272
  390   1HG   PRO  52          2HG       PRO  52   3.165   6.735  13.307
  391   2HG   PRO  52          3HG       PRO  52   4.353   6.149  12.106
  392   1HD   PRO  52          2HD       PRO  52   2.752   8.308  11.637
  393   2HD   PRO  52          3HD       PRO  52   3.170   7.158  10.331
  394    H    ALA  53           H        ALA  53  -0.012   7.912  12.892
  395    HA   ALA  53           HA       ALA  53  -0.912   6.700  15.427
  396   1HB   ALA  53          1HB       ALA  53  -1.671   8.941  15.918
  397   2HB   ALA  53          2HB       ALA  53   0.010   9.032  15.343
  398   3HB   ALA  53          3HB       ALA  53  -1.333   9.481  14.267
  399    H    GLU  54           H        GLU  54  -1.970   7.645  12.153
  400    HA   GLU  54           HA       GLU  54  -4.765   7.418  13.015
  401   1HB   GLU  54          2HB       GLU  54  -3.682   9.541  11.878
  402   2HB   GLU  54          3HB       GLU  54  -3.956   8.643  10.388
  403   1HG   GLU  54          2HG       GLU  54  -5.935   9.828  10.557
  404   2HG   GLU  54          3HG       GLU  54  -6.424   8.370  11.437
  405    H    THR  55           H        THR  55  -2.717   6.687  10.178
  406    HA   THR  55           HA       THR  55  -4.102   4.151   9.837
  407    HB   THR  55           HB       THR  55  -2.436   4.092   7.632
  408    HG1  THR  55           1HG      THR  55  -3.668   6.436   7.412
  409   1HG2  THR  55          1HG2      THR  55  -4.562   4.588   6.488
  410   2HG2  THR  55          2HG2      THR  55  -4.820   3.434   7.826
  411   3HG2  THR  55          3HG2      THR  55  -5.284   5.156   8.019
  412    H    GLY  56           H        GLY  56  -2.119   2.624   8.837
  413   1HA   GLY  56          2HA       GLY  56  -0.147   1.722  10.506
  414   2HA   GLY  56          3HA       GLY  56  -1.719   1.369  11.281
  415    H    THR  57           H        THR  57  -1.897  -0.821  10.670
  416    HA   THR  57           HA       THR  57  -1.411  -1.737   7.924
  417    HB   THR  57           HB       THR  57  -1.904  -3.942   9.063
  418    HG1  THR  57           1HG      THR  57  -2.922  -3.632  10.922
  419   1HG2  THR  57          1HG2      THR  57   0.422  -3.022   8.819
  420   2HG2  THR  57          2HG2      THR  57   0.263  -2.193  10.377
  421   3HG2  THR  57          3HG2      THR  57   0.236  -3.964  10.311
  422    H    ALA  58           H        ALA  58  -3.923  -1.097  10.295
  423    HA   ALA  58           HA       ALA  58  -5.937  -2.627   9.493
  424   1HB   ALA  58          1HB       ALA  58  -7.487  -0.999  10.550
  425   2HB   ALA  58          2HB       ALA  58  -6.013  -1.246  11.507
  426   3HB   ALA  58          3HB       ALA  58  -6.197   0.221  10.525
  427    H    ALA  59           H        ALA  59  -5.617   0.644   8.330
  428    HA   ALA  59           HA       ALA  59  -8.090   0.349   6.755
  429   1HB   ALA  59          1HB       ALA  59  -7.008   2.517   7.867
  430   2HB   ALA  59          2HB       ALA  59  -6.265   2.666   6.247
  431   3HB   ALA  59          3HB       ALA  59  -8.030   2.593   6.445
  432    H    ILE  60           H        ILE  60  -4.650   0.149   6.234
  433    HA   ILE  60           HA       ILE  60  -4.634   0.039   3.385
  434    HB   ILE  60           HB       ILE  60  -2.710  -0.636   5.626
  435   1HG1  ILE  60          2HG1      ILE  60  -1.309   0.894   4.187
  436   2HG1  ILE  60          3HG1      ILE  60  -2.680   0.964   3.073
  437   1HG2  ILE  60          1HG2      ILE  60  -2.304  -1.499   2.731
  438   2HG2  ILE  60          2HG2      ILE  60  -1.044  -1.428   3.979
  439   3HG2  ILE  60          3HG2      ILE  60  -2.370  -2.572   4.150
  440   1HD1  ILE  60          1HD1      ILE  60  -2.689   1.896   6.003
  441   2HD1  ILE  60          2HD1      ILE  60  -2.423   2.967   4.623
  442   3HD1  ILE  60          3HD1      ILE  60  -3.991   2.197   4.842
  443    H    GLN  61           H        GLN  61  -4.711  -2.615   5.829
  444    HA   GLN  61           HA       GLN  61  -4.844  -4.613   3.826
  445   1HB   GLN  61          2HB       GLN  61  -4.925  -4.515   6.678
  446   2HB   GLN  61          3HB       GLN  61  -6.318  -5.450   6.153
  447   1HG   GLN  61          2HG       GLN  61  -5.043  -7.239   5.855
  448   2HG   GLN  61          3HG       GLN  61  -4.094  -6.436   4.615
  449   1HE2  GLN  61          1HE2      GLN  61  -2.549  -4.591   5.843
  450   2HE2  GLN  61          2HE2      GLN  61  -1.538  -5.389   7.042
  451    H    GLU  62           H        GLU  62  -7.459  -2.882   5.588
  452    HA   GLU  62           HA       GLU  62  -9.702  -4.059   4.402
  453   1HB   GLU  62          2HB       GLU  62  -9.030  -1.325   5.506
  454   2HB   GLU  62          3HB       GLU  62 -10.505  -1.480   4.573
  455   1HG   GLU  62          2HG       GLU  62 -11.125  -3.459   6.086
  456   2HG   GLU  62          3HG       GLU  62  -9.768  -2.961   7.116
  457    H    LYS  63           H        LYS  63  -7.884  -1.205   3.107
  458    HA   LYS  63           HA       LYS  63  -9.445  -1.064   0.751
  459   1HB   LYS  63          2HB       LYS  63  -6.804   0.001   1.770
  460   2HB   LYS  63          3HB       LYS  63  -7.195   0.205   0.095
  461   1HG   LYS  63          2HG       LYS  63  -9.058   1.005   2.357
  462   2HG   LYS  63          3HG       LYS  63  -7.848   2.071   1.640
  463   1HD   LYS  63          2HD       LYS  63 -10.156   0.866   0.066
  464   2HD   LYS  63          3HD       LYS  63 -10.170   2.456   0.807
  465   1HE   LYS  63          2HE       LYS  63  -8.992   3.412  -0.854
  466   2HE   LYS  63          3HE       LYS  63  -7.737   2.180  -0.792
  467   1HZ   LYS  63          1HZ       LYS  63  -8.798   2.197  -2.902
  468   2HZ   LYS  63          2HZ       LYS  63  -9.085   0.768  -2.145
  469   3HZ   LYS  63          3HZ       LYS  63 -10.277   1.904  -2.242
  470    H    ILE  64           H        ILE  64  -6.372  -2.741   1.479
  471    HA   ILE  64           HA       ILE  64  -5.438  -3.327  -1.023
  472    HB   ILE  64           HB       ILE  64  -5.242  -4.383   1.720
  473   1HG1  ILE  64          2HG1      ILE  64  -3.867  -2.515   0.638
  474   2HG1  ILE  64          3HG1      ILE  64  -3.013  -3.786   1.507
  475   1HG2  ILE  64          1HG2      ILE  64  -4.418  -6.064  -0.585
  476   2HG2  ILE  64          2HG2      ILE  64  -3.722  -6.186   1.056
  477   3HG2  ILE  64          3HG2      ILE  64  -5.444  -6.486   0.816
  478   1HD1  ILE  64          1HD1      ILE  64  -3.333  -3.689  -1.520
  479   2HD1  ILE  64          2HD1      ILE  64  -1.882  -3.243  -0.588
  480   3HD1  ILE  64          3HD1      ILE  64  -2.457  -4.918  -0.595
  481    H    GLU  65           H        GLU  65  -7.595  -5.206   1.186
  482    HA   GLU  65           HA       GLU  65  -8.407  -7.292  -0.535
  483   1HB   GLU  65          2HB       GLU  65  -9.667  -5.903   1.857
  484   2HB   GLU  65          3HB       GLU  65 -10.501  -7.216   1.016
  485   1HG   GLU  65          2HG       GLU  65  -7.645  -7.734   1.789
  486   2HG   GLU  65          3HG       GLU  65  -8.844  -7.654   3.088
  487    H    LYS  66           H        LYS  66 -10.132  -4.170   0.132
  488    HA   LYS  66           HA       LYS  66 -12.239  -4.734  -1.695
  489   1HB   LYS  66          2HB       LYS  66 -11.229  -2.235  -0.344
  490   2HB   LYS  66          3HB       LYS  66 -12.308  -2.057  -1.730
  491   1HG   LYS  66          2HG       LYS  66 -13.695  -2.067   0.188
  492   2HG   LYS  66          3HG       LYS  66 -13.959  -3.576  -0.690
  493   1HD   LYS  66          2HD       LYS  66 -12.306  -4.667   0.967
  494   2HD   LYS  66          3HD       LYS  66 -12.356  -3.136   1.867
  495   1HE   LYS  66          2HE       LYS  66 -14.865  -3.416   2.059
  496   2HE   LYS  66          3HE       LYS  66 -14.715  -4.979   1.234
  497   1HZ   LYS  66          1HZ       LYS  66 -13.289  -5.706   3.053
  498   2HZ   LYS  66          2HZ       LYS  66 -13.503  -4.267   3.829
  499   3HZ   LYS  66          3HZ       LYS  66 -14.782  -5.272   3.588
  500    H    LEU  67           H        LEU  67  -9.083  -3.313  -2.317
  501    HA   LEU  67           HA       LEU  67  -9.634  -2.557  -5.063
  502   1HB   LEU  67          2HB       LEU  67  -7.143  -2.856  -3.365
  503   2HB   LEU  67          3HB       LEU  67  -7.044  -2.497  -5.087
  504    HG   LEU  67           HG       LEU  67  -8.884  -0.812  -3.399
  505   1HD1  LEU  67          1HD1      LEU  67  -5.868  -0.708  -3.346
  506   2HD1  LEU  67          2HD1      LEU  67  -6.812   0.776  -3.141
  507   3HD1  LEU  67          3HD1      LEU  67  -6.996  -0.579  -2.019
  508   1HD2  LEU  67          1HD2      LEU  67  -7.103  -0.195  -5.800
  509   2HD2  LEU  67          2HD2      LEU  67  -8.841  -0.544  -5.871
  510   3HD2  LEU  67          3HD2      LEU  67  -8.266   0.916  -5.050
  511    H    GLY  68           H        GLY  68  -9.109  -5.603  -3.525
  512   1HA   GLY  68          2HA       GLY  68  -9.250  -7.667  -4.507
  513   2HA   GLY  68          3HA       GLY  68  -9.105  -6.953  -6.121
  514    H    TYR  69           H        TYR  69  -6.951  -6.578  -3.238
  515    HA   TYR  69           HA       TYR  69  -4.773  -8.056  -4.637
  516   1HB   TYR  69          2HB       TYR  69  -5.010  -5.197  -4.145
  517   2HB   TYR  69          3HB       TYR  69  -3.716  -5.835  -3.157
  518    HD1  TYR  69           HD1      TYR  69  -1.643  -6.563  -4.119
  519    HD2  TYR  69           HD2      TYR  69  -5.017  -5.685  -6.657
  520    HE1  TYR  69           HE1      TYR  69  -0.161  -6.475  -6.054
  521    HE2  TYR  69           HE2      TYR  69  -3.539  -5.687  -8.624
  522    HH   TYR  69           HH       TYR  69  -0.035  -6.381  -8.366
  523    H    HIS  70           H        HIS  70  -2.872  -8.250  -2.924
  524    HA   HIS  70           HA       HIS  70  -3.830  -8.253  -0.197
  525   1HB   HIS  70          2HB       HIS  70  -4.338 -10.571  -1.315
  526   2HB   HIS  70          3HB       HIS  70  -2.608 -10.849  -1.128
  527    HD1  HIS  70           1HD      HIS  70  -4.732  -9.007   1.539
  528    HD2  HIS  70           2HD      HIS  70  -3.215 -12.828   0.659
  529    HE1  HIS  70           1HE      HIS  70  -5.092 -10.424   3.617
  530    H    VAL  71           H        VAL  71  -1.990  -8.514   1.357
  531    HA   VAL  71           HA       VAL  71   0.609  -7.797   0.189
  532    HB   VAL  71           HB       VAL  71  -0.714  -5.730   0.479
  533   1HG1  VAL  71          1HG1      VAL  71  -2.005  -6.440   2.562
  534   2HG1  VAL  71          2HG1      VAL  71  -0.503  -6.264   3.488
  535   3HG1  VAL  71          3HG1      VAL  71  -1.230  -4.853   2.711
  536   1HG2  VAL  71          1HG2      VAL  71   0.914  -4.392   1.694
  537   2HG2  VAL  71          2HG2      VAL  71   1.711  -5.875   2.259
  538   3HG2  VAL  71          3HG2      VAL  71   1.632  -5.478   0.513
  539    H    VAL  72           H        VAL  72   2.313  -8.430   1.457
  540    HA   VAL  72           HA       VAL  72   1.634 -10.326   3.631
  541    HB   VAL  72           HB       VAL  72   4.066 -10.263   1.927
  542   1HG1  VAL  72          1HG1      VAL  72   4.477 -11.336   4.095
  543   2HG1  VAL  72          2HG1      VAL  72   3.028 -12.344   3.887
  544   3HG1  VAL  72          3HG1      VAL  72   4.430 -12.554   2.819
  545   1HG2  VAL  72          1HG2      VAL  72   1.590 -12.021   1.723
  546   2HG2  VAL  72          2HG2      VAL  72   2.146 -10.814   0.539
  547   3HG2  VAL  72          3HG2      VAL  72   3.100 -12.276   0.820
  548    H    ILE  73           H        ILE  73   2.620 -10.149   5.506
  549    HA   ILE  73           HA       ILE  73   4.100  -7.620   6.127
  550    HB   ILE  73           HB       ILE  73   2.348  -9.328   7.914
  551   1HG1  ILE  73          2HG1      ILE  73   0.943  -8.191   6.293
  552   2HG1  ILE  73          3HG1      ILE  73   0.809  -7.455   7.881
  553   1HG2  ILE  73          1HG2      ILE  73   2.562  -7.294   9.432
  554   2HG2  ILE  73          2HG2      ILE  73   4.015  -8.275   9.278
  555   3HG2  ILE  73          3HG2      ILE  73   3.899  -6.751   8.389
  556   1HD1  ILE  73          1HD1      ILE  73   2.334  -6.307   5.512
  557   2HD1  ILE  73          2HD1      ILE  73   0.819  -5.722   6.208
  558   3HD1  ILE  73          3HD1      ILE  73   2.315  -5.593   7.145
  559    H    GLU  74           H        GLU  74   6.070  -8.830   5.309
  560    HA   GLU  74           HA       GLU  74   7.112 -10.808   7.007
  561   1HB   GLU  74          2HB       GLU  74   8.230  -9.126   4.753
  562   2HB   GLU  74          3HB       GLU  74   9.227 -10.176   5.735
  563   1HG   GLU  74          2HG       GLU  74   7.530 -12.069   5.168
  564   2HG   GLU  74          3HG       GLU  74   6.957 -10.989   3.884
  565    H    GLY  75           H        GLY  75   6.466  -7.784   7.666
  566   1HA   GLY  75          2HA       GLY  75   8.972  -6.815   8.847
  567   2HA   GLY  75          3HA       GLY  75   7.414  -5.977   8.704
  568    H    ARG  76           H        ARG  76   6.089  -8.436  10.038
  569    HA   ARG  76           HA       ARG  76   6.753  -7.704  12.793
  570   1HB   ARG  76          2HB       ARG  76   4.758  -6.350  11.407
  571   2HB   ARG  76          3HB       ARG  76   3.841  -7.665  12.131
  572   1HG   ARG  76          2HG       ARG  76   5.541  -5.566  13.558
  573   2HG   ARG  76          3HG       ARG  76   3.783  -5.672  13.495
  574   1HD   ARG  76          2HD       ARG  76   4.123  -6.547  15.560
  575   2HD   ARG  76          3HD       ARG  76   4.148  -8.052  14.607
  576    HE   ARG  76           HE       ARG  76   6.776  -7.299  14.630
  577   1HH1  ARG  76          2HH2      ARG  76   4.411  -8.156  17.047
  578   2HH1  ARG  76          1HH2      ARG  76   5.546  -8.432  18.336
  579   1HH2  ARG  76          2HH1      ARG  76   8.351  -7.651  16.265
  580   2HH2  ARG  76          1HH1      ARG  76   7.874  -8.175  17.849
  Start of MODEL   15
    1   1H    MET   1          H1        MET   1  -2.636  15.931  18.876
    2   2H    MET   1          H2        MET   1  -2.038  16.487  20.334
    3   3H    MET   1          H3        MET   1  -2.550  17.537  19.140
    4    HA   MET   1           HA       MET   1  -0.230  17.547  19.036
    5   1HB   MET   1          2HB       MET   1  -0.503  14.500  18.929
    6   2HB   MET   1          3HB       MET   1   0.989  15.394  18.597
    7   1HG   MET   1          2HG       MET   1   1.124  14.657  20.859
    8   2HG   MET   1          3HG       MET   1   0.876  16.404  20.870
    9   1HE   MET   1          1HE       MET   1  -0.966  15.664  24.131
   10   2HE   MET   1          2HE       MET   1   0.623  15.119  23.546
   11   3HE   MET   1          3HE       MET   1   0.086  16.791  23.244
   12    H    LEU   2           H        LEU   2   1.052  16.957  16.923
   13    HA   LEU   2           HA       LEU   2  -0.784  17.263  14.624
   14   1HB   LEU   2          2HB       LEU   2   2.224  17.438  15.037
   15   2HB   LEU   2          3HB       LEU   2   1.492  17.529  13.438
   16    HG   LEU   2           HG       LEU   2   0.550  19.417  15.622
   17   1HD1  LEU   2          1HD1      LEU   2   2.233  21.055  14.835
   18   2HD1  LEU   2          2HD1      LEU   2   2.986  19.646  15.602
   19   3HD1  LEU   2          3HD1      LEU   2   2.985  19.795  13.831
   20   1HD2  LEU   2          1HD2      LEU   2  -0.729  19.280  13.475
   21   2HD2  LEU   2          2HD2      LEU   2   0.052  20.857  13.681
   22   3HD2  LEU   2          3HD2      LEU   2   0.759  19.658  12.581
   23    H    SER   3           H        SER   3  -0.643  15.819  12.785
   24    HA   SER   3           HA       SER   3  -0.207  13.068  13.284
   25   1HB   SER   3          2HB       SER   3  -0.295  14.436  10.561
   26   2HB   SER   3          3HB       SER   3  -0.821  12.821  11.007
   27    HG   SER   3           HG       SER   3  -2.646  14.085  10.956
   28    H    GLU   4           H        GLU   4   1.821  12.358  13.714
   29    HA   GLU   4           HA       GLU   4   4.230  13.283  12.308
   30   1HB   GLU   4          2HB       GLU   4   3.573  11.242  14.356
   31   2HB   GLU   4          3HB       GLU   4   4.908  10.882  13.293
   32   1HG   GLU   4          2HG       GLU   4   5.853  13.102  13.896
   33   2HG   GLU   4          3HG       GLU   4   4.609  13.183  15.152
   34    H    GLN   5           H        GLN   5   5.401  11.484  11.022
   35    HA   GLN   5           HA       GLN   5   3.528   9.866   9.371
   36   1HB   GLN   5          2HB       GLN   5   5.736  11.699   8.419
   37   2HB   GLN   5          3HB       GLN   5   5.031  10.433   7.439
   38   1HG   GLN   5          2HG       GLN   5   2.889  12.082   8.569
   39   2HG   GLN   5          3HG       GLN   5   4.088  13.105   7.777
   40   1HE2  GLN   5          1HE2      GLN   5   2.915   9.776   7.068
   41   2HE2  GLN   5          2HE2      GLN   5   2.326  10.153   5.461
   42    H    LYS   6           H        LYS   6   4.480   7.979   8.458
   43    HA   LYS   6           HA       LYS   6   7.303   7.462   8.896
   44   1HB   LYS   6          2HB       LYS   6   5.185   5.606  10.074
   45   2HB   LYS   6          3HB       LYS   6   6.890   5.181   9.824
   46   1HG   LYS   6          2HG       LYS   6   7.541   7.153  11.258
   47   2HG   LYS   6          3HG       LYS   6   5.831   7.354  11.660
   48   1HD   LYS   6          2HD       LYS   6   5.846   4.905  12.424
   49   2HD   LYS   6          3HD       LYS   6   7.613   4.956  12.218
   50   1HE   LYS   6          2HE       LYS   6   7.632   6.993  13.779
   51   2HE   LYS   6          3HE       LYS   6   5.909   6.713  14.069
   52   1HZ   LYS   6          1HZ       LYS   6   6.499   4.528  14.927
   53   2HZ   LYS   6          2HZ       LYS   6   8.100   4.853  14.701
   54   3HZ   LYS   6          3HZ       LYS   6   7.225   5.739  15.773
   55    H    GLU   7           H        GLU   7   8.016   5.577   7.734
   56    HA   GLU   7           HA       GLU   7   6.616   5.255   5.158
   57   1HB   GLU   7          2HB       GLU   7   9.606   5.054   5.642
   58   2HB   GLU   7          3HB       GLU   7   8.686   5.380   4.178
   59   1HG   GLU   7          2HG       GLU   7   9.740   7.414   4.796
   60   2HG   GLU   7          3HG       GLU   7   8.068   7.639   5.331
   61    H    ILE   8           H        ILE   8   5.596   3.260   5.683
   62    HA   ILE   8           HA       ILE   8   7.198   1.180   7.020
   63    HB   ILE   8           HB       ILE   8   4.373   1.298   6.113
   64   1HG1  ILE   8          2HG1      ILE   8   3.921   1.114   8.643
   65   2HG1  ILE   8          3HG1      ILE   8   5.651   1.330   8.926
   66   1HG2  ILE   8          1HG2      ILE   8   5.028  -0.925   6.027
   67   2HG2  ILE   8          2HG2      ILE   8   5.884  -0.749   7.614
   68   3HG2  ILE   8          3HG2      ILE   8   4.093  -0.689   7.514
   69   1HD1  ILE   8          1HD1      ILE   8   3.975   3.314   7.400
   70   2HD1  ILE   8          2HD1      ILE   8   4.054   3.318   9.184
   71   3HD1  ILE   8          3HD1      ILE   8   5.533   3.583   8.241
   72    H    ALA   9           H        ALA   9   7.168  -0.931   5.920
   73    HA   ALA   9           HA       ALA   9   7.440  -0.843   2.973
   74   1HB   ALA   9          1HB       ALA   9   9.488  -2.185   3.096
   75   2HB   ALA   9          2HB       ALA   9   9.738  -0.626   3.909
   76   3HB   ALA   9          3HB       ALA   9   9.473  -2.094   4.870
   77    H    MET  10           H        MET  10   6.445  -2.686   2.089
   78    HA   MET  10           HA       MET  10   6.091  -5.062   3.821
   79   1HB   MET  10          2HB       MET  10   3.721  -3.928   2.300
   80   2HB   MET  10          3HB       MET  10   3.765  -5.303   3.400
   81   1HG   MET  10          2HG       MET  10   4.222  -3.778   5.289
   82   2HG   MET  10          3HG       MET  10   4.078  -2.400   4.174
   83   1HE   MET  10          1HE       MET  10   0.808  -2.054   6.209
   84   2HE   MET  10          2HE       MET  10   2.421  -2.543   6.800
   85   3HE   MET  10          3HE       MET  10   2.264  -1.230   5.602
   86    H    GLN  11           H        GLN  11   5.044  -6.828   2.418
   87    HA   GLN  11           HA       GLN  11   6.489  -6.977  -0.182
   88   1HB   GLN  11          2HB       GLN  11   5.470  -8.962   1.906
   89   2HB   GLN  11          3HB       GLN  11   5.746  -9.501   0.258
   90   1HG   GLN  11          2HG       GLN  11   7.777  -8.263   2.178
   91   2HG   GLN  11          3HG       GLN  11   7.696  -9.968   1.685
   92   1HE2  GLN  11          1HE2      GLN  11   7.197  -9.712  -1.082
   93   2HE2  GLN  11          2HE2      GLN  11   8.411  -8.690  -1.817
   94    H    VAL  12           H        VAL  12   5.293  -7.357  -2.076
   95    HA   VAL  12           HA       VAL  12   2.334  -7.034  -1.817
   96    HB   VAL  12           HB       VAL  12   4.198  -6.827  -4.208
   97   1HG1  VAL  12          1HG1      VAL  12   2.153  -5.808  -5.300
   98   2HG1  VAL  12          2HG1      VAL  12   2.014  -7.541  -5.002
   99   3HG1  VAL  12          3HG1      VAL  12   1.194  -6.382  -3.924
  100   1HG2  VAL  12          1HG2      VAL  12   3.544  -4.388  -4.052
  101   2HG2  VAL  12          2HG2      VAL  12   2.727  -4.743  -2.524
  102   3HG2  VAL  12          3HG2      VAL  12   4.490  -4.941  -2.667
  103    H    SER  13           H        SER  13   0.889  -8.601  -2.843
  104    HA   SER  13           HA       SER  13   2.067 -10.956  -4.118
  105   1HB   SER  13          2HB       SER  13   0.413 -11.064  -1.555
  106   2HB   SER  13          3HB       SER  13   0.694 -12.464  -2.601
  107    HG   SER  13           HG       SER  13   3.001 -11.114  -1.966
  108    H    GLY  14           H        GLY  14   0.290 -12.312  -5.042
  109   1HA   GLY  14          2HA       GLY  14  -1.545 -12.506  -6.409
  110   2HA   GLY  14          3HA       GLY  14  -2.391 -11.417  -5.296
  111    H    MET  15           H        MET  15   0.216 -11.268  -7.805
  112    HA   MET  15           HA       MET  15  -1.021  -8.825  -8.938
  113   1HB   MET  15          2HB       MET  15   1.058  -7.641  -8.907
  114   2HB   MET  15          3HB       MET  15   0.743  -8.236  -7.272
  115   1HG   MET  15          2HG       MET  15   2.992  -8.631  -7.521
  116   2HG   MET  15          3HG       MET  15   2.315 -10.213  -7.916
  117   1HE   MET  15          1HE       MET  15   5.296  -9.421  -8.518
  118   2HE   MET  15          2HE       MET  15   4.574 -10.982  -8.971
  119   3HE   MET  15          3HE       MET  15   5.489 -10.039 -10.171
  120    H    THR  16           H        THR  16  -0.420  -8.408 -11.098
  121    HA   THR  16           HA       THR  16   0.822 -10.653 -12.626
  122    HB   THR  16           HB       THR  16  -0.258  -9.108 -14.543
  123    HG1  THR  16           1HG      THR  16  -2.177  -8.880 -12.491
  124   1HG2  THR  16          1HG2      THR  16  -0.750 -11.470 -14.287
  125   2HG2  THR  16          2HG2      THR  16  -1.770 -11.164 -12.867
  126   3HG2  THR  16          3HG2      THR  16  -2.269 -10.580 -14.474
  127    H    CYS  17           H        CYS  17   0.594  -7.017 -12.540
  128    HA   CYS  17           HA       CYS  17   3.463  -6.939 -13.299
  129   1HB   CYS  17          2HB       CYS  17   3.006  -5.442 -15.105
  130   2HB   CYS  17          3HB       CYS  17   1.962  -6.852 -15.328
  131    H    ALA  18           H        ALA  18   4.453  -4.903 -13.057
  132    HA   ALA  18           HA       ALA  18   3.822  -3.615 -10.549
  133   1HB   ALA  18          1HB       ALA  18   5.934  -2.973 -12.647
  134   2HB   ALA  18          2HB       ALA  18   5.924  -2.431 -10.956
  135   3HB   ALA  18          3HB       ALA  18   6.122  -4.156 -11.340
  136    H    ALA  19           H        ALA  19   1.678  -3.205 -12.359
  137    HA   ALA  19           HA       ALA  19   1.746  -0.231 -12.697
  138   1HB   ALA  19          1HB       ALA  19   0.496  -0.367 -14.741
  139   2HB   ALA  19          2HB       ALA  19   1.973  -1.335 -14.932
  140   3HB   ALA  19          3HB       ALA  19   0.408  -2.131 -14.658
  141    H    CYS  20           H        CYS  20  -0.467  -3.130 -12.670
  142    HA   CYS  20           HA       CYS  20  -2.597  -1.706 -11.437
  143   1HB   CYS  20          2HB       CYS  20  -1.894  -4.655 -10.990
  144   2HB   CYS  20          3HB       CYS  20  -3.493  -3.895 -10.858
  145    H    ALA  21           H        ALA  21   0.255  -3.354 -10.119
  146    HA   ALA  21           HA       ALA  21  -0.224  -3.035  -7.378
  147   1HB   ALA  21          1HB       ALA  21   1.653  -4.287  -8.537
  148   2HB   ALA  21          2HB       ALA  21   2.468  -2.719  -8.747
  149   3HB   ALA  21          3HB       ALA  21   2.122  -3.354  -7.121
  150    H    ALA  22           H        ALA  22   0.445  -0.501  -9.782
  151    HA   ALA  22           HA       ALA  22   1.209   1.512  -7.787
  152   1HB   ALA  22          1HB       ALA  22   1.072   3.066  -9.602
  153   2HB   ALA  22          2HB       ALA  22   1.900   1.616 -10.215
  154   3HB   ALA  22          3HB       ALA  22   0.194   1.919 -10.624
  155    H    ARG  23           H        ARG  23  -1.668   0.502  -9.649
  156    HA   ARG  23           HA       ARG  23  -3.386   2.622  -8.937
  157   1HB   ARG  23          2HB       ARG  23  -4.030  -0.304  -9.510
  158   2HB   ARG  23          3HB       ARG  23  -5.247   0.935  -9.320
  159   1HG   ARG  23          2HG       ARG  23  -3.005   1.132 -11.391
  160   2HG   ARG  23          3HG       ARG  23  -4.539   0.327 -11.717
  161   1HD   ARG  23          2HD       ARG  23  -4.224   3.247 -10.908
  162   2HD   ARG  23          3HD       ARG  23  -4.546   2.643 -12.544
  163    HE   ARG  23           HE       ARG  23  -6.560   1.517 -11.064
  164   1HH1  ARG  23          2HH2      ARG  23  -5.502   4.819 -11.665
  165   2HH1  ARG  23          1HH2      ARG  23  -7.051   5.551 -11.382
  166   1HH2  ARG  23          2HH1      ARG  23  -8.646   2.435 -10.696
  167   2HH2  ARG  23          1HH1      ARG  23  -8.893   4.143 -10.842
  168    H    ILE  24           H        ILE  24  -2.793  -0.484  -7.220
  169    HA   ILE  24           HA       ILE  24  -4.709   0.068  -5.234
  170    HB   ILE  24           HB       ILE  24  -3.844  -1.642  -3.887
  171   1HG1  ILE  24          2HG1      ILE  24  -1.371  -1.277  -5.495
  172   2HG1  ILE  24          3HG1      ILE  24  -1.584  -1.204  -3.733
  173   1HG2  ILE  24          1HG2      ILE  24  -3.349  -2.546  -6.747
  174   2HG2  ILE  24          2HG2      ILE  24  -4.095  -3.416  -5.388
  175   3HG2  ILE  24          3HG2      ILE  24  -4.968  -2.101  -6.172
  176   1HD1  ILE  24          1HD1      ILE  24  -0.382  -3.221  -4.282
  177   2HD1  ILE  24          2HD1      ILE  24  -2.017  -3.676  -3.748
  178   3HD1  ILE  24          3HD1      ILE  24  -1.597  -3.670  -5.484
  179    H    GLU  25           H        GLU  25  -1.169   0.682  -5.029
  180    HA   GLU  25           HA       GLU  25  -1.184   2.095  -2.622
  181   1HB   GLU  25          2HB       GLU  25   0.594   1.999  -5.033
  182   2HB   GLU  25          3HB       GLU  25   0.783   3.404  -3.969
  183   1HG   GLU  25          2HG       GLU  25   2.275   1.490  -3.373
  184   2HG   GLU  25          3HG       GLU  25   1.237   2.029  -2.052
  185    H    LYS  26           H        LYS  26  -1.968   3.386  -5.858
  186    HA   LYS  26           HA       LYS  26  -2.035   6.131  -4.807
  187   1HB   LYS  26          2HB       LYS  26  -3.175   5.101  -7.420
  188   2HB   LYS  26          3HB       LYS  26  -2.914   6.790  -6.968
  189   1HG   LYS  26          2HG       LYS  26  -0.775   4.683  -7.434
  190   2HG   LYS  26          3HG       LYS  26  -1.194   6.026  -8.492
  191   1HD   LYS  26          2HD       LYS  26  -0.315   7.629  -6.809
  192   2HD   LYS  26          3HD       LYS  26  -0.057   6.310  -5.660
  193   1HE   LYS  26          2HE       LYS  26   2.063   6.874  -6.616
  194   2HE   LYS  26          3HE       LYS  26   1.594   5.236  -7.077
  195   1HZ   LYS  26          1HZ       LYS  26   1.368   7.627  -8.792
  196   2HZ   LYS  26          2HZ       LYS  26   2.509   6.452  -8.916
  197   3HZ   LYS  26          3HZ       LYS  26   0.937   6.096  -9.228
  198    H    GLY  27           H        GLY  27  -4.524   3.675  -5.567
  199   1HA   GLY  27          2HA       GLY  27  -6.800   5.227  -4.783
  200   2HA   GLY  27          3HA       GLY  27  -6.658   3.458  -4.758
  201    H    LEU  28           H        LEU  28  -4.428   3.245  -3.000
  202    HA   LEU  28           HA       LEU  28  -5.795   3.379  -0.467
  203   1HB   LEU  28          2HB       LEU  28  -4.298   1.605  -0.997
  204   2HB   LEU  28          3HB       LEU  28  -2.949   2.696  -1.270
  205    HG   LEU  28           HG       LEU  28  -2.974   1.318   0.844
  206   1HD1  LEU  28          1HD1      LEU  28  -1.459   3.232   0.449
  207   2HD1  LEU  28          2HD1      LEU  28  -2.672   4.311   1.163
  208   3HD1  LEU  28          3HD1      LEU  28  -1.907   3.082   2.156
  209   1HD2  LEU  28          1HD2      LEU  28  -4.203   2.226   2.787
  210   2HD2  LEU  28          2HD2      LEU  28  -5.021   3.390   1.772
  211   3HD2  LEU  28          3HD2      LEU  28  -5.302   1.658   1.520
  212    H    LYS  29           H        LYS  29  -3.195   5.299  -1.975
  213    HA   LYS  29           HA       LYS  29  -2.645   7.079   0.074
  214   1HB   LYS  29          2HB       LYS  29  -1.585   6.716  -2.314
  215   2HB   LYS  29          3HB       LYS  29  -2.720   7.966  -2.811
  216   1HG   LYS  29          2HG       LYS  29  -1.448   8.985  -0.467
  217   2HG   LYS  29          3HG       LYS  29  -0.235   8.020  -1.265
  218   1HD   LYS  29          2HD       LYS  29   0.047  10.202  -2.270
  219   2HD   LYS  29          3HD       LYS  29  -0.792   9.235  -3.461
  220   1HE   LYS  29          2HE       LYS  29  -1.632  11.545  -3.136
  221   2HE   LYS  29          3HE       LYS  29  -2.904  10.327  -2.896
  222   1HZ   LYS  29          1HZ       LYS  29  -1.382  11.442  -0.641
  223   2HZ   LYS  29          2HZ       LYS  29  -2.749  12.170  -1.190
  224   3HZ   LYS  29          3HZ       LYS  29  -2.830  10.630  -0.604
  225    H    ARG  30           H        ARG  30  -5.578   6.841  -1.620
  226    HA   ARG  30           HA       ARG  30  -6.458   9.616  -1.274
  227   1HB   ARG  30          2HB       ARG  30  -7.108   7.368  -2.936
  228   2HB   ARG  30          3HB       ARG  30  -8.552   7.714  -1.999
  229   1HG   ARG  30          2HG       ARG  30  -7.012   9.910  -3.449
  230   2HG   ARG  30          3HG       ARG  30  -8.065   8.808  -4.335
  231   1HD   ARG  30          2HD       ARG  30  -9.992   9.382  -2.987
  232   2HD   ARG  30          3HD       ARG  30  -9.059  10.466  -1.973
  233    HE   ARG  30           HE       ARG  30 -10.032  10.850  -4.736
  234   1HH1  ARG  30          2HH2      ARG  30  -7.850  12.078  -2.261
  235   2HH1  ARG  30          1HH2      ARG  30  -7.657  13.653  -2.966
  236   1HH2  ARG  30          2HH1      ARG  30  -9.747  12.901  -5.760
  237   2HH2  ARG  30          1HH1      ARG  30  -8.750  14.115  -5.030
  238    H    MET  31           H        MET  31  -6.228   6.851   0.760
  239    HA   MET  31           HA       MET  31  -8.707   7.191   2.181
  240   1HB   MET  31          2HB       MET  31  -6.061   5.807   2.847
  241   2HB   MET  31          3HB       MET  31  -7.430   5.768   3.938
  242   1HG   MET  31          2HG       MET  31  -7.509   4.768   1.077
  243   2HG   MET  31          3HG       MET  31  -7.271   3.770   2.516
  244   1HE   MET  31          1HE       MET  31  -9.262   4.483   4.676
  245   2HE   MET  31          2HE       MET  31 -10.753   3.658   4.175
  246   3HE   MET  31          3HE       MET  31  -9.188   2.840   3.995
  247    HA   PRO  32           HA       PRO  32  -7.436  10.337   5.200
  248   1HB   PRO  32          2HB       PRO  32  -8.545   9.309   7.501
  249   2HB   PRO  32          3HB       PRO  32  -9.506  10.131   6.239
  250   1HG   PRO  32          2HG       PRO  32  -9.068   7.152   6.588
  251   2HG   PRO  32          3HG       PRO  32 -10.626   8.007   6.376
  252   1HD   PRO  32          2HD       PRO  32  -9.401   6.852   4.291
  253   2HD   PRO  32          3HD       PRO  32 -10.147   8.453   4.072
  254    H    GLY  33           H        GLY  33  -5.637  10.450   6.592
  255   1HA   GLY  33          2HA       GLY  33  -3.986   9.722   7.981
  256   2HA   GLY  33          3HA       GLY  33  -4.565   8.053   7.797
  257    H    VAL  34           H        VAL  34  -4.194   8.708   4.633
  258    HA   VAL  34           HA       VAL  34  -1.312   7.939   4.716
  259    HB   VAL  34           HB       VAL  34  -3.338   7.299   2.561
  260   1HG1  VAL  34          1HG1      VAL  34  -1.371   5.851   1.807
  261   2HG1  VAL  34          2HG1      VAL  34  -1.029   7.574   1.741
  262   3HG1  VAL  34          3HG1      VAL  34  -0.396   6.595   3.069
  263   1HG2  VAL  34          1HG2      VAL  34  -2.162   5.569   4.786
  264   2HG2  VAL  34          2HG2      VAL  34  -3.870   6.000   4.563
  265   3HG2  VAL  34          3HG2      VAL  34  -3.071   4.951   3.393
  266    H    THR  35           H        THR  35   0.081   9.364   3.912
  267    HA   THR  35           HA       THR  35  -1.029  11.734   2.534
  268    HB   THR  35           HB       THR  35   1.530  11.319   3.967
  269    HG1  THR  35           1HG      THR  35   0.063  11.696   5.575
  270   1HG2  THR  35          1HG2      THR  35   0.273  13.793   2.718
  271   2HG2  THR  35          2HG2      THR  35   1.665  13.799   3.817
  272   3HG2  THR  35          3HG2      THR  35   1.810  13.030   2.220
  273    H    ASP  36           H        ASP  36   1.670   9.267   2.102
  274    HA   ASP  36           HA       ASP  36   1.283   9.560  -0.755
  275   1HB   ASP  36          2HB       ASP  36   3.740  10.520   0.624
  276   2HB   ASP  36          3HB       ASP  36   3.988   9.480  -0.784
  277    H    ALA  37           H        ALA  37   2.280   7.883  -1.977
  278    HA   ALA  37           HA       ALA  37   3.115   5.483  -0.541
  279   1HB   ALA  37          1HB       ALA  37   1.235   4.074  -1.135
  280   2HB   ALA  37          2HB       ALA  37   0.585   5.496  -0.304
  281   3HB   ALA  37          3HB       ALA  37   0.481   5.381  -2.073
  282    H    ASN  38           H        ASN  38   4.019   3.803  -1.847
  283    HA   ASN  38           HA       ASN  38   4.441   4.404  -4.697
  284   1HB   ASN  38          2HB       ASN  38   7.068   4.197  -3.621
  285   2HB   ASN  38          3HB       ASN  38   6.320   5.553  -4.444
  286   1HD2  ASN  38          1HD2      ASN  38   5.939   4.193  -1.078
  287   2HD2  ASN  38          2HD2      ASN  38   6.383   5.720  -0.316
  288    H    VAL  39           H        VAL  39   4.525   2.461  -5.687
  289    HA   VAL  39           HA       VAL  39   5.015   0.077  -4.054
  290    HB   VAL  39           HB       VAL  39   2.995   0.363  -5.401
  291   1HG1  VAL  39          1HG1      VAL  39   4.673  -0.197  -7.889
  292   2HG1  VAL  39          2HG1      VAL  39   2.950   0.001  -7.770
  293   3HG1  VAL  39          3HG1      VAL  39   3.994   1.395  -7.469
  294   1HG2  VAL  39          1HG2      VAL  39   2.756  -1.851  -5.679
  295   2HG2  VAL  39          2HG2      VAL  39   4.322  -2.064  -6.494
  296   3HG2  VAL  39          3HG2      VAL  39   4.234  -1.891  -4.726
  297    H    ASN  40           H        ASN  40   7.178  -0.459  -3.836
  298    HA   ASN  40           HA       ASN  40   9.034   0.134  -6.069
  299   1HB   ASN  40          2HB       ASN  40   9.575   0.740  -3.701
  300   2HB   ASN  40          3HB       ASN  40   9.650  -0.989  -3.316
  301   1HD2  ASN  40          1HD2      ASN  40  11.927   0.252  -2.779
  302   2HD2  ASN  40          2HD2      ASN  40  13.123   0.029  -4.044
  303    H    LEU  41           H        LEU  41   7.361  -1.522  -7.063
  304    HA   LEU  41           HA       LEU  41   7.715  -4.288  -6.403
  305   1HB   LEU  41          2HB       LEU  41   5.958  -2.784  -8.013
  306   2HB   LEU  41          3HB       LEU  41   6.812  -3.799  -9.159
  307    HG   LEU  41           HG       LEU  41   4.636  -4.667  -8.273
  308   1HD1  LEU  41          1HD1      LEU  41   5.362  -6.995  -8.008
  309   2HD1  LEU  41          2HD1      LEU  41   6.239  -6.201  -9.330
  310   3HD1  LEU  41          3HD1      LEU  41   7.037  -6.474  -7.766
  311   1HD2  LEU  41          1HD2      LEU  41   6.010  -5.547  -5.734
  312   2HD2  LEU  41          2HD2      LEU  41   5.216  -3.969  -5.814
  313   3HD2  LEU  41          3HD2      LEU  41   4.297  -5.449  -6.150
  314    H    ALA  42           H        ALA  42   9.592  -2.108  -8.291
  315    HA   ALA  42           HA       ALA  42  11.123  -3.747  -9.944
  316   1HB   ALA  42          1HB       ALA  42  12.101  -1.534  -8.098
  317   2HB   ALA  42          2HB       ALA  42  12.938  -2.158  -9.529
  318   3HB   ALA  42          3HB       ALA  42  11.398  -1.286  -9.719
  319    H    THR  43           H        THR  43  11.126  -3.567  -6.358
  320    HA   THR  43           HA       THR  43  13.025  -5.873  -6.383
  321    HB   THR  43           HB       THR  43  14.150  -3.897  -5.562
  322    HG1  THR  43           1HG      THR  43  13.530  -5.898  -3.671
  323   1HG2  THR  43          1HG2      THR  43  12.229  -3.931  -3.190
  324   2HG2  THR  43          2HG2      THR  43  13.571  -2.816  -3.482
  325   3HG2  THR  43          3HG2      THR  43  12.134  -2.760  -4.517
  326    H    GLU  44           H        GLU  44  10.073  -5.861  -6.583
  327    HA   GLU  44           HA       GLU  44   8.173  -6.617  -5.571
  328   1HB   GLU  44          2HB       GLU  44  10.244  -8.570  -4.522
  329   2HB   GLU  44          3HB       GLU  44   8.501  -8.778  -4.353
  330   1HG   GLU  44          2HG       GLU  44   8.980  -8.203  -7.131
  331   2HG   GLU  44          3HG       GLU  44  10.120  -9.458  -6.625
  332    H    THR  45           H        THR  45   8.718  -4.354  -4.195
  333    HA   THR  45           HA       THR  45   7.806  -5.089  -1.483
  334    HB   THR  45           HB       THR  45  10.146  -3.292  -2.271
  335    HG1  THR  45           1HG      THR  45   9.965  -5.882  -1.519
  336   1HG2  THR  45          1HG2      THR  45   8.974  -2.243  -0.444
  337   2HG2  THR  45          2HG2      THR  45   8.923  -3.794   0.451
  338   3HG2  THR  45          3HG2      THR  45  10.475  -2.976   0.154
  339    H    VAL  46           H        VAL  46   6.650  -3.284  -0.483
  340    HA   VAL  46           HA       VAL  46   5.922  -1.041  -2.313
  341    HB   VAL  46           HB       VAL  46   4.025  -2.496  -2.348
  342   1HG1  VAL  46          1HG1      VAL  46   4.130  -2.512   0.686
  343   2HG1  VAL  46          2HG1      VAL  46   2.812  -3.178  -0.297
  344   3HG1  VAL  46          3HG1      VAL  46   4.410  -3.915  -0.381
  345   1HG2  VAL  46          1HG2      VAL  46   2.310  -1.131  -1.315
  346   2HG2  VAL  46          2HG2      VAL  46   3.488  -0.254  -0.347
  347   3HG2  VAL  46          3HG2      VAL  46   3.523  -0.108  -2.121
  348    H    ASN  47           H        ASN  47   5.740   0.997  -1.285
  349    HA   ASN  47           HA       ASN  47   6.404   1.053   1.594
  350   1HB   ASN  47          2HB       ASN  47   7.676   2.609  -0.691
  351   2HB   ASN  47          3HB       ASN  47   7.563   3.308   0.928
  352   1HD2  ASN  47          1HD2      ASN  47   8.266   1.676   2.782
  353   2HD2  ASN  47          2HD2      ASN  47   9.887   1.076   2.471
  354    H    VAL  48           H        VAL  48   5.208   2.598   2.751
  355    HA   VAL  48           HA       VAL  48   3.288   4.219   1.211
  356    HB   VAL  48           HB       VAL  48   2.106   2.173   1.532
  357   1HG1  VAL  48          1HG1      VAL  48   2.842   2.324   4.471
  358   2HG1  VAL  48          2HG1      VAL  48   1.587   1.273   3.785
  359   3HG1  VAL  48          3HG1      VAL  48   3.271   1.076   3.296
  360   1HG2  VAL  48          1HG2      VAL  48   0.724   4.036   1.617
  361   2HG2  VAL  48          2HG2      VAL  48   0.230   3.064   3.011
  362   3HG2  VAL  48          3HG2      VAL  48   1.227   4.515   3.234
  363    H    ILE  49           H        ILE  49   3.264   6.182   1.993
  364    HA   ILE  49           HA       ILE  49   4.894   6.742   4.369
  365    HB   ILE  49           HB       ILE  49   4.072   8.670   2.158
  366   1HG1  ILE  49          2HG1      ILE  49   5.247   6.998   0.966
  367   2HG1  ILE  49          3HG1      ILE  49   6.284   8.405   1.163
  368   1HG2  ILE  49          1HG2      ILE  49   6.264   8.777   4.258
  369   2HG2  ILE  49          2HG2      ILE  49   5.997   9.974   2.974
  370   3HG2  ILE  49          3HG2      ILE  49   4.774   9.729   4.227
  371   1HD1  ILE  49          1HD1      ILE  49   6.486   5.811   2.759
  372   2HD1  ILE  49          2HD1      ILE  49   7.580   6.371   1.488
  373   3HD1  ILE  49          3HD1      ILE  49   7.489   7.254   3.017
  374    H    TYR  50           H        TYR  50   3.351   6.690   6.046
  375    HA   TYR  50           HA       TYR  50   0.791   8.181   5.623
  376   1HB   TYR  50          2HB       TYR  50  -0.530   6.471   6.535
  377   2HB   TYR  50          3HB       TYR  50   0.286   5.870   5.132
  378    HD1  TYR  50           HD1      TYR  50   0.331   5.828   8.888
  379    HD2  TYR  50           HD2      TYR  50   1.321   3.757   5.266
  380    HE1  TYR  50           HE1      TYR  50   0.730   3.777  10.181
  381    HE2  TYR  50           HE2      TYR  50   1.501   1.635   6.529
  382    HH   TYR  50           HH       TYR  50   1.438   1.496  10.019
  383    H    ASP  51           H        ASP  51  -0.353   8.526   7.538
  384    HA   ASP  51           HA       ASP  51   1.459   9.414   9.646
  385   1HB   ASP  51          2HB       ASP  51  -1.461  10.032   9.175
  386   2HB   ASP  51          3HB       ASP  51  -0.346  10.772  10.348
  387    HA   PRO  52           HA       PRO  52  -0.015   5.607  11.596
  388   1HB   PRO  52          2HB       PRO  52   1.856   5.224  13.528
  389   2HB   PRO  52          3HB       PRO  52   2.202   5.006  11.788
  390   1HG   PRO  52          2HG       PRO  52   2.692   7.504  13.441
  391   2HG   PRO  52          3HG       PRO  52   3.869   6.605  12.436
  392   1HD   PRO  52          2HD       PRO  52   2.566   8.749  11.468
  393   2HD   PRO  52          3HD       PRO  52   2.815   7.317  10.426
  394    H    ALA  53           H        ALA  53  -0.668   8.625  12.567
  395    HA   ALA  53           HA       ALA  53  -1.627   8.030  15.291
  396   1HB   ALA  53          1HB       ALA  53  -0.726  10.287  14.786
  397   2HB   ALA  53          2HB       ALA  53  -1.893  10.447  13.451
  398   3HB   ALA  53          3HB       ALA  53  -2.469  10.342  15.129
  399    H    GLU  54           H        GLU  54  -2.462   7.897  11.868
  400    HA   GLU  54           HA       GLU  54  -5.347   7.728  12.522
  401   1HB   GLU  54          2HB       GLU  54  -3.880   9.415  10.621
  402   2HB   GLU  54          3HB       GLU  54  -5.035   8.345   9.811
  403   1HG   GLU  54          2HG       GLU  54  -6.875   9.106  11.170
  404   2HG   GLU  54          3HG       GLU  54  -5.791  10.210  12.042
  405    H    THR  55           H        THR  55  -2.854   6.646  10.107
  406    HA   THR  55           HA       THR  55  -4.307   4.079   9.943
  407    HB   THR  55           HB       THR  55  -2.714   3.543   7.975
  408    HG1  THR  55           1HG      THR  55  -2.865   6.286   7.803
  409   1HG2  THR  55          1HG2      THR  55  -4.359   4.505   6.501
  410   2HG2  THR  55          2HG2      THR  55  -5.086   3.707   7.921
  411   3HG2  THR  55          3HG2      THR  55  -5.036   5.488   7.828
  412    H    GLY  56           H        GLY  56  -2.227   2.391   9.457
  413   1HA   GLY  56          2HA       GLY  56  -0.368   1.735  11.258
  414   2HA   GLY  56          3HA       GLY  56  -1.761   2.019  12.316
  415    H    THR  57           H        THR  57  -0.758   0.430   9.602
  416    HA   THR  57           HA       THR  57  -1.338  -0.560   7.909
  417    HB   THR  57           HB       THR  57  -1.048  -2.991   8.115
  418    HG1  THR  57           1HG      THR  57  -1.430  -2.434  10.874
  419   1HG2  THR  57          1HG2      THR  57   0.735  -1.652  10.207
  420   2HG2  THR  57          2HG2      THR  57   1.085  -3.077   9.225
  421   3HG2  THR  57          3HG2      THR  57   0.976  -1.475   8.463
  422    H    ALA  58           H        ALA  58  -3.749  -1.159  10.389
  423    HA   ALA  58           HA       ALA  58  -5.871  -2.415   9.490
  424   1HB   ALA  58          1HB       ALA  58  -5.821  -0.898  11.398
  425   2HB   ALA  58          2HB       ALA  58  -5.667   0.497  10.327
  426   3HB   ALA  58          3HB       ALA  58  -7.181  -0.450  10.339
  427    H    ALA  59           H        ALA  59  -5.187   0.861   8.163
  428    HA   ALA  59           HA       ALA  59  -7.653   0.470   6.558
  429   1HB   ALA  59          1HB       ALA  59  -5.680   2.694   6.099
  430   2HB   ALA  59          2HB       ALA  59  -7.367   2.613   5.605
  431   3HB   ALA  59          3HB       ALA  59  -6.996   2.751   7.331
  432    H    ILE  60           H        ILE  60  -4.222   0.338   6.071
  433    HA   ILE  60           HA       ILE  60  -4.093   0.046   3.255
  434    HB   ILE  60           HB       ILE  60  -2.302  -0.496   5.634
  435   1HG1  ILE  60          2HG1      ILE  60  -0.798   0.914   4.126
  436   2HG1  ILE  60          3HG1      ILE  60  -2.190   1.051   3.045
  437   1HG2  ILE  60          1HG2      ILE  60  -1.865  -2.498   4.353
  438   2HG2  ILE  60          2HG2      ILE  60  -1.670  -1.531   2.862
  439   3HG2  ILE  60          3HG2      ILE  60  -0.534  -1.351   4.224
  440   1HD1  ILE  60          1HD1      ILE  60  -2.047   1.890   6.014
  441   2HD1  ILE  60          2HD1      ILE  60  -1.785   3.000   4.663
  442   3HD1  ILE  60          3HD1      ILE  60  -3.382   2.285   4.911
  443    H    GLN  61           H        GLN  61  -4.268  -2.496   5.830
  444    HA   GLN  61           HA       GLN  61  -4.385  -4.550   3.847
  445   1HB   GLN  61          2HB       GLN  61  -4.417  -4.391   6.708
  446   2HB   GLN  61          3HB       GLN  61  -5.747  -5.421   6.194
  447   1HG   GLN  61          2HG       GLN  61  -4.401  -7.137   5.768
  448   2HG   GLN  61          3HG       GLN  61  -3.377  -6.201   4.688
  449   1HE2  GLN  61          1HE2      GLN  61  -2.128  -4.348   6.216
  450   2HE2  GLN  61          2HE2      GLN  61  -1.167  -5.168   7.445
  451    H    GLU  62           H        GLU  62  -7.018  -2.902   5.701
  452    HA   GLU  62           HA       GLU  62  -9.224  -4.173   4.626
  453   1HB   GLU  62          2HB       GLU  62  -8.646  -1.393   5.635
  454   2HB   GLU  62          3HB       GLU  62 -10.123  -1.604   4.709
  455   1HG   GLU  62          2HG       GLU  62 -10.775  -1.899   6.934
  456   2HG   GLU  62          3HG       GLU  62 -10.724  -3.537   6.278
  457    H    LYS  63           H        LYS  63  -7.583  -1.297   3.158
  458    HA   LYS  63           HA       LYS  63  -9.292  -1.366   0.880
  459   1HB   LYS  63          2HB       LYS  63  -6.859   0.110   1.802
  460   2HB   LYS  63          3HB       LYS  63  -7.244   0.181   0.118
  461   1HG   LYS  63          2HG       LYS  63  -9.321   0.841   2.244
  462   2HG   LYS  63          3HG       LYS  63  -8.141   1.991   1.639
  463   1HD   LYS  63          2HD       LYS  63 -10.046   2.467   0.417
  464   2HD   LYS  63          3HD       LYS  63  -8.960   1.652  -0.706
  465   1HE   LYS  63          2HE       LYS  63 -10.315  -0.308  -0.747
  466   2HE   LYS  63          3HE       LYS  63 -11.135   0.116   0.779
  467   1HZ   LYS  63          1HZ       LYS  63 -11.472   1.509  -1.789
  468   2HZ   LYS  63          2HZ       LYS  63 -12.539   0.462  -1.108
  469   3HZ   LYS  63          3HZ       LYS  63 -12.224   1.898  -0.377
  470    H    ILE  64           H        ILE  64  -6.066  -2.759   1.582
  471    HA   ILE  64           HA       ILE  64  -5.125  -3.263  -0.932
  472    HB   ILE  64           HB       ILE  64  -4.821  -4.327   1.769
  473   1HG1  ILE  64          2HG1      ILE  64  -3.463  -2.508   0.645
  474   2HG1  ILE  64          3HG1      ILE  64  -2.581  -3.802   1.455
  475   1HG2  ILE  64          1HG2      ILE  64  -4.066  -6.129  -0.477
  476   2HG2  ILE  64          2HG2      ILE  64  -3.360  -6.152   1.163
  477   3HG2  ILE  64          3HG2      ILE  64  -5.077  -6.461   0.954
  478   1HD1  ILE  64          1HD1      ILE  64  -3.057  -3.610  -1.544
  479   2HD1  ILE  64          2HD1      ILE  64  -1.544  -3.273  -0.670
  480   3HD1  ILE  64          3HD1      ILE  64  -2.199  -4.920  -0.719
  481    H    GLU  65           H        GLU  65  -7.188  -5.268   1.244
  482    HA   GLU  65           HA       GLU  65  -7.944  -7.344  -0.519
  483   1HB   GLU  65          2HB       GLU  65  -9.179  -6.094   1.957
  484   2HB   GLU  65          3HB       GLU  65 -10.018  -7.379   1.082
  485   1HG   GLU  65          2HG       GLU  65  -7.131  -7.806   1.837
  486   2HG   GLU  65          3HG       GLU  65  -8.393  -7.976   3.065
  487    H    LYS  66           H        LYS  66  -9.837  -4.358   0.301
  488    HA   LYS  66           HA       LYS  66 -11.920  -4.993  -1.527
  489   1HB   LYS  66          2HB       LYS  66 -11.082  -2.475  -0.103
  490   2HB   LYS  66          3HB       LYS  66 -12.203  -2.342  -1.460
  491   1HG   LYS  66          2HG       LYS  66 -13.594  -2.497   0.371
  492   2HG   LYS  66          3HG       LYS  66 -13.653  -4.101  -0.375
  493   1HD   LYS  66          2HD       LYS  66 -11.873  -4.822   1.343
  494   2HD   LYS  66          3HD       LYS  66 -12.105  -3.266   2.136
  495   1HE   LYS  66          2HE       LYS  66 -14.153  -5.505   1.734
  496   2HE   LYS  66          3HE       LYS  66 -13.400  -5.008   3.255
  497   1HZ   LYS  66          1HZ       LYS  66 -15.277  -3.398   1.655
  498   2HZ   LYS  66          2HZ       LYS  66 -15.600  -4.146   3.079
  499   3HZ   LYS  66          3HZ       LYS  66 -14.542  -2.889   3.043
  500    H    LEU  67           H        LEU  67  -8.864  -3.375  -2.178
  501    HA   LEU  67           HA       LEU  67  -9.554  -2.501  -4.860
  502   1HB   LEU  67          2HB       LEU  67  -6.984  -2.780  -3.277
  503   2HB   LEU  67          3HB       LEU  67  -6.965  -2.347  -4.982
  504    HG   LEU  67           HG       LEU  67  -8.751  -0.769  -3.114
  505   1HD1  LEU  67          1HD1      LEU  67  -6.825   0.849  -2.832
  506   2HD1  LEU  67          2HD1      LEU  67  -6.650  -0.671  -1.941
  507   3HD1  LEU  67          3HD1      LEU  67  -5.754  -0.431  -3.426
  508   1HD2  LEU  67          1HD2      LEU  67  -7.162  -0.044  -5.625
  509   2HD2  LEU  67          2HD2      LEU  67  -8.893  -0.428  -5.591
  510   3HD2  LEU  67          3HD2      LEU  67  -8.290   1.015  -4.758
  511    H    GLY  68           H        GLY  68  -8.783  -5.575  -3.462
  512   1HA   GLY  68          2HA       GLY  68  -8.981  -7.594  -4.544
  513   2HA   GLY  68          3HA       GLY  68  -8.808  -6.821  -6.126
  514    H    TYR  69           H        TYR  69  -6.693  -6.577  -3.188
  515    HA   TYR  69           HA       TYR  69  -4.513  -8.031  -4.609
  516   1HB   TYR  69          2HB       TYR  69  -4.714  -5.177  -4.001
  517   2HB   TYR  69          3HB       TYR  69  -3.400  -5.890  -3.096
  518    HD1  TYR  69           HD1      TYR  69  -1.377  -6.595  -4.156
  519    HD2  TYR  69           HD2      TYR  69  -4.823  -5.586  -6.541
  520    HE1  TYR  69           HE1      TYR  69   0.044  -6.408  -6.154
  521    HE2  TYR  69           HE2      TYR  69  -3.419  -5.482  -8.544
  522    HH   TYR  69           HH       TYR  69  -1.264  -5.668  -9.392
  523    H    HIS  70           H        HIS  70  -2.670  -8.399  -2.970
  524    HA   HIS  70           HA       HIS  70  -3.608  -8.590  -0.164
  525   1HB   HIS  70          2HB       HIS  70  -3.975 -10.771  -1.346
  526   2HB   HIS  70          3HB       HIS  70  -2.239 -10.867  -1.644
  527    HD1  HIS  70           1HD      HIS  70  -1.765  -9.789   1.665
  528    HD2  HIS  70           2HD      HIS  70  -3.804 -13.089  -0.003
  529    HE1  HIS  70           1HE      HIS  70  -1.933 -11.521   3.472
  530    H    VAL  71           H        VAL  71  -2.065  -7.713   1.122
  531    HA   VAL  71           HA       VAL  71   0.729  -7.500   0.117
  532    HB   VAL  71           HB       VAL  71  -0.593  -5.389   0.697
  533   1HG1  VAL  71          1HG1      VAL  71  -0.737  -4.703   3.003
  534   2HG1  VAL  71          2HG1      VAL  71  -1.622  -6.230   2.831
  535   3HG1  VAL  71          3HG1      VAL  71  -0.002  -6.212   3.562
  536   1HG2  VAL  71          1HG2      VAL  71   1.788  -5.365   0.377
  537   2HG2  VAL  71          2HG2      VAL  71   1.333  -4.296   1.709
  538   3HG2  VAL  71          3HG2      VAL  71   2.045  -5.888   2.061
  539    H    VAL  72           H        VAL  72   2.357  -8.235   1.534
  540    HA   VAL  72           HA       VAL  72   1.573 -10.033   3.767
  541    HB   VAL  72           HB       VAL  72   3.798 -10.320   1.804
  542   1HG1  VAL  72          1HG1      VAL  72   4.579 -11.105   3.962
  543   2HG1  VAL  72          2HG1      VAL  72   3.079 -12.029   4.215
  544   3HG1  VAL  72          3HG1      VAL  72   4.231 -12.506   2.951
  545   1HG2  VAL  72          1HG2      VAL  72   1.329 -12.059   2.296
  546   2HG2  VAL  72          2HG2      VAL  72   1.584 -11.026   0.875
  547   3HG2  VAL  72          3HG2      VAL  72   2.628 -12.427   1.144
  548    H    ILE  73           H        ILE  73   2.930  -9.855   5.548
  549    HA   ILE  73           HA       ILE  73   4.605  -7.387   5.672
  550    HB   ILE  73           HB       ILE  73   2.747  -8.477   7.785
  551   1HG1  ILE  73          2HG1      ILE  73   1.972  -5.957   7.430
  552   2HG1  ILE  73          3HG1      ILE  73   2.685  -6.163   5.833
  553   1HG2  ILE  73          1HG2      ILE  73   3.369  -6.494   9.058
  554   2HG2  ILE  73          2HG2      ILE  73   4.800  -7.483   8.786
  555   3HG2  ILE  73          3HG2      ILE  73   4.550  -6.022   7.812
  556   1HD1  ILE  73          1HD1      ILE  73   1.129  -8.047   5.448
  557   2HD1  ILE  73          2HD1      ILE  73   0.537  -7.877   7.124
  558   3HD1  ILE  73          3HD1      ILE  73   0.265  -6.579   5.935
  559    H    GLU  74           H        GLU  74   6.363  -8.859   4.964
  560    HA   GLU  74           HA       GLU  74   7.405 -10.741   6.765
  561   1HB   GLU  74          2HB       GLU  74   8.263  -9.482   4.183
  562   2HB   GLU  74          3HB       GLU  74   9.440 -10.352   5.157
  563   1HG   GLU  74          2HG       GLU  74   6.821 -11.695   4.459
  564   2HG   GLU  74          3HG       GLU  74   8.201 -11.706   3.347
  565    H    GLY  75           H        GLY  75   7.148  -7.619   7.204
  566   1HA   GLY  75          2HA       GLY  75   9.523  -7.383   8.989
  567   2HA   GLY  75          3HA       GLY  75   9.186  -6.090   7.818
  568    H    ARG  76           H        ARG  76   7.335  -8.182  10.049
  569    HA   ARG  76           HA       ARG  76   5.395  -6.126  10.695
  570   1HB   ARG  76          2HB       ARG  76   5.167  -8.773  10.781
  571   2HB   ARG  76          3HB       ARG  76   5.921  -8.582  12.371
  572   1HG   ARG  76          2HG       ARG  76   4.021  -6.698  12.647
  573   2HG   ARG  76          3HG       ARG  76   3.244  -7.620  11.347
  574   1HD   ARG  76          2HD       ARG  76   3.504  -9.689  12.791
  575   2HD   ARG  76          3HD       ARG  76   4.169  -8.625  14.063
  576    HE   ARG  76           HE       ARG  76   1.635  -7.649  13.126
  577   1HH1  ARG  76          2HH2      ARG  76   3.056 -10.110  15.190
  578   2HH1  ARG  76          1HH2      ARG  76   1.667 -10.318  16.212
  579   1HH2  ARG  76          2HH1      ARG  76  -0.265  -7.904  14.423
  580   2HH2  ARG  76          1HH1      ARG  76  -0.283  -9.020  15.749
  Start of MODEL   16
    1   1H    MET   1          H1        MET   1  -3.721  16.441  17.537
    2   2H    MET   1          H2        MET   1  -5.291  16.949  17.251
    3   3H    MET   1          H3        MET   1  -4.424  16.115  16.101
    4    HA   MET   1           HA       MET   1  -4.325  18.316  15.422
    5   1HB   MET   1          2HB       MET   1  -3.703  20.132  16.847
    6   2HB   MET   1          3HB       MET   1  -4.973  19.241  17.676
    7   1HG   MET   1          2HG       MET   1  -2.891  18.039  18.884
    8   2HG   MET   1          3HG       MET   1  -2.023  19.456  18.291
    9   1HE   MET   1          1HE       MET   1  -5.640  18.853  19.887
   10   2HE   MET   1          2HE       MET   1  -4.447  17.918  20.827
   11   3HE   MET   1          3HE       MET   1  -5.254  19.321  21.557
   12    H    LEU   2           H        LEU   2  -2.399  18.701  14.244
   13    HA   LEU   2           HA       LEU   2  -0.382  18.248  13.418
   14   1HB   LEU   2          2HB       LEU   2   0.189  18.539  16.232
   15   2HB   LEU   2          3HB       LEU   2   1.161  17.205  15.637
   16    HG   LEU   2           HG       LEU   2   1.040  19.831  14.102
   17   1HD1  LEU   2          1HD1      LEU   2   2.930  20.670  15.448
   18   2HD1  LEU   2          2HD1      LEU   2   1.445  20.516  16.399
   19   3HD1  LEU   2          3HD1      LEU   2   2.736  19.305  16.571
   20   1HD2  LEU   2          1HD2      LEU   2   3.269  17.790  14.572
   21   2HD2  LEU   2          2HD2      LEU   2   2.249  17.863  13.120
   22   3HD2  LEU   2          3HD2      LEU   2   3.346  19.201  13.499
   23    H    SER   3           H        SER   3   0.801  16.492  12.540
   24    HA   SER   3           HA       SER   3  -0.121  13.740  13.147
   25   1HB   SER   3          2HB       SER   3  -0.437  15.265  10.511
   26   2HB   SER   3          3HB       SER   3  -0.584  13.515  10.661
   27    HG   SER   3           HG       SER   3  -2.317  13.750  11.977
   28    H    GLU   4           H        GLU   4   1.760  12.534  13.174
   29    HA   GLU   4           HA       GLU   4   4.200  13.568  11.912
   30   1HB   GLU   4          2HB       GLU   4   3.521  11.449  13.858
   31   2HB   GLU   4          3HB       GLU   4   4.830  11.071  12.763
   32   1HG   GLU   4          2HG       GLU   4   5.794  13.315  13.397
   33   2HG   GLU   4          3HG       GLU   4   4.603  13.315  14.702
   34    H    GLN   5           H        GLN   5   5.415  11.686  10.650
   35    HA   GLN   5           HA       GLN   5   3.583  10.207   8.880
   36   1HB   GLN   5          2HB       GLN   5   5.861  12.016   8.081
   37   2HB   GLN   5          3HB       GLN   5   5.150  10.885   6.954
   38   1HG   GLN   5          2HG       GLN   5   3.350  12.939   8.330
   39   2HG   GLN   5          3HG       GLN   5   4.425  13.430   7.044
   40   1HE2  GLN   5          1HE2      GLN   5   3.102  10.139   6.877
   41   2HE2  GLN   5          2HE2      GLN   5   2.024  10.498   5.544
   42    H    LYS   6           H        LYS   6   4.469   8.231   8.354
   43    HA   LYS   6           HA       LYS   6   7.351   7.755   8.652
   44   1HB   LYS   6          2HB       LYS   6   5.233   6.051  10.016
   45   2HB   LYS   6          3HB       LYS   6   6.843   5.472   9.606
   46   1HG   LYS   6          2HG       LYS   6   7.130   7.984  10.997
   47   2HG   LYS   6          3HG       LYS   6   6.100   6.966  11.966
   48   1HD   LYS   6          2HD       LYS   6   8.801   6.132  10.794
   49   2HD   LYS   6          3HD       LYS   6   8.586   6.911  12.365
   50   1HE   LYS   6          2HE       LYS   6   8.762   4.679  12.962
   51   2HE   LYS   6          3HE       LYS   6   7.022   4.982  13.017
   52   1HZ   LYS   6          1HZ       LYS   6   7.590   2.914  11.915
   53   2HZ   LYS   6          2HZ       LYS   6   6.860   3.936  10.853
   54   3HZ   LYS   6          3HZ       LYS   6   8.489   3.711  10.788
   55    H    GLU   7           H        GLU   7   8.046   5.936   7.578
   56    HA   GLU   7           HA       GLU   7   6.571   5.273   5.112
   57   1HB   GLU   7          2HB       GLU   7   9.575   5.127   5.381
   58   2HB   GLU   7          3HB       GLU   7   8.538   5.498   4.011
   59   1HG   GLU   7          2HG       GLU   7   9.651   7.490   4.517
   60   2HG   GLU   7          3HG       GLU   7   8.079   7.756   5.278
   61    H    ILE   8           H        ILE   8   5.675   3.245   5.709
   62    HA   ILE   8           HA       ILE   8   7.336   1.289   7.124
   63    HB   ILE   8           HB       ILE   8   4.619   1.015   5.990
   64   1HG1  ILE   8          2HG1      ILE   8   4.282   2.982   7.219
   65   2HG1  ILE   8          3HG1      ILE   8   3.617   1.601   8.111
   66   1HG2  ILE   8          1HG2      ILE   8   4.316  -0.567   7.822
   67   2HG2  ILE   8          2HG2      ILE   8   5.695  -1.005   6.795
   68   3HG2  ILE   8          3HG2      ILE   8   5.997  -0.217   8.349
   69   1HD1  ILE   8          1HD1      ILE   8   4.819   3.181   9.536
   70   2HD1  ILE   8          2HD1      ILE   8   5.479   1.523   9.564
   71   3HD1  ILE   8          3HD1      ILE   8   6.312   2.792   8.627
   72    H    ALA   9           H        ALA   9   7.569  -0.904   6.026
   73    HA   ALA   9           HA       ALA   9   7.685  -0.804   3.069
   74   1HB   ALA   9          1HB       ALA   9   9.956  -0.187   4.011
   75   2HB   ALA   9          2HB       ALA   9   9.977  -1.747   4.848
   76   3HB   ALA   9          3HB       ALA   9   9.940  -1.696   3.072
   77    H    MET  10           H        MET  10   6.918  -2.779   2.239
   78    HA   MET  10           HA       MET  10   7.106  -5.225   3.813
   79   1HB   MET  10          2HB       MET  10   4.682  -5.578   4.063
   80   2HB   MET  10          3HB       MET  10   5.219  -4.147   4.930
   81   1HG   MET  10          2HG       MET  10   4.537  -2.861   2.747
   82   2HG   MET  10          3HG       MET  10   3.640  -4.334   2.374
   83   1HE   MET  10          1HE       MET  10   4.422  -1.887   5.290
   84   2HE   MET  10          2HE       MET  10   3.765  -0.952   3.934
   85   3HE   MET  10          3HE       MET  10   2.854  -1.048   5.462
   86    H    GLN  11           H        GLN  11   5.549  -6.958   2.596
   87    HA   GLN  11           HA       GLN  11   6.549  -6.942  -0.201
   88   1HB   GLN  11          2HB       GLN  11   5.783  -9.111   1.813
   89   2HB   GLN  11          3HB       GLN  11   5.898  -9.466   0.096
   90   1HG   GLN  11          2HG       GLN  11   8.124  -8.460   1.920
   91   2HG   GLN  11          3HG       GLN  11   7.955 -10.089   1.237
   92   1HE2  GLN  11          1HE2      GLN  11   7.429  -9.859  -1.349
   93   2HE2  GLN  11          2HE2      GLN  11   8.367  -8.618  -2.175
   94    H    VAL  12           H        VAL  12   5.123  -8.064  -1.787
   95    HA   VAL  12           HA       VAL  12   2.254  -7.274  -1.435
   96    HB   VAL  12           HB       VAL  12   4.035  -7.061  -3.906
   97   1HG1  VAL  12          1HG1      VAL  12   1.760  -7.495  -4.625
   98   2HG1  VAL  12          2HG1      VAL  12   1.111  -6.325  -3.449
   99   3HG1  VAL  12          3HG1      VAL  12   2.076  -5.775  -4.833
  100   1HG2  VAL  12          1HG2      VAL  12   2.883  -4.943  -2.051
  101   2HG2  VAL  12          2HG2      VAL  12   4.610  -5.302  -2.311
  102   3HG2  VAL  12          3HG2      VAL  12   3.650  -4.593  -3.610
  103    H    SER  13           H        SER  13   0.702  -8.617  -2.654
  104    HA   SER  13           HA       SER  13   1.754 -10.866  -4.184
  105   1HB   SER  13          2HB       SER  13   0.158 -11.215  -1.625
  106   2HB   SER  13          3HB       SER  13   0.109 -12.432  -2.908
  107    HG   SER  13           HG       SER  13   2.613 -11.475  -2.066
  108    H    GLY  14           H        GLY  14  -0.067 -12.025  -5.247
  109   1HA   GLY  14          2HA       GLY  14  -1.814 -11.928  -6.746
  110   2HA   GLY  14          3HA       GLY  14  -2.553 -10.641  -5.776
  111    H    MET  15           H        MET  15   0.585 -10.930  -7.533
  112    HA   MET  15           HA       MET  15  -0.074  -8.519  -9.129
  113   1HB   MET  15          2HB       MET  15   2.126  -7.608  -8.763
  114   2HB   MET  15          3HB       MET  15   1.343  -7.902  -7.214
  115   1HG   MET  15          2HG       MET  15   3.441  -8.662  -6.759
  116   2HG   MET  15          3HG       MET  15   2.688 -10.178  -7.250
  117   1HE   MET  15          1HE       MET  15   6.391 -10.569  -8.446
  118   2HE   MET  15          2HE       MET  15   5.769  -9.858  -6.945
  119   3HE   MET  15          3HE       MET  15   5.036 -11.345  -7.596
  120    H    THR  16           H        THR  16   1.043  -8.394 -11.083
  121    HA   THR  16           HA       THR  16   2.809 -10.184 -12.261
  122    HB   THR  16           HB       THR  16   0.804 -11.070 -13.964
  123    HG1  THR  16           1HG      THR  16   0.005 -11.563 -11.305
  124   1HG2  THR  16          1HG2      THR  16   2.689 -12.442 -13.303
  125   2HG2  THR  16          2HG2      THR  16   2.120 -12.583 -11.637
  126   3HG2  THR  16          3HG2      THR  16   1.187 -13.308 -12.959
  127    H    CYS  17           H        CYS  17  -0.095  -8.243 -12.962
  128    HA   CYS  17           HA       CYS  17   0.587  -7.263 -15.452
  129   1HB   CYS  17          2HB       CYS  17  -0.702  -5.649 -13.217
  130   2HB   CYS  17          3HB       CYS  17  -0.885  -5.393 -14.959
  131    H    ALA  18           H        ALA  18   2.184  -6.518 -12.451
  132    HA   ALA  18           HA       ALA  18   3.857  -5.125 -11.843
  133   1HB   ALA  18          1HB       ALA  18   4.954  -6.499 -13.601
  134   2HB   ALA  18          2HB       ALA  18   4.587  -5.238 -14.797
  135   3HB   ALA  18          3HB       ALA  18   5.671  -4.885 -13.439
  136    H    ALA  19           H        ALA  19   1.377  -3.873 -12.441
  137    HA   ALA  19           HA       ALA  19   2.195  -1.068 -12.686
  138   1HB   ALA  19          1HB       ALA  19   0.353  -2.348 -14.758
  139   2HB   ALA  19          2HB       ALA  19   0.668  -0.606 -14.579
  140   3HB   ALA  19          3HB       ALA  19   1.981  -1.701 -15.052
  141    H    CYS  20           H        CYS  20  -0.626  -3.327 -12.697
  142    HA   CYS  20           HA       CYS  20  -2.480  -1.835 -11.333
  143   1HB   CYS  20          2HB       CYS  20  -1.747  -4.801 -11.170
  144   2HB   CYS  20          3HB       CYS  20  -3.222  -4.157 -10.453
  145    H    ALA  21           H        ALA  21   0.303  -3.518  -9.889
  146    HA   ALA  21           HA       ALA  21  -0.278  -3.066  -7.190
  147   1HB   ALA  21          1HB       ALA  21   2.486  -3.018  -8.444
  148   2HB   ALA  21          2HB       ALA  21   2.022  -3.535  -6.795
  149   3HB   ALA  21          3HB       ALA  21   1.541  -4.499  -8.187
  150    H    ALA  22           H        ALA  22   0.644  -0.703  -9.635
  151    HA   ALA  22           HA       ALA  22   1.227   1.438  -7.713
  152   1HB   ALA  22          1HB       ALA  22   2.105   1.408 -10.089
  153   2HB   ALA  22          2HB       ALA  22   0.434   1.684 -10.638
  154   3HB   ALA  22          3HB       ALA  22   1.240   2.884  -9.616
  155    H    ARG  23           H        ARG  23  -1.562   0.303  -9.654
  156    HA   ARG  23           HA       ARG  23  -3.327   2.487  -9.052
  157   1HB   ARG  23          2HB       ARG  23  -4.023  -0.447  -9.542
  158   2HB   ARG  23          3HB       ARG  23  -5.152   0.892  -9.533
  159   1HG   ARG  23          2HG       ARG  23  -2.892   0.515 -11.558
  160   2HG   ARG  23          3HG       ARG  23  -4.600   0.146 -11.786
  161   1HD   ARG  23          2HD       ARG  23  -4.369   2.226 -12.811
  162   2HD   ARG  23          3HD       ARG  23  -5.099   2.591 -11.232
  163    HE   ARG  23           HE       ARG  23  -2.193   2.668 -11.203
  164   1HH1  ARG  23          2HH2      ARG  23  -5.032   4.561 -12.074
  165   2HH1  ARG  23          1HH2      ARG  23  -4.270   6.112 -11.910
  166   1HH2  ARG  23          2HH1      ARG  23  -1.105   4.699 -11.062
  167   2HH2  ARG  23          1HH1      ARG  23  -1.962   6.182 -11.333
  168    H    ILE  24           H        ILE  24  -2.705  -0.628  -7.368
  169    HA   ILE  24           HA       ILE  24  -4.573  -0.034  -5.350
  170    HB   ILE  24           HB       ILE  24  -3.824  -1.712  -4.016
  171   1HG1  ILE  24          2HG1      ILE  24  -1.237  -1.470  -5.439
  172   2HG1  ILE  24          3HG1      ILE  24  -1.556  -1.276  -3.697
  173   1HG2  ILE  24          1HG2      ILE  24  -4.744  -2.175  -6.426
  174   2HG2  ILE  24          2HG2      ILE  24  -3.099  -2.740  -6.776
  175   3HG2  ILE  24          3HG2      ILE  24  -4.057  -3.486  -5.480
  176   1HD1  ILE  24          1HD1      ILE  24  -2.104  -3.732  -3.622
  177   2HD1  ILE  24          2HD1      ILE  24  -1.530  -3.813  -5.314
  178   3HD1  ILE  24          3HD1      ILE  24  -0.408  -3.365  -4.023
  179    H    GLU  25           H        GLU  25  -0.998   0.489  -5.076
  180    HA   GLU  25           HA       GLU  25  -1.050   1.836  -2.665
  181   1HB   GLU  25          2HB       GLU  25   0.762   1.929  -5.060
  182   2HB   GLU  25          3HB       GLU  25   1.001   3.134  -3.783
  183   1HG   GLU  25          2HG       GLU  25   0.790   0.172  -3.122
  184   2HG   GLU  25          3HG       GLU  25   2.316   0.975  -3.522
  185    H    LYS  26           H        LYS  26  -1.789   3.236  -5.857
  186    HA   LYS  26           HA       LYS  26  -1.839   5.939  -4.784
  187   1HB   LYS  26          2HB       LYS  26  -2.503   4.800  -7.478
  188   2HB   LYS  26          3HB       LYS  26  -3.005   6.430  -7.018
  189   1HG   LYS  26          2HG       LYS  26  -0.917   6.684  -8.096
  190   2HG   LYS  26          3HG       LYS  26  -0.644   7.003  -6.381
  191   1HD   LYS  26          2HD       LYS  26   0.280   4.630  -6.158
  192   2HD   LYS  26          3HD       LYS  26  -0.091   4.441  -7.864
  193   1HE   LYS  26          2HE       LYS  26   2.195   4.818  -7.884
  194   2HE   LYS  26          3HE       LYS  26   1.529   6.395  -8.309
  195   1HZ   LYS  26          1HZ       LYS  26   1.895   7.071  -6.005
  196   2HZ   LYS  26          2HZ       LYS  26   2.496   5.631  -5.577
  197   3HZ   LYS  26          3HZ       LYS  26   3.288   6.543  -6.677
  198    H    GLY  27           H        GLY  27  -4.361   3.478  -5.565
  199   1HA   GLY  27          2HA       GLY  27  -6.604   5.122  -4.776
  200   2HA   GLY  27          3HA       GLY  27  -6.553   3.356  -4.906
  201    H    LEU  28           H        LEU  28  -4.310   3.076  -3.095
  202    HA   LEU  28           HA       LEU  28  -5.557   2.844  -0.502
  203   1HB   LEU  28          2HB       LEU  28  -3.963   1.330  -1.395
  204   2HB   LEU  28          3HB       LEU  28  -2.714   2.567  -1.442
  205    HG   LEU  28           HG       LEU  28  -4.071   1.789   1.140
  206   1HD1  LEU  28          1HD1      LEU  28  -3.374  -0.263   0.178
  207   2HD1  LEU  28          2HD1      LEU  28  -1.765   0.385  -0.220
  208   3HD1  LEU  28          3HD1      LEU  28  -2.243   0.159   1.478
  209   1HD2  LEU  28          1HD2      LEU  28  -1.315   2.910   0.351
  210   2HD2  LEU  28          2HD2      LEU  28  -2.620   3.817   1.144
  211   3HD2  LEU  28          3HD2      LEU  28  -1.788   2.513   2.011
  212    H    LYS  29           H        LYS  29  -3.061   5.072  -1.867
  213    HA   LYS  29           HA       LYS  29  -2.763   6.804   0.237
  214   1HB   LYS  29          2HB       LYS  29  -1.702   6.913  -2.124
  215   2HB   LYS  29          3HB       LYS  29  -3.135   7.848  -2.578
  216   1HG   LYS  29          2HG       LYS  29  -2.512   9.283  -0.413
  217   2HG   LYS  29          3HG       LYS  29  -0.932   8.556  -0.632
  218   1HD   LYS  29          2HD       LYS  29  -2.519  10.156  -2.715
  219   2HD   LYS  29          3HD       LYS  29  -1.254  10.800  -1.685
  220   1HE   LYS  29          2HE       LYS  29   0.154   8.754  -2.806
  221   2HE   LYS  29          3HE       LYS  29  -1.029   9.019  -4.092
  222   1HZ   LYS  29          1HZ       LYS  29  -0.287  11.438  -3.948
  223   2HZ   LYS  29          2HZ       LYS  29   0.928  10.914  -2.947
  224   3HZ   LYS  29          3HZ       LYS  29   0.894  10.389  -4.444
  225    H    ARG  30           H        ARG  30  -5.559   6.656  -1.935
  226    HA   ARG  30           HA       ARG  30  -6.703   9.159  -1.133
  227   1HB   ARG  30          2HB       ARG  30  -7.356   6.918  -2.915
  228   2HB   ARG  30          3HB       ARG  30  -8.798   7.512  -2.122
  229   1HG   ARG  30          2HG       ARG  30  -6.907   9.552  -3.292
  230   2HG   ARG  30          3HG       ARG  30  -7.775   8.505  -4.412
  231   1HD   ARG  30          2HD       ARG  30  -9.942   9.228  -3.606
  232   2HD   ARG  30          3HD       ARG  30  -9.226   9.938  -2.162
  233    HE   ARG  30           HE       ARG  30  -8.952  11.881  -3.225
  234   1HH1  ARG  30          2HH2      ARG  30  -9.080   9.402  -5.719
  235   2HH1  ARG  30          1HH2      ARG  30  -8.965  10.501  -7.062
  236   1HH2  ARG  30          2HH1      ARG  30  -8.843  13.383  -4.965
  237   2HH2  ARG  30          1HH1      ARG  30  -8.844  12.833  -6.607
  238    H    MET  31           H        MET  31  -6.319   6.561   0.915
  239    HA   MET  31           HA       MET  31  -8.880   6.790   2.293
  240   1HB   MET  31          2HB       MET  31  -7.958   5.194   3.772
  241   2HB   MET  31          3HB       MET  31  -7.280   4.800   2.202
  242   1HG   MET  31          2HG       MET  31  -5.133   5.811   2.874
  243   2HG   MET  31          3HG       MET  31  -5.852   6.379   4.370
  244   1HE   MET  31          1HE       MET  31  -5.743   3.199   2.277
  245   2HE   MET  31          2HE       MET  31  -4.071   3.207   2.861
  246   3HE   MET  31          3HE       MET  31  -5.221   1.992   3.460
  247    HA   PRO  32           HA       PRO  32  -7.561  10.143   5.061
  248   1HB   PRO  32          2HB       PRO  32  -8.610   9.478   7.490
  249   2HB   PRO  32          3HB       PRO  32  -9.622  10.021   6.119
  250   1HG   PRO  32          2HG       PRO  32  -9.072   7.177   6.992
  251   2HG   PRO  32          3HG       PRO  32 -10.655   7.917   6.618
  252   1HD   PRO  32          2HD       PRO  32  -9.290   6.432   4.820
  253   2HD   PRO  32          3HD       PRO  32 -10.222   7.851   4.284
  254    H    GLY  33           H        GLY  33  -5.659  10.490   6.207
  255   1HA   GLY  33          2HA       GLY  33  -4.097  10.070   7.842
  256   2HA   GLY  33          3HA       GLY  33  -4.511   8.362   7.885
  257    H    VAL  34           H        VAL  34  -4.199   8.103   4.829
  258    HA   VAL  34           HA       VAL  34  -1.236   8.026   4.777
  259    HB   VAL  34           HB       VAL  34  -3.234   7.199   2.665
  260   1HG1  VAL  34          1HG1      VAL  34  -0.215   6.789   2.941
  261   2HG1  VAL  34          2HG1      VAL  34  -1.231   5.951   1.760
  262   3HG1  VAL  34          3HG1      VAL  34  -1.046   7.708   1.675
  263   1HG2  VAL  34          1HG2      VAL  34  -2.769   4.922   3.362
  264   2HG2  VAL  34          2HG2      VAL  34  -1.614   5.443   4.578
  265   3HG2  VAL  34          3HG2      VAL  34  -3.320   5.817   4.793
  266    H    THR  35           H        THR  35   0.055   9.363   3.562
  267    HA   THR  35           HA       THR  35  -1.324  11.645   2.187
  268    HB   THR  35           HB       THR  35   0.645  11.644   4.321
  269    HG1  THR  35           1HG      THR  35  -0.128  13.720   4.477
  270   1HG2  THR  35          1HG2      THR  35   1.320  13.217   1.799
  271   2HG2  THR  35          2HG2      THR  35   1.923  13.605   3.411
  272   3HG2  THR  35          3HG2      THR  35   2.342  12.045   2.691
  273    H    ASP  36           H        ASP  36   1.416   9.248   1.991
  274    HA   ASP  36           HA       ASP  36   1.160   9.565  -0.874
  275   1HB   ASP  36          2HB       ASP  36   3.475  10.703   0.567
  276   2HB   ASP  36          3HB       ASP  36   3.959   9.485  -0.618
  277    H    ALA  37           H        ALA  37   2.485   7.921  -2.008
  278    HA   ALA  37           HA       ALA  37   2.886   5.411  -0.604
  279   1HB   ALA  37          1HB       ALA  37   0.335   5.866  -2.215
  280   2HB   ALA  37          2HB       ALA  37   0.876   4.276  -1.675
  281   3HB   ALA  37          3HB       ALA  37   0.435   5.490  -0.478
  282    H    ASN  38           H        ASN  38   3.902   3.801  -1.797
  283    HA   ASN  38           HA       ASN  38   4.659   4.473  -4.546
  284   1HB   ASN  38          2HB       ASN  38   7.161   4.244  -3.191
  285   2HB   ASN  38          3HB       ASN  38   6.543   5.527  -4.220
  286   1HD2  ASN  38          1HD2      ASN  38   5.950   4.438  -0.810
  287   2HD2  ASN  38          2HD2      ASN  38   6.317   6.019  -0.129
  288    H    VAL  39           H        VAL  39   4.463   2.589  -5.465
  289    HA   VAL  39           HA       VAL  39   4.934   0.105  -4.021
  290    HB   VAL  39           HB       VAL  39   2.995   0.332  -5.421
  291   1HG1  VAL  39          1HG1      VAL  39   3.539   1.866  -7.154
  292   2HG1  VAL  39          2HG1      VAL  39   4.803   0.823  -7.823
  293   3HG1  VAL  39          3HG1      VAL  39   3.146   0.301  -7.884
  294   1HG2  VAL  39          1HG2      VAL  39   4.046  -1.837  -5.063
  295   2HG2  VAL  39          2HG2      VAL  39   3.189  -1.713  -6.607
  296   3HG2  VAL  39          3HG2      VAL  39   4.953  -1.624  -6.584
  297    H    ASN  40           H        ASN  40   7.141  -0.283  -3.651
  298    HA   ASN  40           HA       ASN  40   9.070   0.277  -5.817
  299   1HB   ASN  40          2HB       ASN  40   9.536   0.866  -3.459
  300   2HB   ASN  40          3HB       ASN  40   9.494  -0.851  -3.032
  301   1HD2  ASN  40          1HD2      ASN  40  11.777  -0.067  -2.294
  302   2HD2  ASN  40          2HD2      ASN  40  13.053  -0.238  -3.490
  303    H    LEU  41           H        LEU  41   7.422  -1.374  -6.899
  304    HA   LEU  41           HA       LEU  41   7.870  -4.172  -6.377
  305   1HB   LEU  41          2HB       LEU  41   6.156  -2.588  -8.090
  306   2HB   LEU  41          3HB       LEU  41   6.929  -3.790  -9.076
  307    HG   LEU  41           HG       LEU  41   4.694  -4.382  -8.080
  308   1HD1  LEU  41          1HD1      LEU  41   7.083  -6.229  -7.794
  309   2HD1  LEU  41          2HD1      LEU  41   5.403  -6.773  -7.607
  310   3HD1  LEU  41          3HD1      LEU  41   5.950  -6.087  -9.150
  311   1HD2  LEU  41          1HD2      LEU  41   5.369  -3.654  -5.660
  312   2HD2  LEU  41          2HD2      LEU  41   4.402  -5.120  -5.898
  313   3HD2  LEU  41          3HD2      LEU  41   6.125  -5.244  -5.554
  314    H    ALA  42           H        ALA  42   9.645  -1.818  -8.111
  315    HA   ALA  42           HA       ALA  42  11.285  -3.236  -9.846
  316   1HB   ALA  42          1HB       ALA  42  13.050  -1.694  -9.205
  317   2HB   ALA  42          2HB       ALA  42  11.509  -0.800  -9.245
  318   3HB   ALA  42          3HB       ALA  42  12.222  -1.308  -7.689
  319    H    THR  43           H        THR  43  11.238  -3.330  -6.258
  320    HA   THR  43           HA       THR  43  12.879  -5.799  -6.425
  321    HB   THR  43           HB       THR  43  14.389  -4.144  -5.591
  322    HG1  THR  43           1HG      THR  43  13.332  -5.804  -3.571
  323   1HG2  THR  43          1HG2      THR  43  12.257  -3.436  -3.529
  324   2HG2  THR  43          2HG2      THR  43  13.953  -2.916  -3.467
  325   3HG2  THR  43          3HG2      THR  43  12.926  -2.401  -4.812
  326    H    GLU  44           H        GLU  44  10.119  -5.646  -6.651
  327    HA   GLU  44           HA       GLU  44   8.153  -6.408  -5.806
  328   1HB   GLU  44          2HB       GLU  44  10.217  -8.339  -4.703
  329   2HB   GLU  44          3HB       GLU  44   8.479  -8.668  -4.745
  330   1HG   GLU  44          2HG       GLU  44   8.399  -8.421  -7.169
  331   2HG   GLU  44          3HG       GLU  44  10.122  -8.006  -7.222
  332    H    THR  45           H        THR  45   9.115  -4.205  -4.076
  333    HA   THR  45           HA       THR  45   8.009  -5.048  -1.442
  334    HB   THR  45           HB       THR  45  10.082  -2.919  -2.154
  335    HG1  THR  45           1HG      THR  45  10.758  -5.202  -2.358
  336   1HG2  THR  45          1HG2      THR  45  10.565  -2.972   0.272
  337   2HG2  THR  45          2HG2      THR  45   8.913  -2.415  -0.042
  338   3HG2  THR  45          3HG2      THR  45   9.207  -4.093   0.505
  339    H    VAL  46           H        VAL  46   6.815  -3.202  -0.360
  340    HA   VAL  46           HA       VAL  46   6.000  -0.983  -2.166
  341    HB   VAL  46           HB       VAL  46   4.184  -2.519  -2.336
  342   1HG1  VAL  46          1HG1      VAL  46   2.881  -3.280  -0.351
  343   2HG1  VAL  46          2HG1      VAL  46   4.522  -3.944  -0.344
  344   3HG1  VAL  46          3HG1      VAL  46   4.111  -2.560   0.691
  345   1HG2  VAL  46          1HG2      VAL  46   3.355  -0.423  -0.286
  346   2HG2  VAL  46          2HG2      VAL  46   3.697  -0.077  -1.993
  347   3HG2  VAL  46          3HG2      VAL  46   2.365  -1.170  -1.550
  348    H    ASN  47           H        ASN  47   5.646   1.031  -1.118
  349    HA   ASN  47           HA       ASN  47   6.330   1.134   1.758
  350   1HB   ASN  47          2HB       ASN  47   7.551   2.675  -0.585
  351   2HB   ASN  47          3HB       ASN  47   7.544   3.329   1.053
  352   1HD2  ASN  47          1HD2      ASN  47   8.398   1.753   2.814
  353   2HD2  ASN  47          2HD2      ASN  47   9.984   1.133   2.381
  354    H    VAL  48           H        VAL  48   4.983   2.627   2.865
  355    HA   VAL  48           HA       VAL  48   3.113   4.227   1.223
  356    HB   VAL  48           HB       VAL  48   1.896   2.232   1.689
  357   1HG1  VAL  48          1HG1      VAL  48   3.166   1.184   3.418
  358   2HG1  VAL  48          2HG1      VAL  48   2.808   2.475   4.570
  359   3HG1  VAL  48          3HG1      VAL  48   1.515   1.397   4.007
  360   1HG2  VAL  48          1HG2      VAL  48   1.124   4.544   3.498
  361   2HG2  VAL  48          2HG2      VAL  48   0.546   4.151   1.878
  362   3HG2  VAL  48          3HG2      VAL  48   0.118   3.114   3.255
  363    H    ILE  49           H        ILE  49   3.026   6.259   2.003
  364    HA   ILE  49           HA       ILE  49   4.665   6.829   4.366
  365    HB   ILE  49           HB       ILE  49   3.870   8.776   2.171
  366   1HG1  ILE  49          2HG1      ILE  49   5.048   7.124   0.972
  367   2HG1  ILE  49          3HG1      ILE  49   6.111   8.504   1.217
  368   1HG2  ILE  49          1HG2      ILE  49   6.014   8.846   4.327
  369   2HG2  ILE  49          2HG2      ILE  49   5.850  10.027   3.011
  370   3HG2  ILE  49          3HG2      ILE  49   4.565   9.855   4.213
  371   1HD1  ILE  49          1HD1      ILE  49   7.451   6.557   1.563
  372   2HD1  ILE  49          2HD1      ILE  49   7.162   7.248   3.163
  373   3HD1  ILE  49          3HD1      ILE  49   6.257   5.813   2.636
  374    H    TYR  50           H        TYR  50   3.241   6.984   6.127
  375    HA   TYR  50           HA       TYR  50   0.757   8.610   5.829
  376   1HB   TYR  50          2HB       TYR  50  -0.658   6.875   6.652
  377   2HB   TYR  50          3HB       TYR  50   0.224   6.289   5.257
  378    HD1  TYR  50           HD1      TYR  50   1.871   4.438   5.512
  379    HD2  TYR  50           HD2      TYR  50  -0.273   5.986   8.892
  380    HE1  TYR  50           HE1      TYR  50   2.036   2.239   6.648
  381    HE2  TYR  50           HE2      TYR  50   0.348   3.951  10.181
  382    HH   TYR  50           HH       TYR  50   1.221   1.858  10.087
  383    H    ASP  51           H        ASP  51  -0.408   8.767   7.867
  384    HA   ASP  51           HA       ASP  51   1.503   9.390  10.067
  385   1HB   ASP  51          2HB       ASP  51  -0.101  11.108   9.507
  386   2HB   ASP  51          3HB       ASP  51  -1.447   9.995   9.773
  387    HA   PRO  52           HA       PRO  52   0.038   5.405  11.699
  388   1HB   PRO  52          2HB       PRO  52   2.051   4.713  13.356
  389   2HB   PRO  52          3HB       PRO  52   2.237   4.660  11.587
  390   1HG   PRO  52          2HG       PRO  52   3.019   6.943  13.448
  391   2HG   PRO  52          3HG       PRO  52   4.044   6.130  12.230
  392   1HD   PRO  52          2HD       PRO  52   2.713   8.465  11.702
  393   2HD   PRO  52          3HD       PRO  52   2.916   7.197  10.454
  394    H    ALA  53           H        ALA  53  -0.199   8.436  13.026
  395    HA   ALA  53           HA       ALA  53  -1.115   7.504  15.672
  396   1HB   ALA  53          1HB       ALA  53  -1.426  10.174  14.255
  397   2HB   ALA  53          2HB       ALA  53  -1.715   9.824  15.967
  398   3HB   ALA  53          3HB       ALA  53  -0.057   9.773  15.320
  399    H    GLU  54           H        GLU  54  -2.135   7.961  12.308
  400    HA   GLU  54           HA       GLU  54  -4.954   7.993  13.159
  401   1HB   GLU  54          2HB       GLU  54  -3.733   9.922  11.693
  402   2HB   GLU  54          3HB       GLU  54  -4.273   8.864  10.383
  403   1HG   GLU  54          2HG       GLU  54  -6.591   8.917  11.404
  404   2HG   GLU  54          3HG       GLU  54  -5.979  10.064  12.610
  405    H    THR  55           H        THR  55  -2.810   6.877  10.518
  406    HA   THR  55           HA       THR  55  -4.371   4.435  10.316
  407    HB   THR  55           HB       THR  55  -2.512   4.077   8.281
  408    HG1  THR  55           1HG      THR  55  -3.518   6.544   7.868
  409   1HG2  THR  55          1HG2      THR  55  -4.469   4.622   6.928
  410   2HG2  THR  55          2HG2      THR  55  -4.957   3.632   8.333
  411   3HG2  THR  55          3HG2      THR  55  -5.294   5.396   8.308
  412    H    GLY  56           H        GLY  56  -2.855   2.640   9.557
  413   1HA   GLY  56          2HA       GLY  56  -0.664   1.826  11.079
  414   2HA   GLY  56          3HA       GLY  56  -2.188   1.268  11.834
  415    H    THR  57           H        THR  57  -2.033  -0.905  11.034
  416    HA   THR  57           HA       THR  57  -1.554  -1.556   8.230
  417    HB   THR  57           HB       THR  57  -1.986  -3.865   9.276
  418    HG1  THR  57           1HG      THR  57  -2.037  -3.825  11.570
  419   1HG2  THR  57          1HG2      THR  57   0.193  -3.841  10.499
  420   2HG2  THR  57          2HG2      THR  57   0.312  -2.877   9.015
  421   3HG2  THR  57          3HG2      THR  57   0.155  -2.068  10.581
  422    H    ALA  58           H        ALA  58  -4.098  -1.158  10.600
  423    HA   ALA  58           HA       ALA  58  -6.209  -2.479   9.747
  424   1HB   ALA  58          1HB       ALA  58  -7.646  -0.708  10.698
  425   2HB   ALA  58          2HB       ALA  58  -6.237  -1.052  11.719
  426   3HB   ALA  58          3HB       ALA  58  -6.259   0.401  10.697
  427    H    ALA  59           H        ALA  59  -5.475   0.684   8.385
  428    HA   ALA  59           HA       ALA  59  -8.005   0.492   6.810
  429   1HB   ALA  59          1HB       ALA  59  -7.367   2.659   7.818
  430   2HB   ALA  59          2HB       ALA  59  -5.946   2.663   6.740
  431   3HB   ALA  59          3HB       ALA  59  -7.587   2.718   6.055
  432    H    ILE  60           H        ILE  60  -4.535   0.279   6.468
  433    HA   ILE  60           HA       ILE  60  -4.352   0.080   3.632
  434    HB   ILE  60           HB       ILE  60  -2.616  -0.518   6.031
  435   1HG1  ILE  60          2HG1      ILE  60  -1.189   0.773   4.077
  436   2HG1  ILE  60          3HG1      ILE  60  -2.780   1.368   3.717
  437   1HG2  ILE  60          1HG2      ILE  60  -1.915  -1.518   3.259
  438   2HG2  ILE  60          2HG2      ILE  60  -0.824  -1.392   4.664
  439   3HG2  ILE  60          3HG2      ILE  60  -2.183  -2.505   4.718
  440   1HD1  ILE  60          1HD1      ILE  60  -1.644   2.891   5.260
  441   2HD1  ILE  60          2HD1      ILE  60  -2.923   2.078   6.187
  442   3HD1  ILE  60          3HD1      ILE  60  -1.219   1.561   6.342
  443    H    GLN  61           H        GLN  61  -4.750  -2.556   6.046
  444    HA   GLN  61           HA       GLN  61  -4.704  -4.536   3.975
  445   1HB   GLN  61          2HB       GLN  61  -5.284  -4.505   6.841
  446   2HB   GLN  61          3HB       GLN  61  -6.438  -5.489   5.931
  447   1HG   GLN  61          2HG       GLN  61  -4.919  -7.072   6.418
  448   2HG   GLN  61          3HG       GLN  61  -4.393  -6.608   4.803
  449   1HE2  GLN  61          1HE2      GLN  61  -3.124  -4.040   5.816
  450   2HE2  GLN  61          2HE2      GLN  61  -1.663  -4.588   6.626
  451    H    GLU  62           H        GLU  62  -7.415  -2.783   5.566
  452    HA   GLU  62           HA       GLU  62  -9.600  -3.848   4.200
  453   1HB   GLU  62          2HB       GLU  62  -8.916  -1.272   5.569
  454   2HB   GLU  62          3HB       GLU  62 -10.232  -1.150   4.402
  455   1HG   GLU  62          2HG       GLU  62 -10.156  -3.252   6.598
  456   2HG   GLU  62          3HG       GLU  62 -10.957  -1.679   6.750
  457    H    LYS  63           H        LYS  63  -7.668  -0.972   3.166
  458    HA   LYS  63           HA       LYS  63  -9.045  -0.720   0.720
  459   1HB   LYS  63          2HB       LYS  63  -6.539   0.375   2.006
  460   2HB   LYS  63          3HB       LYS  63  -6.752   0.602   0.295
  461   1HG   LYS  63          2HG       LYS  63  -8.920   1.262   2.309
  462   2HG   LYS  63          3HG       LYS  63  -7.732   2.457   1.810
  463   1HD   LYS  63          2HD       LYS  63  -8.607   2.772  -0.289
  464   2HD   LYS  63          3HD       LYS  63  -8.991   1.084  -0.498
  465   1HE   LYS  63          2HE       LYS  63 -11.124   1.852  -0.412
  466   2HE   LYS  63          3HE       LYS  63 -10.903   1.518   1.302
  467   1HZ   LYS  63          1HZ       LYS  63 -11.855   3.662   0.975
  468   2HZ   LYS  63          2HZ       LYS  63 -10.331   3.888   1.556
  469   3HZ   LYS  63          3HZ       LYS  63 -10.652   4.134  -0.042
  470    H    ILE  64           H        ILE  64  -6.038  -2.462   1.596
  471    HA   ILE  64           HA       ILE  64  -5.016  -3.103  -0.857
  472    HB   ILE  64           HB       ILE  64  -4.943  -4.115   1.872
  473   1HG1  ILE  64          2HG1      ILE  64  -3.346  -2.537   0.740
  474   2HG1  ILE  64          3HG1      ILE  64  -2.658  -3.880   1.646
  475   1HG2  ILE  64          1HG2      ILE  64  -3.697  -6.150   1.405
  476   2HG2  ILE  64          2HG2      ILE  64  -5.436  -6.243   1.156
  477   3HG2  ILE  64          3HG2      ILE  64  -4.351  -6.107  -0.251
  478   1HD1  ILE  64          1HD1      ILE  64  -3.027  -3.842  -1.378
  479   2HD1  ILE  64          2HD1      ILE  64  -1.505  -3.586  -0.495
  480   3HD1  ILE  64          3HD1      ILE  64  -2.326  -5.160  -0.424
  481    H    GLU  65           H        GLU  65  -7.435  -4.886   1.159
  482    HA   GLU  65           HA       GLU  65  -8.152  -6.896  -0.713
  483   1HB   GLU  65          2HB       GLU  65  -9.507  -5.671   1.717
  484   2HB   GLU  65          3HB       GLU  65 -10.305  -6.925   0.764
  485   1HG   GLU  65          2HG       GLU  65  -7.488  -7.381   1.751
  486   2HG   GLU  65          3HG       GLU  65  -8.869  -7.613   2.828
  487    H    LYS  66           H        LYS  66  -9.891  -3.821   0.075
  488    HA   LYS  66           HA       LYS  66 -11.897  -4.199  -1.890
  489   1HB   LYS  66          2HB       LYS  66 -10.845  -1.882  -0.316
  490   2HB   LYS  66          3HB       LYS  66 -11.806  -1.465  -1.715
  491   1HG   LYS  66          2HG       LYS  66 -12.715  -3.511   0.334
  492   2HG   LYS  66          3HG       LYS  66 -13.028  -1.801   0.563
  493   1HD   LYS  66          2HD       LYS  66 -14.010  -3.399  -1.881
  494   2HD   LYS  66          3HD       LYS  66 -14.914  -3.133  -0.402
  495   1HE   LYS  66          2HE       LYS  66 -15.799  -1.440  -1.635
  496   2HE   LYS  66          3HE       LYS  66 -14.490  -0.567  -0.840
  497   1HZ   LYS  66          1HZ       LYS  66 -13.199  -0.927  -2.911
  498   2HZ   LYS  66          2HZ       LYS  66 -14.496  -1.658  -3.590
  499   3HZ   LYS  66          3HZ       LYS  66 -14.582  -0.075  -3.164
  500    H    LEU  67           H        LEU  67  -8.661  -2.945  -2.301
  501    HA   LEU  67           HA       LEU  67  -9.039  -2.004  -5.019
  502   1HB   LEU  67          2HB       LEU  67  -6.609  -2.521  -3.294
  503   2HB   LEU  67          3HB       LEU  67  -6.511  -1.899  -4.943
  504    HG   LEU  67           HG       LEU  67  -8.291  -0.503  -2.908
  505   1HD1  LEU  67          1HD1      LEU  67  -6.076  -0.632  -1.846
  506   2HD1  LEU  67          2HD1      LEU  67  -5.333  -0.028  -3.307
  507   3HD1  LEU  67          3HD1      LEU  67  -6.432   1.016  -2.388
  508   1HD2  LEU  67          1HD2      LEU  67  -8.550   0.149  -5.281
  509   2HD2  LEU  67          2HD2      LEU  67  -7.841   1.451  -4.323
  510   3HD2  LEU  67          3HD2      LEU  67  -6.812   0.475  -5.388
  511    H    GLY  68           H        GLY  68  -8.697  -5.121  -3.600
  512   1HA   GLY  68          2HA       GLY  68  -9.075  -7.098  -4.717
  513   2HA   GLY  68          3HA       GLY  68  -8.665  -6.353  -6.270
  514    H    TYR  69           H        TYR  69  -6.811  -6.435  -3.159
  515    HA   TYR  69           HA       TYR  69  -4.619  -7.949  -4.484
  516   1HB   TYR  69          2HB       TYR  69  -4.796  -5.082  -4.087
  517   2HB   TYR  69          3HB       TYR  69  -3.523  -5.711  -3.070
  518    HD1  TYR  69           HD1      TYR  69  -4.796  -5.635  -6.579
  519    HD2  TYR  69           HD2      TYR  69  -1.460  -6.530  -4.002
  520    HE1  TYR  69           HE1      TYR  69  -3.327  -5.690  -8.520
  521    HE2  TYR  69           HE2      TYR  69   0.040  -6.461  -5.934
  522    HH   TYR  69           HH       TYR  69  -1.184  -6.125  -9.276
  523    H    HIS  70           H        HIS  70  -2.718  -8.065  -2.829
  524    HA   HIS  70           HA       HIS  70  -3.669  -8.492  -0.057
  525   1HB   HIS  70          2HB       HIS  70  -3.973 -10.558  -1.474
  526   2HB   HIS  70          3HB       HIS  70  -2.232 -10.581  -1.746
  527    HD1  HIS  70           1HD      HIS  70  -4.642 -12.277   0.251
  528    HD2  HIS  70           2HD      HIS  70  -0.869 -10.554   0.931
  529    HE1  HIS  70           1HE      HIS  70  -3.645 -13.472   2.276
  530    H    VAL  71           H        VAL  71  -2.079  -7.833   1.372
  531    HA   VAL  71           HA       VAL  71   0.629  -7.193   0.300
  532    HB   VAL  71           HB       VAL  71  -0.739  -5.254   1.068
  533   1HG1  VAL  71          1HG1      VAL  71  -1.084  -4.808   3.417
  534   2HG1  VAL  71          2HG1      VAL  71  -1.912  -6.321   3.015
  535   3HG1  VAL  71          3HG1      VAL  71  -0.361  -6.354   3.881
  536   1HG2  VAL  71          1HG2      VAL  71   1.781  -5.750   2.644
  537   2HG2  VAL  71          2HG2      VAL  71   1.675  -5.166   0.960
  538   3HG2  VAL  71          3HG2      VAL  71   1.015  -4.183   2.265
  539    H    VAL  72           H        VAL  72   2.396  -8.043   1.453
  540    HA   VAL  72           HA       VAL  72   1.713 -10.112   3.501
  541    HB   VAL  72           HB       VAL  72   3.977 -10.323   1.595
  542   1HG1  VAL  72          1HG1      VAL  72   3.916 -12.699   2.258
  543   2HG1  VAL  72          2HG1      VAL  72   4.104 -11.670   3.682
  544   3HG1  VAL  72          3HG1      VAL  72   2.520 -12.380   3.306
  545   1HG2  VAL  72          1HG2      VAL  72   1.990 -10.382   0.168
  546   2HG2  VAL  72          2HG2      VAL  72   2.624 -12.022   0.371
  547   3HG2  VAL  72          3HG2      VAL  72   1.198 -11.518   1.291
  548    H    ILE  73           H        ILE  73   2.992 -10.129   5.295
  549    HA   ILE  73           HA       ILE  73   5.095  -8.028   5.528
  550    HB   ILE  73           HB       ILE  73   3.146  -8.980   7.634
  551   1HG1  ILE  73          2HG1      ILE  73   2.824  -6.346   7.593
  552   2HG1  ILE  73          3HG1      ILE  73   3.442  -6.479   5.950
  553   1HG2  ILE  73          1HG2      ILE  73   5.357  -8.521   8.663
  554   2HG2  ILE  73          2HG2      ILE  73   5.436  -6.984   7.774
  555   3HG2  ILE  73          3HG2      ILE  73   4.197  -7.249   9.031
  556   1HD1  ILE  73          1HD1      ILE  73   0.961  -6.487   6.175
  557   2HD1  ILE  73          2HD1      ILE  73   1.559  -7.968   5.405
  558   3HD1  ILE  73          3HD1      ILE  73   1.088  -7.988   7.127
  559    H    GLU  74           H        GLU  74   6.494  -9.774   4.574
  560    HA   GLU  74           HA       GLU  74   7.283 -11.875   6.269
  561   1HB   GLU  74          2HB       GLU  74   8.309 -10.655   3.706
  562   2HB   GLU  74          3HB       GLU  74   9.237 -11.855   4.591
  563   1HG   GLU  74          2HG       GLU  74   7.413 -13.482   4.446
  564   2HG   GLU  74          3HG       GLU  74   6.396 -12.305   3.594
  565    H    GLY  75           H        GLY  75   7.533  -8.755   6.720
  566   1HA   GLY  75          2HA       GLY  75  10.307  -8.331   7.498
  567   2HA   GLY  75          3HA       GLY  75   8.909  -7.270   7.797
  568    H    ARG  76           H        ARG  76   7.702  -9.964   8.954
  569    HA   ARG  76           HA       ARG  76   8.957  -9.969  11.586
  570   1HB   ARG  76          2HB       ARG  76   7.135  -8.291  11.737
  571   2HB   ARG  76          3HB       ARG  76   5.975  -9.475  11.098
  572   1HG   ARG  76          2HG       ARG  76   6.084 -10.830  13.024
  573   2HG   ARG  76          3HG       ARG  76   7.634 -10.141  13.539
  574   1HD   ARG  76          2HD       ARG  76   6.549  -7.989  14.007
  575   2HD   ARG  76          3HD       ARG  76   4.961  -8.681  13.572
  576    HE   ARG  76           HE       ARG  76   5.951 -10.441  15.433
  577   1HH1  ARG  76          2HH2      ARG  76   5.347  -6.977  15.448
  578   2HH1  ARG  76          1HH2      ARG  76   5.186  -6.828  17.171
  579   1HH2  ARG  76          2HH1      ARG  76   5.721 -10.313  17.729
  580   2HH2  ARG  76          1HH1      ARG  76   5.377  -8.799  18.501
  Start of MODEL   17
    1   1H    MET   1          H1        MET   1   3.797  21.032  14.464
    2   2H    MET   1          H2        MET   1   5.090  21.012  13.409
    3   3H    MET   1          H3        MET   1   3.557  21.336  12.870
    4    HA   MET   1           HA       MET   1   4.042  19.113  12.289
    5   1HB   MET   1          2HB       MET   1   4.494  18.705  15.285
    6   2HB   MET   1          3HB       MET   1   4.479  17.454  14.038
    7   1HG   MET   1          2HG       MET   1   6.460  18.687  12.962
    8   2HG   MET   1          3HG       MET   1   6.543  19.632  14.465
    9   1HE   MET   1          1HE       MET   1   9.616  17.324  14.927
   10   2HE   MET   1          2HE       MET   1   9.071  18.246  13.507
   11   3HE   MET   1          3HE       MET   1   8.988  18.973  15.134
   12    H    LEU   2           H        LEU   2   2.087  18.032  11.964
   13    HA   LEU   2           HA       LEU   2   0.216  17.625  14.123
   14   1HB   LEU   2          2HB       LEU   2  -0.628  19.799  13.068
   15   2HB   LEU   2          3HB       LEU   2  -0.658  18.961  11.515
   16    HG   LEU   2           HG       LEU   2  -2.172  17.193  12.876
   17   1HD1  LEU   2          1HD1      LEU   2  -3.595  18.299  14.528
   18   2HD1  LEU   2          2HD1      LEU   2  -1.905  18.386  15.055
   19   3HD1  LEU   2          3HD1      LEU   2  -2.689  19.815  14.345
   20   1HD2  LEU   2          1HD2      LEU   2  -4.169  18.380  12.104
   21   2HD2  LEU   2          2HD2      LEU   2  -3.207  19.852  11.831
   22   3HD2  LEU   2          3HD2      LEU   2  -2.894  18.382  10.878
   23    H    SER   3           H        SER   3  -0.153  15.435  13.814
   24    HA   SER   3           HA       SER   3  -0.064  13.371  12.900
   25   1HB   SER   3          2HB       SER   3  -0.292  14.607  10.123
   26   2HB   SER   3          3HB       SER   3  -0.676  12.979  10.612
   27    HG   SER   3           HG       SER   3  -2.414  13.723  11.795
   28    H    GLU   4           H        GLU   4   1.966  12.545  13.342
   29    HA   GLU   4           HA       GLU   4   4.334  13.351  11.830
   30   1HB   GLU   4          2HB       GLU   4   3.684  11.352  13.918
   31   2HB   GLU   4          3HB       GLU   4   4.936  10.916  12.777
   32   1HG   GLU   4          2HG       GLU   4   6.051  13.040  13.267
   33   2HG   GLU   4          3HG       GLU   4   4.853  13.317  14.536
   34    H    GLN   5           H        GLN   5   5.353  11.482  10.501
   35    HA   GLN   5           HA       GLN   5   3.334   9.864   9.071
   36   1HB   GLN   5          2HB       GLN   5   5.464  11.615   7.805
   37   2HB   GLN   5          3HB       GLN   5   4.662  10.284   6.997
   38   1HG   GLN   5          2HG       GLN   5   2.591  11.955   8.121
   39   2HG   GLN   5          3HG       GLN   5   3.747  13.016   7.313
   40   1HE2  GLN   5          1HE2      GLN   5   2.491   9.713   6.754
   41   2HE2  GLN   5          2HE2      GLN   5   2.025   9.948   5.080
   42    H    LYS   6           H        LYS   6   4.189   7.888   8.298
   43    HA   LYS   6           HA       LYS   6   7.060   7.443   8.581
   44   1HB   LYS   6          2HB       LYS   6   5.056   5.650  10.018
   45   2HB   LYS   6          3HB       LYS   6   6.746   5.259   9.697
   46   1HG   LYS   6          2HG       LYS   6   7.365   7.436  10.932
   47   2HG   LYS   6          3HG       LYS   6   5.685   7.509  11.447
   48   1HD   LYS   6          2HD       LYS   6   6.875   6.511  13.220
   49   2HD   LYS   6          3HD       LYS   6   5.981   5.183  12.450
   50   1HE   LYS   6          2HE       LYS   6   8.041   4.455  11.259
   51   2HE   LYS   6          3HE       LYS   6   8.905   5.891  11.825
   52   1HZ   LYS   6          1HZ       LYS   6   8.701   5.054  14.057
   53   2HZ   LYS   6          2HZ       LYS   6   7.900   3.712  13.525
   54   3HZ   LYS   6          3HZ       LYS   6   9.466   3.970  13.085
   55    H    GLU   7           H        GLU   7   7.802   5.713   7.509
   56    HA   GLU   7           HA       GLU   7   6.320   4.941   5.100
   57   1HB   GLU   7          2HB       GLU   7   9.242   4.340   5.561
   58   2HB   GLU   7          3HB       GLU   7   8.384   4.794   4.097
   59   1HG   GLU   7          2HG       GLU   7   9.625   6.676   4.489
   60   2HG   GLU   7          3HG       GLU   7   8.178   7.164   5.368
   61    H    ILE   8           H        ILE   8   5.271   2.961   5.316
   62    HA   ILE   8           HA       ILE   8   6.619   0.789   6.904
   63    HB   ILE   8           HB       ILE   8   4.760  -0.589   6.478
   64   1HG1  ILE   8          2HG1      ILE   8   2.638   0.434   5.570
   65   2HG1  ILE   8          3HG1      ILE   8   3.667   1.694   4.857
   66   1HG2  ILE   8          1HG2      ILE   8   3.167   0.479   7.796
   67   2HG2  ILE   8          2HG2      ILE   8   4.774   0.926   8.405
   68   3HG2  ILE   8          3HG2      ILE   8   3.832   2.097   7.438
   69   1HD1  ILE   8          1HD1      ILE   8   3.015  -0.483   3.499
   70   2HD1  ILE   8          2HD1      ILE   8   4.700   0.090   3.430
   71   3HD1  ILE   8          3HD1      ILE   8   4.261  -1.237   4.518
   72    H    ALA   9           H        ALA   9   7.051  -1.275   5.817
   73    HA   ALA   9           HA       ALA   9   7.646  -1.127   2.935
   74   1HB   ALA   9          1HB       ALA   9   9.910  -1.973   3.273
   75   2HB   ALA   9          2HB       ALA   9   9.752  -0.418   4.120
   76   3HB   ALA   9          3HB       ALA   9   9.712  -1.931   5.037
   77    H    MET  10           H        MET  10   6.495  -2.908   2.219
   78    HA   MET  10           HA       MET  10   6.494  -5.392   3.878
   79   1HB   MET  10          2HB       MET  10   4.043  -3.820   2.972
   80   2HB   MET  10          3HB       MET  10   4.000  -5.504   3.522
   81   1HG   MET  10          2HG       MET  10   4.793  -4.955   5.691
   82   2HG   MET  10          3HG       MET  10   5.069  -3.265   5.258
   83   1HE   MET  10          1HE       MET  10   2.162  -3.253   7.837
   84   2HE   MET  10          2HE       MET  10   3.620  -4.262   7.780
   85   3HE   MET  10          3HE       MET  10   3.744  -2.515   7.466
   86    H    GLN  11           H        GLN  11   5.235  -7.148   2.624
   87    HA   GLN  11           HA       GLN  11   6.456  -7.188  -0.095
   88   1HB   GLN  11          2HB       GLN  11   5.683  -9.280   1.991
   89   2HB   GLN  11          3HB       GLN  11   5.984  -9.739   0.309
   90   1HG   GLN  11          2HG       GLN  11   7.924  -8.379   2.249
   91   2HG   GLN  11          3HG       GLN  11   7.996 -10.048   1.662
   92   1HE2  GLN  11          1HE2      GLN  11   7.711 -10.068  -0.947
   93   2HE2  GLN  11          2HE2      GLN  11   8.574  -8.783  -1.783
   94    H    VAL  12           H        VAL  12   5.237  -8.370  -1.795
   95    HA   VAL  12           HA       VAL  12   2.329  -7.637  -1.659
   96    HB   VAL  12           HB       VAL  12   4.261  -7.521  -4.026
   97   1HG1  VAL  12          1HG1      VAL  12   1.377  -6.582  -3.715
   98   2HG1  VAL  12          2HG1      VAL  12   2.421  -6.269  -5.119
   99   3HG1  VAL  12          3HG1      VAL  12   1.937  -7.923  -4.741
  100   1HG2  VAL  12          1HG2      VAL  12   3.113  -5.263  -2.339
  101   2HG2  VAL  12          2HG2      VAL  12   4.831  -5.725  -2.442
  102   3HG2  VAL  12          3HG2      VAL  12   4.015  -5.055  -3.854
  103    H    SER  13           H        SER  13   0.892  -9.164  -2.601
  104    HA   SER  13           HA       SER  13   2.012 -11.491  -4.043
  105   1HB   SER  13          2HB       SER  13   0.062 -11.608  -1.701
  106   2HB   SER  13          3HB       SER  13   0.385 -12.959  -2.803
  107    HG   SER  13           HG       SER  13   1.681 -13.046  -0.901
  108    H    GLY  14           H        GLY  14   0.296 -12.573  -5.274
  109   1HA   GLY  14          2HA       GLY  14  -1.469 -12.598  -6.738
  110   2HA   GLY  14          3HA       GLY  14  -2.368 -11.772  -5.455
  111    H    MET  15           H        MET  15   0.125 -11.056  -7.951
  112    HA   MET  15           HA       MET  15  -1.206  -8.445  -8.514
  113   1HB   MET  15          2HB       MET  15   1.115  -7.684  -9.138
  114   2HB   MET  15          3HB       MET  15   0.837  -7.917  -7.406
  115   1HG   MET  15          2HG       MET  15   2.077  -9.870  -7.288
  116   2HG   MET  15          3HG       MET  15   2.108 -10.118  -9.041
  117   1HE   MET  15          1HE       MET  15   3.030  -7.329 -10.259
  118   2HE   MET  15          2HE       MET  15   4.779  -7.627 -10.272
  119   3HE   MET  15          3HE       MET  15   3.655  -8.938 -10.699
  120    H    THR  16           H        THR  16  -1.380  -7.799 -10.640
  121    HA   THR  16           HA       THR  16  -0.886  -9.747 -12.790
  122    HB   THR  16           HB       THR  16  -1.730  -7.492 -14.016
  123    HG1  THR  16           1HG      THR  16  -3.282  -7.153 -11.789
  124   1HG2  THR  16          1HG2      THR  16  -2.932  -9.607 -14.095
  125   2HG2  THR  16          2HG2      THR  16  -3.510  -9.401 -12.428
  126   3HG2  THR  16          3HG2      THR  16  -4.064  -8.300 -13.717
  127    H    CYS  17           H        CYS  17  -0.086  -6.229 -12.294
  128    HA   CYS  17           HA       CYS  17   2.729  -6.796 -12.744
  129   1HB   CYS  17          2HB       CYS  17   3.014  -5.561 -14.776
  130   2HB   CYS  17          3HB       CYS  17   1.747  -6.751 -15.081
  131    H    ALA  18           H        ALA  18   3.982  -4.751 -12.830
  132    HA   ALA  18           HA       ALA  18   3.639  -3.261 -10.508
  133   1HB   ALA  18          1HB       ALA  18   5.190  -2.555 -13.030
  134   2HB   ALA  18          2HB       ALA  18   5.403  -1.790 -11.444
  135   3HB   ALA  18          3HB       ALA  18   5.784  -3.512 -11.654
  136    H    ALA  19           H        ALA  19   2.497  -2.532 -13.813
  137    HA   ALA  19           HA       ALA  19   1.853   0.207 -13.314
  138   1HB   ALA  19          1HB       ALA  19   0.499   0.074 -15.331
  139   2HB   ALA  19          2HB       ALA  19   2.049  -0.750 -15.580
  140   3HB   ALA  19          3HB       ALA  19   0.567  -1.696 -15.313
  141    H    CYS  20           H        CYS  20  -0.099  -2.829 -12.977
  142    HA   CYS  20           HA       CYS  20  -2.423  -1.402 -12.009
  143   1HB   CYS  20          2HB       CYS  20  -1.611  -4.335 -11.659
  144   2HB   CYS  20          3HB       CYS  20  -3.213  -3.642 -11.356
  145    H    ALA  21           H        ALA  21   0.323  -3.106 -10.466
  146    HA   ALA  21           HA       ALA  21  -0.444  -2.653  -7.810
  147   1HB   ALA  21          1HB       ALA  21   1.783  -3.187  -7.207
  148   2HB   ALA  21          2HB       ALA  21   1.441  -4.126  -8.670
  149   3HB   ALA  21          3HB       ALA  21   2.402  -2.643  -8.782
  150    H    ALA  22           H        ALA  22   0.666  -0.246 -10.119
  151    HA   ALA  22           HA       ALA  22   1.361   1.750  -8.135
  152   1HB   ALA  22          1HB       ALA  22   2.064   1.865 -10.530
  153   2HB   ALA  22          2HB       ALA  22   0.364   2.134 -10.981
  154   3HB   ALA  22          3HB       ALA  22   1.204   3.318  -9.968
  155    H    ARG  23           H        ARG  23  -1.600   0.782  -9.936
  156    HA   ARG  23           HA       ARG  23  -3.215   3.007  -9.113
  157   1HB   ARG  23          2HB       ARG  23  -3.767   0.306 -10.341
  158   2HB   ARG  23          3HB       ARG  23  -5.046   1.022  -9.396
  159   1HG   ARG  23          2HG       ARG  23  -5.714   2.084 -11.159
  160   2HG   ARG  23          3HG       ARG  23  -4.366   3.194 -10.977
  161   1HD   ARG  23          2HD       ARG  23  -4.256   0.583 -12.566
  162   2HD   ARG  23          3HD       ARG  23  -4.736   2.145 -13.260
  163    HE   ARG  23           HE       ARG  23  -2.235   2.485 -11.962
  164   1HH1  ARG  23          2HH2      ARG  23  -3.485   0.580 -14.620
  165   2HH1  ARG  23          1HH2      ARG  23  -2.182   0.899 -15.719
  166   1HH2  ARG  23          2HH1      ARG  23  -0.466   2.993 -13.395
  167   2HH2  ARG  23          1HH1      ARG  23  -0.424   2.343 -15.003
  168    H    ILE  24           H        ILE  24  -2.690  -0.252  -7.659
  169    HA   ILE  24           HA       ILE  24  -4.592   0.141  -5.624
  170    HB   ILE  24           HB       ILE  24  -3.686  -1.634  -4.374
  171   1HG1  ILE  24          2HG1      ILE  24  -1.276  -1.086  -6.007
  172   2HG1  ILE  24          3HG1      ILE  24  -1.404  -1.139  -4.237
  173   1HG2  ILE  24          1HG2      ILE  24  -3.242  -2.309  -7.306
  174   2HG2  ILE  24          2HG2      ILE  24  -3.883  -3.320  -5.995
  175   3HG2  ILE  24          3HG2      ILE  24  -4.851  -1.992  -6.622
  176   1HD1  ILE  24          1HD1      ILE  24  -0.090  -3.030  -5.182
  177   2HD1  ILE  24          2HD1      ILE  24  -1.536  -3.558  -4.283
  178   3HD1  ILE  24          3HD1      ILE  24  -1.522  -3.545  -6.069
  179    H    GLU  25           H        GLU  25  -1.023   0.773  -5.215
  180    HA   GLU  25           HA       GLU  25  -1.221   2.103  -2.788
  181   1HB   GLU  25          2HB       GLU  25   0.710   2.064  -5.062
  182   2HB   GLU  25          3HB       GLU  25   0.810   3.485  -4.002
  183   1HG   GLU  25          2HG       GLU  25   2.297   1.619  -3.267
  184   2HG   GLU  25          3HG       GLU  25   1.132   2.102  -2.041
  185    H    LYS  26           H        LYS  26  -1.753   3.542  -6.036
  186    HA   LYS  26           HA       LYS  26  -1.964   6.220  -4.865
  187   1HB   LYS  26          2HB       LYS  26  -2.988   5.252  -7.550
  188   2HB   LYS  26          3HB       LYS  26  -2.781   6.940  -7.058
  189   1HG   LYS  26          2HG       LYS  26  -0.546   4.890  -7.310
  190   2HG   LYS  26          3HG       LYS  26  -0.945   6.090  -8.517
  191   1HD   LYS  26          2HD       LYS  26  -0.193   7.864  -7.175
  192   2HD   LYS  26          3HD       LYS  26  -0.138   6.929  -5.683
  193   1HE   LYS  26          2HE       LYS  26   1.605   6.223  -8.072
  194   2HE   LYS  26          3HE       LYS  26   2.124   7.350  -6.810
  195   1HZ   LYS  26          1HZ       LYS  26   2.023   5.665  -5.195
  196   2HZ   LYS  26          2HZ       LYS  26   1.280   4.592  -6.210
  197   3HZ   LYS  26          3HZ       LYS  26   2.838   5.049  -6.463
  198    H    GLY  27           H        GLY  27  -4.381   3.776  -5.739
  199   1HA   GLY  27          2HA       GLY  27  -6.687   5.272  -4.858
  200   2HA   GLY  27          3HA       GLY  27  -6.563   3.516  -5.013
  201    H    LEU  28           H        LEU  28  -4.183   3.356  -3.210
  202    HA   LEU  28           HA       LEU  28  -5.525   3.180  -0.708
  203   1HB   LEU  28          2HB       LEU  28  -3.265   2.070  -1.702
  204   2HB   LEU  28          3HB       LEU  28  -2.526   3.350  -0.734
  205    HG   LEU  28           HG       LEU  28  -4.410   1.123   0.143
  206   1HD1  LEU  28          1HD1      LEU  28  -2.052   0.497  -0.293
  207   2HD1  LEU  28          2HD1      LEU  28  -1.521   1.707   0.894
  208   3HD1  LEU  28          3HD1      LEU  28  -2.506   0.312   1.403
  209   1HD2  LEU  28          1HD2      LEU  28  -3.940   2.064   2.484
  210   2HD2  LEU  28          2HD2      LEU  28  -3.312   3.506   1.649
  211   3HD2  LEU  28          3HD2      LEU  28  -5.011   3.037   1.483
  212    H    LYS  29           H        LYS  29  -3.138   5.542  -2.019
  213    HA   LYS  29           HA       LYS  29  -3.072   7.356   0.123
  214   1HB   LYS  29          2HB       LYS  29  -1.674   7.504  -1.962
  215   2HB   LYS  29          3HB       LYS  29  -3.102   8.120  -2.811
  216   1HG   LYS  29          2HG       LYS  29  -3.145   9.914  -0.818
  217   2HG   LYS  29          3HG       LYS  29  -1.498   9.412  -0.601
  218   1HD   LYS  29          2HD       LYS  29  -2.557  10.303  -3.346
  219   2HD   LYS  29          3HD       LYS  29  -2.112  11.482  -2.086
  220   1HE   LYS  29          2HE       LYS  29   0.042  10.590  -1.848
  221   2HE   LYS  29          3HE       LYS  29  -0.194   9.291  -3.042
  222   1HZ   LYS  29          1HZ       LYS  29  -0.137  11.152  -4.642
  223   2HZ   LYS  29          2HZ       LYS  29   0.048  12.221  -3.372
  224   3HZ   LYS  29          3HZ       LYS  29   1.178  11.054  -3.615
  225    H    ARG  30           H        ARG  30  -5.617   6.987  -2.366
  226    HA   ARG  30           HA       ARG  30  -7.060   9.351  -1.662
  227   1HB   ARG  30          2HB       ARG  30  -7.770   6.774  -3.040
  228   2HB   ARG  30          3HB       ARG  30  -9.061   7.857  -2.586
  229   1HG   ARG  30          2HG       ARG  30  -6.706   9.083  -4.007
  230   2HG   ARG  30          3HG       ARG  30  -7.750   8.002  -4.944
  231   1HD   ARG  30          2HD       ARG  30  -9.736   9.253  -4.339
  232   2HD   ARG  30          3HD       ARG  30  -8.785  10.362  -3.316
  233    HE   ARG  30           HE       ARG  30  -7.597  10.513  -5.816
  234   1HH1  ARG  30          2HH2      ARG  30 -10.830  11.086  -4.534
  235   2HH1  ARG  30          1HH2      ARG  30 -11.283  12.266  -5.723
  236   1HH2  ARG  30          2HH1      ARG  30  -8.140  12.126  -7.402
  237   2HH2  ARG  30          1HH1      ARG  30  -9.698  12.883  -7.377
  238    H    MET  31           H        MET  31  -6.540   6.639   0.404
  239    HA   MET  31           HA       MET  31  -9.118   6.898   1.731
  240   1HB   MET  31          2HB       MET  31  -8.639   4.982   2.715
  241   2HB   MET  31          3HB       MET  31  -7.419   4.823   1.451
  242   1HG   MET  31          2HG       MET  31  -5.692   5.565   2.977
  243   2HG   MET  31          3HG       MET  31  -6.875   5.762   4.276
  244   1HE   MET  31          1HE       MET  31  -8.029   2.137   5.064
  245   2HE   MET  31          2HE       MET  31  -8.192   3.860   5.500
  246   3HE   MET  31          3HE       MET  31  -8.820   3.244   3.955
  247    HA   PRO  32           HA       PRO  32  -7.830   9.911   4.802
  248   1HB   PRO  32          2HB       PRO  32  -9.163   9.079   7.046
  249   2HB   PRO  32          3HB       PRO  32  -9.979   9.846   5.655
  250   1HG   PRO  32          2HG       PRO  32  -9.700   6.887   6.244
  251   2HG   PRO  32          3HG       PRO  32 -11.184   7.795   5.835
  252   1HD   PRO  32          2HD       PRO  32  -9.800   6.422   3.962
  253   2HD   PRO  32          3HD       PRO  32 -10.526   8.003   3.553
  254    H    GLY  33           H        GLY  33  -5.861   9.899   5.653
  255   1HA   GLY  33          2HA       GLY  33  -4.462   9.362   7.444
  256   2HA   GLY  33          3HA       GLY  33  -4.939   7.665   7.395
  257    H    VAL  34           H        VAL  34  -4.502   7.745   4.241
  258    HA   VAL  34           HA       VAL  34  -1.529   7.489   4.441
  259    HB   VAL  34           HB       VAL  34  -3.427   6.499   2.311
  260   1HG1  VAL  34          1HG1      VAL  34  -1.423   5.287   1.512
  261   2HG1  VAL  34          2HG1      VAL  34  -1.153   7.029   1.427
  262   3HG1  VAL  34          3HG1      VAL  34  -0.428   6.099   2.746
  263   1HG2  VAL  34          1HG2      VAL  34  -3.804   5.133   4.202
  264   2HG2  VAL  34          2HG2      VAL  34  -2.457   4.289   3.417
  265   3HG2  VAL  34          3HG2      VAL  34  -2.163   5.326   4.804
  266    H    THR  35           H        THR  35  -0.313   9.159   3.887
  267    HA   THR  35           HA       THR  35  -1.494  11.301   2.251
  268    HB   THR  35           HB       THR  35   0.825  11.188   4.072
  269    HG1  THR  35           1HG      THR  35  -0.774  11.652   5.361
  270   1HG2  THR  35          1HG2      THR  35   0.898  13.688   3.742
  271   2HG2  THR  35          2HG2      THR  35   1.504  12.753   2.365
  272   3HG2  THR  35          3HG2      THR  35  -0.127  13.471   2.305
  273    H    ASP  36           H        ASP  36   1.307   8.972   2.023
  274    HA   ASP  36           HA       ASP  36   0.929   9.167  -0.781
  275   1HB   ASP  36          2HB       ASP  36   3.224  10.643   0.267
  276   2HB   ASP  36          3HB       ASP  36   3.786   9.262  -0.671
  277    H    ALA  37           H        ALA  37   2.244   7.615  -1.993
  278    HA   ALA  37           HA       ALA  37   2.906   5.241  -0.475
  279   1HB   ALA  37          1HB       ALA  37   0.390   4.997  -2.155
  280   2HB   ALA  37          2HB       ALA  37   1.027   3.885  -0.914
  281   3HB   ALA  37          3HB       ALA  37   0.306   5.412  -0.436
  282    H    ASN  38           H        ASN  38   4.088   3.707  -1.684
  283    HA   ASN  38           HA       ASN  38   4.647   4.377  -4.522
  284   1HB   ASN  38          2HB       ASN  38   7.189   4.280  -3.342
  285   2HB   ASN  38          3HB       ASN  38   6.373   5.686  -3.995
  286   1HD2  ASN  38          1HD2      ASN  38   6.000   3.846  -0.912
  287   2HD2  ASN  38          2HD2      ASN  38   6.281   5.256   0.107
  288    H    VAL  39           H        VAL  39   4.510   2.381  -5.349
  289    HA   VAL  39           HA       VAL  39   5.268   0.045  -3.777
  290    HB   VAL  39           HB       VAL  39   3.125   0.267  -5.006
  291   1HG1  VAL  39          1HG1      VAL  39   3.655   1.459  -6.968
  292   2HG1  VAL  39          2HG1      VAL  39   4.809   0.247  -7.526
  293   3HG1  VAL  39          3HG1      VAL  39   3.097  -0.139  -7.449
  294   1HG2  VAL  39          1HG2      VAL  39   4.989  -2.030  -5.355
  295   2HG2  VAL  39          2HG2      VAL  39   3.542  -1.843  -4.366
  296   3HG2  VAL  39          3HG2      VAL  39   3.367  -2.055  -6.103
  297    H    ASN  40           H        ASN  40   7.215  -1.096  -4.135
  298    HA   ASN  40           HA       ASN  40   8.996  -0.146  -6.340
  299   1HB   ASN  40          2HB       ASN  40   9.689   0.676  -4.128
  300   2HB   ASN  40          3HB       ASN  40   9.776  -0.986  -3.524
  301   1HD2  ASN  40          1HD2      ASN  40  12.036   0.561  -3.362
  302   2HD2  ASN  40          2HD2      ASN  40  13.207   0.029  -4.559
  303    H    LEU  41           H        LEU  41   7.751  -1.821  -7.471
  304    HA   LEU  41           HA       LEU  41   7.993  -4.598  -6.748
  305   1HB   LEU  41          2HB       LEU  41   7.410  -3.440  -9.507
  306   2HB   LEU  41          3HB       LEU  41   7.190  -5.092  -8.963
  307    HG   LEU  41           HG       LEU  41   5.044  -4.145  -8.971
  308   1HD1  LEU  41          1HD1      LEU  41   5.505  -5.467  -6.960
  309   2HD1  LEU  41          2HD1      LEU  41   5.898  -3.986  -6.067
  310   3HD1  LEU  41          3HD1      LEU  41   4.261  -4.232  -6.707
  311   1HD2  LEU  41          1HD2      LEU  41   5.877  -1.755  -7.335
  312   2HD2  LEU  41          2HD2      LEU  41   5.905  -1.754  -9.104
  313   3HD2  LEU  41          3HD2      LEU  41   4.396  -2.031  -8.239
  314    H    ALA  42           H        ALA  42  10.068  -2.340  -8.426
  315    HA   ALA  42           HA       ALA  42  11.820  -4.086  -9.758
  316   1HB   ALA  42          1HB       ALA  42  12.539  -1.575  -8.199
  317   2HB   ALA  42          2HB       ALA  42  13.543  -2.385  -9.405
  318   3HB   ALA  42          3HB       ALA  42  12.008  -1.634  -9.898
  319    H    THR  43           H        THR  43  11.520  -3.418  -6.239
  320    HA   THR  43           HA       THR  43  13.489  -5.621  -5.820
  321    HB   THR  43           HB       THR  43  14.177  -3.373  -5.125
  322    HG1  THR  43           1HG      THR  43  15.054  -4.284  -3.143
  323   1HG2  THR  43          1HG2      THR  43  13.453  -2.434  -3.049
  324   2HG2  THR  43          2HG2      THR  43  11.943  -2.846  -3.891
  325   3HG2  THR  43          3HG2      THR  43  12.557  -3.896  -2.604
  326    H    GLU  44           H        GLU  44  10.516  -5.704  -6.355
  327    HA   GLU  44           HA       GLU  44   8.564  -6.498  -5.542
  328   1HB   GLU  44          2HB       GLU  44  10.755  -8.413  -4.834
  329   2HB   GLU  44          3HB       GLU  44   9.133  -8.816  -4.283
  330   1HG   GLU  44          2HG       GLU  44   9.577  -8.093  -7.185
  331   2HG   GLU  44          3HG       GLU  44   9.827  -9.733  -6.564
  332    H    THR  45           H        THR  45   9.174  -4.356  -3.903
  333    HA   THR  45           HA       THR  45   7.886  -5.242  -1.368
  334    HB   THR  45           HB       THR  45  10.348  -3.493  -1.768
  335    HG1  THR  45           1HG      THR  45   9.896  -6.055  -0.636
  336   1HG2  THR  45          1HG2      THR  45  10.415  -3.258   0.662
  337   2HG2  THR  45          2HG2      THR  45   8.984  -2.485  -0.048
  338   3HG2  THR  45          3HG2      THR  45   8.833  -4.057   0.789
  339    H    VAL  46           H        VAL  46   6.457  -3.683  -0.519
  340    HA   VAL  46           HA       VAL  46   5.894  -1.317  -2.250
  341    HB   VAL  46           HB       VAL  46   4.083  -2.853  -2.399
  342   1HG1  VAL  46          1HG1      VAL  46   3.992  -2.883   0.654
  343   2HG1  VAL  46          2HG1      VAL  46   2.741  -3.533  -0.414
  344   3HG1  VAL  46          3HG1      VAL  46   4.345  -4.260  -0.418
  345   1HG2  VAL  46          1HG2      VAL  46   2.241  -1.544  -1.592
  346   2HG2  VAL  46          2HG2      VAL  46   3.270  -0.649  -0.466
  347   3HG2  VAL  46          3HG2      VAL  46   3.498  -0.460  -2.221
  348    H    ASN  47           H        ASN  47   5.615   0.746  -1.214
  349    HA   ASN  47           HA       ASN  47   6.178   0.761   1.692
  350   1HB   ASN  47          2HB       ASN  47   7.422   2.451  -0.525
  351   2HB   ASN  47          3HB       ASN  47   7.447   2.916   1.181
  352   1HD2  ASN  47          1HD2      ASN  47   8.433   1.261   2.711
  353   2HD2  ASN  47          2HD2      ASN  47   9.899   0.492   2.106
  354    H    VAL  48           H        VAL  48   4.915   2.325   2.813
  355    HA   VAL  48           HA       VAL  48   2.993   3.883   1.194
  356    HB   VAL  48           HB       VAL  48   2.165   2.057   3.474
  357   1HG1  VAL  48          1HG1      VAL  48   0.499   3.830   1.695
  358   2HG1  VAL  48          2HG1      VAL  48  -0.043   2.806   3.048
  359   3HG1  VAL  48          3HG1      VAL  48   0.979   4.214   3.367
  360   1HG2  VAL  48          1HG2      VAL  48   1.558   1.855   0.504
  361   2HG2  VAL  48          2HG2      VAL  48   2.544   0.720   1.446
  362   3HG2  VAL  48          3HG2      VAL  48   0.821   0.881   1.790
  363    H    ILE  49           H        ILE  49   3.001   5.922   1.937
  364    HA   ILE  49           HA       ILE  49   4.634   6.503   4.319
  365    HB   ILE  49           HB       ILE  49   3.896   8.396   2.049
  366   1HG1  ILE  49          2HG1      ILE  49   5.104   6.683   0.956
  367   2HG1  ILE  49          3HG1      ILE  49   6.144   8.087   1.150
  368   1HG2  ILE  49          1HG2      ILE  49   5.985   8.528   4.255
  369   2HG2  ILE  49          2HG2      ILE  49   5.831   9.681   2.912
  370   3HG2  ILE  49          3HG2      ILE  49   4.530   9.521   4.095
  371   1HD1  ILE  49          1HD1      ILE  49   6.271   5.511   2.777
  372   2HD1  ILE  49          2HD1      ILE  49   7.457   6.110   1.607
  373   3HD1  ILE  49          3HD1      ILE  49   7.228   6.968   3.133
  374    H    TYR  50           H        TYR  50   3.042   6.419   5.939
  375    HA   TYR  50           HA       TYR  50   0.479   7.924   5.443
  376   1HB   TYR  50          2HB       TYR  50  -0.771   6.264   6.447
  377   2HB   TYR  50          3HB       TYR  50   0.099   5.582   5.118
  378    HD1  TYR  50           HD1      TYR  50   0.892   3.384   5.463
  379    HD2  TYR  50           HD2      TYR  50   0.305   5.931   8.883
  380    HE1  TYR  50           HE1      TYR  50   1.090   1.453   6.983
  381    HE2  TYR  50           HE2      TYR  50   0.901   4.091  10.374
  382    HH   TYR  50           HH       TYR  50   1.648   1.848  10.437
  383    H    ASP  51           H        ASP  51  -0.697   8.294   7.436
  384    HA   ASP  51           HA       ASP  51   1.199   9.474   9.378
  385   1HB   ASP  51          2HB       ASP  51  -1.741  10.003   8.972
  386   2HB   ASP  51          3HB       ASP  51  -0.597  10.840  10.048
  387    HA   PRO  52           HA       PRO  52  -0.071   5.868  11.821
  388   1HB   PRO  52          2HB       PRO  52   1.754   5.920  13.833
  389   2HB   PRO  52          3HB       PRO  52   2.166   5.457  12.159
  390   1HG   PRO  52          2HG       PRO  52   2.437   8.206  13.411
  391   2HG   PRO  52          3HG       PRO  52   3.710   7.261  12.589
  392   1HD   PRO  52          2HD       PRO  52   2.291   9.118  11.286
  393   2HD   PRO  52          3HD       PRO  52   2.658   7.581  10.450
  394    H    ALA  53           H        ALA  53  -0.868   9.005  12.406
  395    HA   ALA  53           HA       ALA  53  -1.880   8.675  15.158
  396   1HB   ALA  53          1HB       ALA  53  -2.149  10.898  13.086
  397   2HB   ALA  53          2HB       ALA  53  -2.767  10.939  14.751
  398   3HB   ALA  53          3HB       ALA  53  -1.016  10.884  14.459
  399    H    GLU  54           H        GLU  54  -2.638   8.103  11.786
  400    HA   GLU  54           HA       GLU  54  -5.511   7.899  12.405
  401   1HB   GLU  54          2HB       GLU  54  -4.678   9.896  11.044
  402   2HB   GLU  54          3HB       GLU  54  -4.373   8.763   9.726
  403   1HG   GLU  54          2HG       GLU  54  -6.783   8.161   9.707
  404   2HG   GLU  54          3HG       GLU  54  -7.053   9.158  11.150
  405    H    THR  55           H        THR  55  -2.968   6.779  10.115
  406    HA   THR  55           HA       THR  55  -4.185   4.094  10.104
  407    HB   THR  55           HB       THR  55  -2.189   3.794   8.259
  408    HG1  THR  55           1HG      THR  55  -3.119   6.421   7.999
  409   1HG2  THR  55          1HG2      THR  55  -5.032   4.870   7.955
  410   2HG2  THR  55          2HG2      THR  55  -4.005   4.301   6.608
  411   3HG2  THR  55          3HG2      THR  55  -4.417   3.184   7.930
  412    H    GLY  56           H        GLY  56  -1.975   2.572   9.766
  413   1HA   GLY  56          2HA       GLY  56  -0.227   2.052  11.719
  414   2HA   GLY  56          3HA       GLY  56  -1.710   2.300  12.658
  415    H    THR  57           H        THR  57  -0.379   0.659  10.110
  416    HA   THR  57           HA       THR  57  -0.987  -0.293   8.310
  417    HB   THR  57           HB       THR  57  -0.337  -2.671   8.533
  418    HG1  THR  57           1HG      THR  57  -0.602  -2.160  11.316
  419   1HG2  THR  57          1HG2      THR  57   1.234  -0.884  10.480
  420   2HG2  THR  57          2HG2      THR  57   1.778  -2.404   9.811
  421   3HG2  THR  57          3HG2      THR  57   1.504  -1.018   8.728
  422    H    ALA  58           H        ALA  58  -3.154  -1.250  10.844
  423    HA   ALA  58           HA       ALA  58  -5.117  -2.804   9.981
  424   1HB   ALA  58          1HB       ALA  58  -6.614  -1.157  11.145
  425   2HB   ALA  58          2HB       ALA  58  -5.072  -1.391  12.014
  426   3HB   ALA  58          3HB       ALA  58  -5.304   0.048  11.020
  427    H    ALA  59           H        ALA  59  -4.834   0.568   8.809
  428    HA   ALA  59           HA       ALA  59  -7.368   0.085   7.365
  429   1HB   ALA  59          1HB       ALA  59  -6.427   2.374   8.504
  430   2HB   ALA  59          2HB       ALA  59  -6.131   2.648   6.756
  431   3HB   ALA  59          3HB       ALA  59  -7.742   2.242   7.349
  432    H    ILE  60           H        ILE  60  -3.946   0.197   6.740
  433    HA   ILE  60           HA       ILE  60  -4.017   0.282   3.899
  434    HB   ILE  60           HB       ILE  60  -2.007  -0.384   6.042
  435   1HG1  ILE  60          2HG1      ILE  60  -0.655   1.080   4.516
  436   2HG1  ILE  60          3HG1      ILE  60  -2.091   1.209   3.479
  437   1HG2  ILE  60          1HG2      ILE  60  -0.334  -1.156   4.503
  438   2HG2  ILE  60          2HG2      ILE  60  -1.634  -2.330   4.609
  439   3HG2  ILE  60          3HG2      ILE  60  -1.527  -1.267   3.183
  440   1HD1  ILE  60          1HD1      ILE  60  -3.273   2.407   5.264
  441   2HD1  ILE  60          2HD1      ILE  60  -2.041   1.940   6.465
  442   3HD1  ILE  60          3HD1      ILE  60  -1.640   3.103   5.202
  443    H    GLN  61           H        GLN  61  -3.914  -2.533   6.180
  444    HA   GLN  61           HA       GLN  61  -3.992  -4.422   4.041
  445   1HB   GLN  61          2HB       GLN  61  -4.259  -4.513   6.931
  446   2HB   GLN  61          3HB       GLN  61  -5.474  -5.530   6.142
  447   1HG   GLN  61          2HG       GLN  61  -3.864  -7.074   6.344
  448   2HG   GLN  61          3HG       GLN  61  -3.446  -6.474   4.743
  449   1HE2  GLN  61          1HE2      GLN  61  -2.152  -4.016   5.544
  450   2HE2  GLN  61          2HE2      GLN  61  -0.683  -4.464   6.404
  451    H    GLU  62           H        GLU  62  -6.652  -2.877   5.889
  452    HA   GLU  62           HA       GLU  62  -8.813  -4.114   4.622
  453   1HB   GLU  62          2HB       GLU  62  -8.356  -1.759   6.298
  454   2HB   GLU  62          3HB       GLU  62  -9.519  -1.349   5.039
  455   1HG   GLU  62          2HG       GLU  62  -9.805  -3.835   6.773
  456   2HG   GLU  62          3HG       GLU  62 -10.494  -2.262   7.188
  457    H    LYS  63           H        LYS  63  -7.145  -1.075   3.583
  458    HA   LYS  63           HA       LYS  63  -8.762  -0.869   1.254
  459   1HB   LYS  63          2HB       LYS  63  -6.496   0.591   2.452
  460   2HB   LYS  63          3HB       LYS  63  -6.446   0.530   0.710
  461   1HG   LYS  63          2HG       LYS  63  -8.849   1.403   2.340
  462   2HG   LYS  63          3HG       LYS  63  -7.678   2.495   1.580
  463   1HD   LYS  63          2HD       LYS  63  -8.778   2.460  -0.378
  464   2HD   LYS  63          3HD       LYS  63  -8.529   0.730  -0.490
  465   1HE   LYS  63          2HE       LYS  63 -10.875   1.052  -0.679
  466   2HE   LYS  63          3HE       LYS  63 -10.611   0.371   0.929
  467   1HZ   LYS  63          1HZ       LYS  63 -12.145   2.164   1.016
  468   2HZ   LYS  63          2HZ       LYS  63 -10.782   2.609   1.818
  469   3HZ   LYS  63          3HZ       LYS  63 -11.087   3.208   0.314
  470    H    ILE  64           H        ILE  64  -5.620  -2.511   1.821
  471    HA   ILE  64           HA       ILE  64  -4.767  -3.032  -0.756
  472    HB   ILE  64           HB       ILE  64  -4.539  -4.224   1.936
  473   1HG1  ILE  64          2HG1      ILE  64  -3.139  -2.329   1.274
  474   2HG1  ILE  64          3HG1      ILE  64  -2.236  -3.802   1.616
  475   1HG2  ILE  64          1HG2      ILE  64  -3.754  -5.754  -0.502
  476   2HG2  ILE  64          2HG2      ILE  64  -3.052  -5.978   1.124
  477   3HG2  ILE  64          3HG2      ILE  64  -4.778  -6.236   0.873
  478   1HD1  ILE  64          1HD1      ILE  64  -1.222  -2.911  -0.261
  479   2HD1  ILE  64          2HD1      ILE  64  -2.260  -4.201  -0.929
  480   3HD1  ILE  64          3HD1      ILE  64  -2.745  -2.495  -1.051
  481    H    GLU  65           H        GLU  65  -6.960  -4.927   1.432
  482    HA   GLU  65           HA       GLU  65  -7.832  -6.899  -0.393
  483   1HB   GLU  65          2HB       GLU  65  -9.097  -5.617   2.055
  484   2HB   GLU  65          3HB       GLU  65  -9.944  -6.842   1.115
  485   1HG   GLU  65          2HG       GLU  65  -7.135  -7.540   1.887
  486   2HG   GLU  65          3HG       GLU  65  -8.300  -7.397   3.211
  487    H    LYS  66           H        LYS  66  -9.491  -3.792   0.440
  488    HA   LYS  66           HA       LYS  66 -11.634  -4.154  -1.395
  489   1HB   LYS  66          2HB       LYS  66 -10.449  -1.831   0.071
  490   2HB   LYS  66          3HB       LYS  66 -11.407  -1.454  -1.353
  491   1HG   LYS  66          2HG       LYS  66 -12.870  -1.298   0.421
  492   2HG   LYS  66          3HG       LYS  66 -13.332  -2.755  -0.445
  493   1HD   LYS  66          2HD       LYS  66 -11.561  -2.799   2.055
  494   2HD   LYS  66          3HD       LYS  66 -13.315  -2.704   2.155
  495   1HE   LYS  66          2HE       LYS  66 -13.483  -4.857   0.834
  496   2HE   LYS  66          3HE       LYS  66 -11.722  -4.993   0.937
  497   1HZ   LYS  66          1HZ       LYS  66 -13.582  -4.991   3.203
  498   2HZ   LYS  66          2HZ       LYS  66 -12.592  -6.219   2.708
  499   3HZ   LYS  66          3HZ       LYS  66 -11.975  -4.843   3.364
  500    H    LEU  67           H        LEU  67  -8.427  -2.773  -1.951
  501    HA   LEU  67           HA       LEU  67  -8.891  -1.858  -4.641
  502   1HB   LEU  67          2HB       LEU  67  -6.396  -2.517  -3.062
  503   2HB   LEU  67          3HB       LEU  67  -6.359  -1.841  -4.690
  504    HG   LEU  67           HG       LEU  67  -7.905  -0.451  -2.461
  505   1HD1  LEU  67          1HD1      LEU  67  -5.620  -0.726  -1.646
  506   2HD1  LEU  67          2HD1      LEU  67  -4.980  -0.162  -3.185
  507   3HD1  LEU  67          3HD1      LEU  67  -5.878   0.958  -2.136
  508   1HD2  LEU  67          1HD2      LEU  67  -8.455   0.362  -4.672
  509   2HD2  LEU  67          2HD2      LEU  67  -7.437   1.552  -3.857
  510   3HD2  LEU  67          3HD2      LEU  67  -6.744   0.500  -5.104
  511    H    GLY  68           H        GLY  68  -8.487  -5.018  -3.278
  512   1HA   GLY  68          2HA       GLY  68  -8.885  -6.982  -4.396
  513   2HA   GLY  68          3HA       GLY  68  -8.573  -6.214  -5.957
  514    H    TYR  69           H        TYR  69  -6.376  -6.006  -3.087
  515    HA   TYR  69           HA       TYR  69  -4.433  -7.797  -4.484
  516   1HB   TYR  69          2HB       TYR  69  -4.301  -4.930  -3.907
  517   2HB   TYR  69          3HB       TYR  69  -3.057  -5.782  -3.016
  518    HD1  TYR  69           HD1      TYR  69  -4.634  -5.711  -6.431
  519    HD2  TYR  69           HD2      TYR  69  -1.043  -6.282  -4.119
  520    HE1  TYR  69           HE1      TYR  69  -3.315  -5.624  -8.478
  521    HE2  TYR  69           HE2      TYR  69   0.289  -5.997  -6.132
  522    HH   TYR  69           HH       TYR  69   0.267  -5.836  -8.472
  523    H    HIS  70           H        HIS  70  -2.590  -8.311  -2.904
  524    HA   HIS  70           HA       HIS  70  -3.480  -8.440  -0.090
  525   1HB   HIS  70          2HB       HIS  70  -4.063 -10.577  -1.355
  526   2HB   HIS  70          3HB       HIS  70  -2.331 -10.865  -1.514
  527    HD1  HIS  70           1HD      HIS  70  -1.632  -9.991   1.652
  528    HD2  HIS  70           2HD      HIS  70  -4.667 -12.552   0.213
  529    HE1  HIS  70           1HE      HIS  70  -2.293 -11.481   3.570
  530    H    VAL  71           H        VAL  71  -1.854  -7.783   1.176
  531    HA   VAL  71           HA       VAL  71   0.942  -7.739   0.145
  532    HB   VAL  71           HB       VAL  71  -0.713  -5.930   1.853
  533   1HG1  VAL  71          1HG1      VAL  71   1.188  -4.797   2.840
  534   2HG1  VAL  71          2HG1      VAL  71   1.086  -6.451   3.448
  535   3HG1  VAL  71          3HG1      VAL  71   2.287  -6.025   2.211
  536   1HG2  VAL  71          1HG2      VAL  71  -0.260  -5.405  -0.496
  537   2HG2  VAL  71          2HG2      VAL  71   0.509  -4.212   0.575
  538   3HG2  VAL  71          3HG2      VAL  71   1.482  -5.480  -0.194
  539    H    VAL  72           H        VAL  72   2.575  -8.380   1.635
  540    HA   VAL  72           HA       VAL  72   1.696 -10.394   3.648
  541    HB   VAL  72           HB       VAL  72   3.987 -10.541   1.758
  542   1HG1  VAL  72          1HG1      VAL  72   3.181 -12.445   3.991
  543   2HG1  VAL  72          2HG1      VAL  72   4.379 -12.808   2.734
  544   3HG1  VAL  72          3HG1      VAL  72   4.695 -11.515   3.885
  545   1HG2  VAL  72          1HG2      VAL  72   1.484 -12.258   2.023
  546   2HG2  VAL  72          2HG2      VAL  72   1.837 -11.124   0.700
  547   3HG2  VAL  72          3HG2      VAL  72   2.840 -12.569   0.918
  548    H    ILE  73           H        ILE  73   2.901 -10.503   5.457
  549    HA   ILE  73           HA       ILE  73   4.348  -7.994   6.193
  550    HB   ILE  73           HB       ILE  73   2.707  -9.790   7.983
  551   1HG1  ILE  73          2HG1      ILE  73   1.180  -8.800   6.372
  552   2HG1  ILE  73          3HG1      ILE  73   1.042  -8.037   7.948
  553   1HG2  ILE  73          1HG2      ILE  73   4.386  -8.549   9.217
  554   2HG2  ILE  73          2HG2      ILE  73   4.021  -7.058   8.349
  555   3HG2  ILE  73          3HG2      ILE  73   2.832  -7.754   9.475
  556   1HD1  ILE  73          1HD1      ILE  73   2.298  -6.095   7.206
  557   2HD1  ILE  73          2HD1      ILE  73   2.525  -6.812   5.592
  558   3HD1  ILE  73          3HD1      ILE  73   0.912  -6.376   6.153
  559    H    GLU  74           H        GLU  74   6.321  -9.193   5.298
  560    HA   GLU  74           HA       GLU  74   7.356 -11.251   6.890
  561   1HB   GLU  74          2HB       GLU  74   8.408  -9.590   4.608
  562   2HB   GLU  74          3HB       GLU  74   9.492 -10.542   5.606
  563   1HG   GLU  74          2HG       GLU  74   7.986 -12.567   5.171
  564   2HG   GLU  74          3HG       GLU  74   7.249 -11.605   3.874
  565    H    GLY  75           H        GLY  75   6.921  -8.183   7.646
  566   1HA   GLY  75          2HA       GLY  75   9.429  -7.658   9.141
  567   2HA   GLY  75          3HA       GLY  75   8.010  -6.607   9.059
  568    H    ARG  76           H        ARG  76   6.049  -7.353  10.160
  569    HA   ARG  76           HA       ARG  76   5.078  -7.500  12.156
  570   1HB   ARG  76          2HB       ARG  76   4.802  -9.728  11.260
  571   2HB   ARG  76          3HB       ARG  76   6.318 -10.253  11.992
  572   1HG   ARG  76          2HG       ARG  76   5.384 -10.431  14.095
  573   2HG   ARG  76          3HG       ARG  76   4.355  -9.013  13.878
  574   1HD   ARG  76          2HD       ARG  76   2.793 -10.262  12.489
  575   2HD   ARG  76          3HD       ARG  76   3.762 -11.725  12.599
  576    HE   ARG  76           HE       ARG  76   1.969 -10.536  14.595
  577   1HH1  ARG  76          2HH2      ARG  76   4.735 -12.663  14.199
  578   2HH1  ARG  76          1HH2      ARG  76   4.467 -13.589  15.644
  579   1HH2  ARG  76          2HH1      ARG  76   1.619 -11.651  16.592
  580   2HH2  ARG  76          1HH1      ARG  76   2.658 -12.955  17.064
  Start of MODEL   18
    1   1H    MET   1          H1        MET   1  -1.979  17.608  18.709
    2   2H    MET   1          H2        MET   1  -1.149  18.049  20.051
    3   3H    MET   1          H3        MET   1  -0.799  18.782  18.615
    4    HA   MET   1           HA       MET   1   0.812  17.122  19.371
    5   1HB   MET   1          2HB       MET   1   0.237  14.755  19.005
    6   2HB   MET   1          3HB       MET   1  -0.653  15.490  20.341
    7   1HG   MET   1          2HG       MET   1  -1.799  15.097  17.546
    8   2HG   MET   1          3HG       MET   1  -2.007  13.962  18.875
    9   1HE   MET   1          1HE       MET   1  -5.541  15.689  18.338
   10   2HE   MET   1          2HE       MET   1  -4.320  15.492  17.058
   11   3HE   MET   1          3HE       MET   1  -4.632  14.168  18.208
   12    H    LEU   2           H        LEU   2  -1.342  17.661  16.604
   13    HA   LEU   2           HA       LEU   2  -0.964  17.704  14.429
   14   1HB   LEU   2          2HB       LEU   2   1.782  18.216  15.446
   15   2HB   LEU   2          3HB       LEU   2   1.793  17.413  13.901
   16    HG   LEU   2           HG       LEU   2   1.922  19.832  13.750
   17   1HD1  LEU   2          1HD1      LEU   2   0.976  18.561  11.867
   18   2HD1  LEU   2          2HD1      LEU   2  -0.664  18.796  12.508
   19   3HD1  LEU   2          3HD1      LEU   2   0.293  20.191  11.988
   20   1HD2  LEU   2          1HD2      LEU   2  -0.930  19.956  14.817
   21   2HD2  LEU   2          2HD2      LEU   2   0.532  20.390  15.731
   22   3HD2  LEU   2          3HD2      LEU   2   0.085  21.305  14.279
   23    H    SER   3           H        SER   3   0.460  16.332  12.650
   24    HA   SER   3           HA       SER   3  -0.246  13.491  13.219
   25   1HB   SER   3          2HB       SER   3  -0.148  14.934  10.537
   26   2HB   SER   3          3HB       SER   3  -0.938  13.410  10.930
   27    HG   SER   3           HG       SER   3  -2.192  14.782  12.477
   28    H    GLU   4           H        GLU   4   1.612  12.237  13.340
   29    HA   GLU   4           HA       GLU   4   4.157  13.165  12.242
   30   1HB   GLU   4          2HB       GLU   4   3.244  10.898  13.888
   31   2HB   GLU   4          3HB       GLU   4   4.441  10.460  12.696
   32   1HG   GLU   4          2HG       GLU   4   5.708  12.528  13.629
   33   2HG   GLU   4          3HG       GLU   4   4.642  12.306  15.012
   34    H    GLN   5           H        GLN   5   5.300  11.411  10.794
   35    HA   GLN   5           HA       GLN   5   3.461  10.018   8.973
   36   1HB   GLN   5          2HB       GLN   5   5.928  11.626   8.268
   37   2HB   GLN   5          3HB       GLN   5   5.197  10.508   7.133
   38   1HG   GLN   5          2HG       GLN   5   3.547  12.778   8.367
   39   2HG   GLN   5          3HG       GLN   5   4.662  13.070   7.056
   40   1HE2  GLN   5          1HE2      GLN   5   3.193   9.882   6.927
   41   2HE2  GLN   5          2HE2      GLN   5   2.048  10.292   5.670
   42    H    LYS   6           H        LYS   6   4.304   7.952   8.499
   43    HA   LYS   6           HA       LYS   6   7.104   7.414   9.023
   44   1HB   LYS   6          2HB       LYS   6   4.909   5.760  10.260
   45   2HB   LYS   6          3HB       LYS   6   6.521   5.113   9.989
   46   1HG   LYS   6          2HG       LYS   6   6.031   7.622  11.634
   47   2HG   LYS   6          3HG       LYS   6   6.107   6.006  12.322
   48   1HD   LYS   6          2HD       LYS   6   8.362   5.817  12.134
   49   2HD   LYS   6          3HD       LYS   6   8.422   6.570  10.555
   50   1HE   LYS   6          2HE       LYS   6   9.672   7.866  12.197
   51   2HE   LYS   6          3HE       LYS   6   8.379   8.803  11.457
   52   1HZ   LYS   6          1HZ       LYS   6   8.531   9.127  13.861
   53   2HZ   LYS   6          2HZ       LYS   6   7.082   8.595  13.455
   54   3HZ   LYS   6          3HZ       LYS   6   8.154   7.551  14.129
   55    H    GLU   7           H        GLU   7   7.830   5.531   7.945
   56    HA   GLU   7           HA       GLU   7   6.404   4.996   5.387
   57   1HB   GLU   7          2HB       GLU   7   9.420   4.897   5.715
   58   2HB   GLU   7          3HB       GLU   7   8.432   5.048   4.267
   59   1HG   GLU   7          2HG       GLU   7   9.286   7.175   4.487
   60   2HG   GLU   7          3HG       GLU   7   7.765   7.395   5.373
   61    H    ILE   8           H        ILE   8   5.508   2.904   5.796
   62    HA   ILE   8           HA       ILE   8   7.091   0.907   7.215
   63    HB   ILE   8           HB       ILE   8   4.550   0.514   5.752
   64   1HG1  ILE   8          2HG1      ILE   8   3.912   2.491   6.869
   65   2HG1  ILE   8          3HG1      ILE   8   3.155   1.076   7.603
   66   1HG2  ILE   8          1HG2      ILE   8   5.753  -0.600   8.257
   67   2HG2  ILE   8          2HG2      ILE   8   4.115  -1.019   7.671
   68   3HG2  ILE   8          3HG2      ILE   8   5.543  -1.437   6.701
   69   1HD1  ILE   8          1HD1      ILE   8   4.728   1.048   9.388
   70   2HD1  ILE   8          2HD1      ILE   8   5.664   2.363   8.639
   71   3HD1  ILE   8          3HD1      ILE   8   4.016   2.682   9.262
   72    H    ALA   9           H        ALA   9   7.576  -1.250   6.037
   73    HA   ALA   9           HA       ALA   9   7.718  -0.978   3.074
   74   1HB   ALA   9          1HB       ALA   9   9.967  -2.008   4.828
   75   2HB   ALA   9          2HB       ALA   9   9.971  -1.839   3.064
   76   3HB   ALA   9          3HB       ALA   9   9.935  -0.398   4.111
   77    H    MET  10           H        MET  10   6.623  -2.687   2.199
   78    HA   MET  10           HA       MET  10   6.629  -5.332   3.613
   79   1HB   MET  10          2HB       MET  10   4.221  -3.708   2.726
   80   2HB   MET  10          3HB       MET  10   4.154  -5.428   3.110
   81   1HG   MET  10          2HG       MET  10   4.781  -5.093   5.370
   82   2HG   MET  10          3HG       MET  10   5.168  -3.394   5.120
   83   1HE   MET  10          1HE       MET  10   2.703  -2.190   3.482
   84   2HE   MET  10          2HE       MET  10   1.770  -1.624   4.882
   85   3HE   MET  10          3HE       MET  10   3.542  -1.473   4.877
   86    H    GLN  11           H        GLN  11   5.351  -6.932   2.102
   87    HA   GLN  11           HA       GLN  11   6.424  -6.697  -0.682
   88   1HB   GLN  11          2HB       GLN  11   6.534  -8.809   1.320
   89   2HB   GLN  11          3HB       GLN  11   5.584  -9.374  -0.048
   90   1HG   GLN  11          2HG       GLN  11   8.295  -8.104  -0.521
   91   2HG   GLN  11          3HG       GLN  11   8.133  -9.787  -0.007
   92   1HE2  GLN  11          1HE2      GLN  11   7.424  -7.582  -2.658
   93   2HE2  GLN  11          2HE2      GLN  11   6.745  -8.794  -3.747
   94    H    VAL  12           H        VAL  12   4.948  -7.883  -2.322
   95    HA   VAL  12           HA       VAL  12   2.065  -7.769  -1.556
   96    HB   VAL  12           HB       VAL  12   1.717  -7.061  -3.978
   97   1HG1  VAL  12          1HG1      VAL  12   1.968  -4.644  -3.449
   98   2HG1  VAL  12          2HG1      VAL  12   1.196  -5.557  -2.138
   99   3HG1  VAL  12          3HG1      VAL  12   2.904  -5.089  -2.010
  100   1HG2  VAL  12          1HG2      VAL  12   4.144  -7.411  -4.654
  101   2HG2  VAL  12          2HG2      VAL  12   3.396  -5.874  -5.124
  102   3HG2  VAL  12          3HG2      VAL  12   4.516  -5.927  -3.739
  103    H    SER  13           H        SER  13   0.691  -9.151  -2.644
  104    HA   SER  13           HA       SER  13   1.946 -11.393  -4.193
  105   1HB   SER  13          2HB       SER  13  -0.389 -11.397  -2.235
  106   2HB   SER  13          3HB       SER  13   0.128 -12.795  -3.201
  107    HG   SER  13           HG       SER  13   1.034 -12.726  -1.047
  108    H    GLY  14           H        GLY  14   0.134 -12.529  -5.541
  109   1HA   GLY  14          2HA       GLY  14  -1.726 -12.540  -6.882
  110   2HA   GLY  14          3HA       GLY  14  -2.209 -10.965  -6.247
  111    H    MET  15           H        MET  15  -0.045  -9.406  -6.910
  112    HA   MET  15           HA       MET  15  -0.546  -8.355  -9.304
  113   1HB   MET  15          2HB       MET  15   1.582  -7.212  -9.164
  114   2HB   MET  15          3HB       MET  15   0.919  -7.480  -7.554
  115   1HG   MET  15          2HG       MET  15   3.035  -8.026  -7.101
  116   2HG   MET  15          3HG       MET  15   2.448  -9.628  -7.544
  117   1HE   MET  15          1HE       MET  15   4.927 -10.459  -7.781
  118   2HE   MET  15          2HE       MET  15   6.176  -9.593  -8.707
  119   3HE   MET  15          3HE       MET  15   5.467  -8.846  -7.257
  120    H    THR  16           H        THR  16   0.000  -8.470 -11.412
  121    HA   THR  16           HA       THR  16   2.011 -10.335 -12.402
  122    HB   THR  16           HB       THR  16   0.006 -11.074 -14.119
  123    HG1  THR  16           1HG      THR  16  -1.086 -11.104 -11.494
  124   1HG2  THR  16          1HG2      THR  16   0.002 -13.230 -12.937
  125   2HG2  THR  16          2HG2      THR  16   1.644 -12.591 -13.095
  126   3HG2  THR  16          3HG2      THR  16   0.807 -12.505 -11.533
  127    H    CYS  17           H        CYS  17  -0.455  -7.822 -13.409
  128    HA   CYS  17           HA       CYS  17   1.007  -7.552 -15.926
  129   1HB   CYS  17          2HB       CYS  17  -0.470  -5.787 -16.487
  130   2HB   CYS  17          3HB       CYS  17  -1.412  -7.149 -15.857
  131    H    ALA  18           H        ALA  18   1.786  -6.612 -12.828
  132    HA   ALA  18           HA       ALA  18   3.371  -5.287 -11.946
  133   1HB   ALA  18          1HB       ALA  18   5.371  -4.897 -13.263
  134   2HB   ALA  18          2HB       ALA  18   4.724  -6.505 -13.641
  135   3HB   ALA  18          3HB       ALA  18   4.489  -5.161 -14.777
  136    H    ALA  19           H        ALA  19   0.929  -4.025 -12.832
  137    HA   ALA  19           HA       ALA  19   1.868  -1.197 -12.830
  138   1HB   ALA  19          1HB       ALA  19  -0.208  -2.321 -14.755
  139   2HB   ALA  19          2HB       ALA  19   0.239  -0.609 -14.565
  140   3HB   ALA  19          3HB       ALA  19   1.429  -1.775 -15.176
  141    H    CYS  20           H        CYS  20  -0.965  -3.416 -12.493
  142    HA   CYS  20           HA       CYS  20  -2.662  -1.707 -11.097
  143   1HB   CYS  20          2HB       CYS  20  -3.562  -3.871 -10.097
  144   2HB   CYS  20          3HB       CYS  20  -3.423  -3.863 -11.861
  145    H    ALA  21           H        ALA  21   0.161  -3.419  -9.915
  146    HA   ALA  21           HA       ALA  21  -0.011  -3.058  -7.154
  147   1HB   ALA  21          1HB       ALA  21   1.781  -4.271  -8.455
  148   2HB   ALA  21          2HB       ALA  21   2.490  -2.692  -8.854
  149   3HB   ALA  21          3HB       ALA  21   2.392  -3.241  -7.164
  150    H    ALA  22           H        ALA  22   0.628  -0.566  -9.648
  151    HA   ALA  22           HA       ALA  22   1.291   1.509  -7.676
  152   1HB   ALA  22          1HB       ALA  22   2.038   1.637 -10.046
  153   2HB   ALA  22          2HB       ALA  22   0.337   1.737 -10.560
  154   3HB   ALA  22          3HB       ALA  22   1.040   3.026  -9.561
  155    H    ARG  23           H        ARG  23  -1.594   0.408  -9.476
  156    HA   ARG  23           HA       ARG  23  -3.250   2.608  -8.798
  157   1HB   ARG  23          2HB       ARG  23  -3.989  -0.276  -9.451
  158   2HB   ARG  23          3HB       ARG  23  -5.154   1.037  -9.335
  159   1HG   ARG  23          2HG       ARG  23  -2.762   1.248 -11.206
  160   2HG   ARG  23          3HG       ARG  23  -4.209   0.377 -11.693
  161   1HD   ARG  23          2HD       ARG  23  -4.360   3.221 -10.634
  162   2HD   ARG  23          3HD       ARG  23  -4.016   2.871 -12.337
  163    HE   ARG  23           HE       ARG  23  -6.218   1.354 -11.924
  164   1HH1  ARG  23          2HH2      ARG  23  -5.597   4.762 -11.254
  165   2HH1  ARG  23          1HH2      ARG  23  -7.196   5.300 -11.660
  166   1HH2  ARG  23          2HH1      ARG  23  -8.323   2.045 -12.558
  167   2HH2  ARG  23          1HH1      ARG  23  -8.780   3.710 -12.426
  168    H    ILE  24           H        ILE  24  -2.722  -0.519  -7.089
  169    HA   ILE  24           HA       ILE  24  -4.637   0.088  -5.095
  170    HB   ILE  24           HB       ILE  24  -3.809  -1.611  -3.725
  171   1HG1  ILE  24          2HG1      ILE  24  -1.326  -1.313  -5.339
  172   2HG1  ILE  24          3HG1      ILE  24  -1.545  -1.227  -3.575
  173   1HG2  ILE  24          1HG2      ILE  24  -3.377  -2.561  -6.583
  174   2HG2  ILE  24          2HG2      ILE  24  -4.075  -3.424  -5.199
  175   3HG2  ILE  24          3HG2      ILE  24  -4.975  -2.111  -5.952
  176   1HD1  ILE  24          1HD1      ILE  24  -1.990  -3.683  -3.569
  177   2HD1  ILE  24          2HD1      ILE  24  -1.607  -3.693  -5.316
  178   3HD1  ILE  24          3HD1      ILE  24  -0.360  -3.256  -4.141
  179    H    GLU  25           H        GLU  25  -1.070   0.629  -4.868
  180    HA   GLU  25           HA       GLU  25  -1.092   2.062  -2.474
  181   1HB   GLU  25          2HB       GLU  25   0.714   1.860  -4.848
  182   2HB   GLU  25          3HB       GLU  25   0.921   3.312  -3.858
  183   1HG   GLU  25          2HG       GLU  25   2.375   1.406  -3.156
  184   2HG   GLU  25          3HG       GLU  25   1.339   2.019  -1.868
  185    H    LYS  26           H        LYS  26  -1.800   3.299  -5.728
  186    HA   LYS  26           HA       LYS  26  -1.747   6.084  -4.789
  187   1HB   LYS  26          2HB       LYS  26  -2.753   4.999  -7.432
  188   2HB   LYS  26          3HB       LYS  26  -2.497   6.697  -7.013
  189   1HG   LYS  26          2HG       LYS  26  -0.379   4.553  -7.357
  190   2HG   LYS  26          3HG       LYS  26  -0.677   5.956  -8.370
  191   1HD   LYS  26          2HD       LYS  26   0.100   7.423  -6.464
  192   2HD   LYS  26          3HD       LYS  26   0.323   5.973  -5.474
  193   1HE   LYS  26          2HE       LYS  26   2.476   6.562  -6.252
  194   2HE   LYS  26          3HE       LYS  26   1.985   5.065  -7.049
  195   1HZ   LYS  26          1HZ       LYS  26   1.926   7.765  -8.241
  196   2HZ   LYS  26          2HZ       LYS  26   3.008   6.576  -8.577
  197   3HZ   LYS  26          3HZ       LYS  26   1.434   6.388  -9.003
  198    H    GLY  27           H        GLY  27  -4.316   3.672  -5.461
  199   1HA   GLY  27          2HA       GLY  27  -6.490   5.449  -4.766
  200   2HA   GLY  27          3HA       GLY  27  -6.520   3.686  -4.681
  201    H    LEU  28           H        LEU  28  -4.336   3.233  -2.916
  202    HA   LEU  28           HA       LEU  28  -5.630   3.586  -0.420
  203   1HB   LEU  28          2HB       LEU  28  -4.209   1.746  -0.918
  204   2HB   LEU  28          3HB       LEU  28  -2.800   2.777  -1.117
  205    HG   LEU  28           HG       LEU  28  -3.090   1.379   1.019
  206   1HD1  LEU  28          1HD1      LEU  28  -1.991   3.231   2.358
  207   2HD1  LEU  28          2HD1      LEU  28  -1.297   2.890   0.757
  208   3HD1  LEU  28          3HD1      LEU  28  -2.340   4.295   0.993
  209   1HD2  LEU  28          1HD2      LEU  28  -5.400   2.013   1.583
  210   2HD2  LEU  28          2HD2      LEU  28  -4.279   2.446   2.883
  211   3HD2  LEU  28          3HD2      LEU  28  -4.895   3.695   1.842
  212    H    LYS  29           H        LYS  29  -3.067   5.446  -2.064
  213    HA   LYS  29           HA       LYS  29  -2.512   7.325  -0.081
  214   1HB   LYS  29          2HB       LYS  29  -1.556   6.917  -2.532
  215   2HB   LYS  29          3HB       LYS  29  -2.729   8.173  -2.959
  216   1HG   LYS  29          2HG       LYS  29  -1.558   9.418  -0.878
  217   2HG   LYS  29          3HG       LYS  29  -0.310   8.215  -1.201
  218   1HD   LYS  29          2HD       LYS  29   0.414   9.963  -2.682
  219   2HD   LYS  29          3HD       LYS  29  -0.607   9.011  -3.736
  220   1HE   LYS  29          2HE       LYS  29  -1.277  11.270  -4.031
  221   2HE   LYS  29          3HE       LYS  29  -2.541  10.556  -3.005
  222   1HZ   LYS  29          1HZ       LYS  29  -1.171  11.500  -1.097
  223   2HZ   LYS  29          2HZ       LYS  29  -0.315  12.317  -2.182
  224   3HZ   LYS  29          3HZ       LYS  29  -1.937  12.618  -2.039
  225    H    ARG  30           H        ARG  30  -5.514   6.976  -1.821
  226    HA   ARG  30           HA       ARG  30  -6.387   9.762  -1.364
  227   1HB   ARG  30          2HB       ARG  30  -7.260   7.452  -2.991
  228   2HB   ARG  30          3HB       ARG  30  -8.594   8.235  -2.189
  229   1HG   ARG  30          2HG       ARG  30  -7.835  10.410  -3.181
  230   2HG   ARG  30          3HG       ARG  30  -6.477   9.546  -3.943
  231   1HD   ARG  30          2HD       ARG  30  -8.160   8.017  -5.054
  232   2HD   ARG  30          3HD       ARG  30  -9.461   9.040  -4.467
  233    HE   ARG  30           HE       ARG  30  -7.625   9.471  -6.683
  234   1HH1  ARG  30          2HH2      ARG  30  -9.610  11.186  -4.340
  235   2HH1  ARG  30          1HH2      ARG  30  -9.830  12.614  -5.305
  236   1HH2  ARG  30          2HH1      ARG  30  -7.855  11.349  -8.000
  237   2HH2  ARG  30          1HH1      ARG  30  -8.780  12.704  -7.444
  238    H    MET  31           H        MET  31  -6.055   7.055   0.640
  239    HA   MET  31           HA       MET  31  -8.672   7.291   1.939
  240   1HB   MET  31          2HB       MET  31  -6.225   5.638   2.674
  241   2HB   MET  31          3HB       MET  31  -7.862   5.380   3.272
  242   1HG   MET  31          2HG       MET  31  -7.019   5.142   0.357
  243   2HG   MET  31          3HG       MET  31  -7.229   3.817   1.467
  244   1HE   MET  31          1HE       MET  31  -8.569   4.416  -1.572
  245   2HE   MET  31          2HE       MET  31  -8.370   2.921  -0.631
  246   3HE   MET  31          3HE       MET  31  -9.986   3.424  -1.228
  247    HA   PRO  32           HA       PRO  32  -7.388  10.169   5.053
  248   1HB   PRO  32          2HB       PRO  32  -8.437   9.116   7.404
  249   2HB   PRO  32          3HB       PRO  32  -9.384   9.986   6.165
  250   1HG   PRO  32          2HG       PRO  32  -9.036   6.999   6.472
  251   2HG   PRO  32          3HG       PRO  32 -10.563   7.904   6.238
  252   1HD   PRO  32          2HD       PRO  32  -9.357   6.717   4.157
  253   2HD   PRO  32          3HD       PRO  32 -10.019   8.358   3.943
  254    H    GLY  33           H        GLY  33  -5.722  10.461   6.567
  255   1HA   GLY  33          2HA       GLY  33  -3.993   9.929   7.955
  256   2HA   GLY  33          3HA       GLY  33  -4.395   8.204   7.813
  257    H    VAL  34           H        VAL  34  -4.215   8.249   4.813
  258    HA   VAL  34           HA       VAL  34  -1.290   7.976   4.683
  259    HB   VAL  34           HB       VAL  34  -3.298   7.492   2.470
  260   1HG1  VAL  34          1HG1      VAL  34  -0.920   7.738   1.761
  261   2HG1  VAL  34          2HG1      VAL  34  -0.412   6.577   3.001
  262   3HG1  VAL  34          3HG1      VAL  34  -1.395   6.057   1.634
  263   1HG2  VAL  34          1HG2      VAL  34  -3.926   6.070   4.371
  264   2HG2  VAL  34          2HG2      VAL  34  -3.144   5.098   3.135
  265   3HG2  VAL  34          3HG2      VAL  34  -2.237   5.568   4.589
  266    H    THR  35           H        THR  35   0.083   9.309   3.578
  267    HA   THR  35           HA       THR  35  -1.134  11.709   2.257
  268    HB   THR  35           HB       THR  35   0.971  11.442   4.258
  269    HG1  THR  35           1HG      THR  35  -0.522  13.639   3.290
  270   1HG2  THR  35          1HG2      THR  35   2.528  11.943   2.519
  271   2HG2  THR  35          2HG2      THR  35   1.472  13.211   1.834
  272   3HG2  THR  35          3HG2      THR  35   2.223  13.425   3.430
  273    H    ASP  36           H        ASP  36   1.614   9.288   2.041
  274    HA   ASP  36           HA       ASP  36   1.344   9.538  -0.841
  275   1HB   ASP  36          2HB       ASP  36   3.714  10.564   0.628
  276   2HB   ASP  36          3HB       ASP  36   4.048   9.504  -0.745
  277    H    ALA  37           H        ALA  37   2.468   7.851  -1.972
  278    HA   ALA  37           HA       ALA  37   3.229   5.495  -0.441
  279   1HB   ALA  37          1HB       ALA  37   0.687   5.330  -2.117
  280   2HB   ALA  37          2HB       ALA  37   1.420   4.051  -1.119
  281   3HB   ALA  37          3HB       ALA  37   0.696   5.462  -0.345
  282    H    ASN  38           H        ASN  38   4.211   3.825  -1.721
  283    HA   ASN  38           HA       ASN  38   4.868   4.517  -4.511
  284   1HB   ASN  38          2HB       ASN  38   7.390   4.237  -3.218
  285   2HB   ASN  38          3HB       ASN  38   6.736   5.621  -4.071
  286   1HD2  ASN  38          1HD2      ASN  38   6.032   4.185  -0.792
  287   2HD2  ASN  38          2HD2      ASN  38   6.415   5.686   0.046
  288    H    VAL  39           H        VAL  39   4.878   2.616  -5.526
  289    HA   VAL  39           HA       VAL  39   5.227   0.152  -3.985
  290    HB   VAL  39           HB       VAL  39   3.230   0.606  -5.289
  291   1HG1  VAL  39          1HG1      VAL  39   4.874   0.222  -7.834
  292   2HG1  VAL  39          2HG1      VAL  39   3.144   0.339  -7.691
  293   3HG1  VAL  39          3HG1      VAL  39   4.141   1.750  -7.297
  294   1HG2  VAL  39          1HG2      VAL  39   4.269  -1.732  -4.783
  295   2HG2  VAL  39          2HG2      VAL  39   2.870  -1.554  -5.829
  296   3HG2  VAL  39          3HG2      VAL  39   4.468  -1.782  -6.561
  297    H    ASN  40           H        ASN  40   7.410  -0.283  -3.701
  298    HA   ASN  40           HA       ASN  40   9.314   0.295  -5.864
  299   1HB   ASN  40          2HB       ASN  40   9.760   0.803  -3.458
  300   2HB   ASN  40          3HB       ASN  40   9.783  -0.937  -3.124
  301   1HD2  ASN  40          1HD2      ASN  40  12.028   0.056  -2.366
  302   2HD2  ASN  40          2HD2      ASN  40  13.311  -0.067  -3.558
  303    H    LEU  41           H        LEU  41   7.710  -1.374  -6.980
  304    HA   LEU  41           HA       LEU  41   8.190  -4.176  -6.468
  305   1HB   LEU  41          2HB       LEU  41   6.592  -2.529  -8.340
  306   2HB   LEU  41          3HB       LEU  41   7.148  -4.028  -9.057
  307    HG   LEU  41           HG       LEU  41   4.893  -3.994  -7.898
  308   1HD1  LEU  41          1HD1      LEU  41   6.903  -6.183  -7.248
  309   2HD1  LEU  41          2HD1      LEU  41   5.136  -6.341  -7.166
  310   3HD1  LEU  41          3HD1      LEU  41   5.926  -6.036  -8.722
  311   1HD2  LEU  41          1HD2      LEU  41   6.056  -3.033  -5.676
  312   2HD2  LEU  41          2HD2      LEU  41   4.673  -4.124  -5.601
  313   3HD2  LEU  41          3HD2      LEU  41   6.309  -4.747  -5.339
  314    H    ALA  42           H        ALA  42   9.923  -1.807  -8.253
  315    HA   ALA  42           HA       ALA  42  11.562  -3.253  -9.976
  316   1HB   ALA  42          1HB       ALA  42  11.738  -0.801  -9.548
  317   2HB   ALA  42          2HB       ALA  42  12.400  -1.166  -7.927
  318   3HB   ALA  42          3HB       ALA  42  13.306  -1.635  -9.375
  319    H    THR  43           H        THR  43  11.529  -3.261  -6.390
  320    HA   THR  43           HA       THR  43  13.260  -5.639  -6.531
  321    HB   THR  43           HB       THR  43  14.780  -3.864  -5.984
  322    HG1  THR  43           1HG      THR  43  14.896  -5.898  -4.852
  323   1HG2  THR  43          1HG2      THR  43  13.791  -2.039  -5.067
  324   2HG2  THR  43          2HG2      THR  43  12.653  -2.971  -4.091
  325   3HG2  THR  43          3HG2      THR  43  14.331  -2.798  -3.556
  326    H    GLU  44           H        GLU  44  10.609  -5.724  -6.616
  327    HA   GLU  44           HA       GLU  44   8.634  -6.257  -5.522
  328   1HB   GLU  44          2HB       GLU  44  10.736  -8.253  -4.655
  329   2HB   GLU  44          3HB       GLU  44   9.005  -8.514  -4.472
  330   1HG   GLU  44          2HG       GLU  44   8.905  -9.326  -6.540
  331   2HG   GLU  44          3HG       GLU  44   9.257  -7.719  -7.176
  332    H    THR  45           H        THR  45   9.294  -4.079  -4.073
  333    HA   THR  45           HA       THR  45   8.298  -4.905  -1.413
  334    HB   THR  45           HB       THR  45   9.729  -2.500  -1.128
  335    HG1  THR  45           1HG      THR  45  11.304  -4.349  -2.563
  336   1HG2  THR  45          1HG2      THR  45   9.525  -4.242   0.614
  337   2HG2  THR  45          2HG2      THR  45  10.554  -5.333  -0.342
  338   3HG2  THR  45          3HG2      THR  45  11.230  -3.840   0.344
  339    H    VAL  46           H        VAL  46   7.117  -3.087  -0.374
  340    HA   VAL  46           HA       VAL  46   6.224  -0.932  -2.197
  341    HB   VAL  46           HB       VAL  46   4.505  -2.555  -2.483
  342   1HG1  VAL  46          1HG1      VAL  46   3.190  -3.434  -0.492
  343   2HG1  VAL  46          2HG1      VAL  46   4.800  -4.129  -0.711
  344   3HG1  VAL  46          3HG1      VAL  46   4.514  -2.894   0.543
  345   1HG2  VAL  46          1HG2      VAL  46   2.573  -1.462  -1.576
  346   2HG2  VAL  46          2HG2      VAL  46   3.527  -0.579  -0.379
  347   3HG2  VAL  46          3HG2      VAL  46   3.746  -0.240  -2.114
  348    H    ASN  47           H        ASN  47   5.894   1.018  -1.129
  349    HA   ASN  47           HA       ASN  47   6.410   1.032   1.793
  350   1HB   ASN  47          2HB       ASN  47   7.659   2.723  -0.421
  351   2HB   ASN  47          3HB       ASN  47   7.618   3.250   1.268
  352   1HD2  ASN  47          1HD2      ASN  47   8.442   1.475   2.902
  353   2HD2  ASN  47          2HD2      ASN  47  10.012   0.857   2.422
  354    H    VAL  48           H        VAL  48   5.122   2.550   2.912
  355    HA   VAL  48           HA       VAL  48   3.171   4.095   1.315
  356    HB   VAL  48           HB       VAL  48   2.140   1.949   1.660
  357   1HG1  VAL  48          1HG1      VAL  48   1.617   1.061   3.897
  358   2HG1  VAL  48          2HG1      VAL  48   3.349   1.047   3.552
  359   3HG1  VAL  48          3HG1      VAL  48   2.673   2.277   4.633
  360   1HG2  VAL  48          1HG2      VAL  48   1.020   4.203   3.354
  361   2HG2  VAL  48          2HG2      VAL  48   0.679   3.803   1.675
  362   3HG2  VAL  48          3HG2      VAL  48   0.151   2.707   2.972
  363    H    ILE  49           H        ILE  49   3.029   6.090   2.116
  364    HA   ILE  49           HA       ILE  49   4.622   6.667   4.513
  365    HB   ILE  49           HB       ILE  49   3.904   8.601   2.284
  366   1HG1  ILE  49          2HG1      ILE  49   5.011   6.935   1.048
  367   2HG1  ILE  49          3HG1      ILE  49   6.155   8.233   1.353
  368   1HG2  ILE  49          1HG2      ILE  49   5.922   9.776   3.106
  369   2HG2  ILE  49          2HG2      ILE  49   4.634   9.656   4.310
  370   3HG2  ILE  49          3HG2      ILE  49   6.048   8.600   4.427
  371   1HD1  ILE  49          1HD1      ILE  49   6.138   5.441   2.522
  372   2HD1  ILE  49          2HD1      ILE  49   7.445   6.320   1.721
  373   3HD1  ILE  49          3HD1      ILE  49   6.961   6.768   3.357
  374    H    TYR  50           H        TYR  50   3.126   6.747   6.207
  375    HA   TYR  50           HA       TYR  50   0.693   8.449   5.858
  376   1HB   TYR  50          2HB       TYR  50  -0.735   6.775   6.735
  377   2HB   TYR  50          3HB       TYR  50   0.044   6.173   5.305
  378    HD1  TYR  50           HD1      TYR  50   1.439   4.145   5.428
  379    HD2  TYR  50           HD2      TYR  50  -0.092   5.923   9.012
  380    HE1  TYR  50           HE1      TYR  50   1.306   1.916   6.489
  381    HE2  TYR  50           HE2      TYR  50   0.309   3.798  10.217
  382    HH   TYR  50           HH       TYR  50   0.962   0.775   8.487
  383    H    ASP  51           H        ASP  51  -0.453   8.815   7.784
  384    HA   ASP  51           HA       ASP  51   1.324   9.427  10.051
  385   1HB   ASP  51          2HB       ASP  51  -0.197  11.148   9.483
  386   2HB   ASP  51          3HB       ASP  51  -1.575  10.042   9.513
  387    HA   PRO  52           HA       PRO  52   0.008   5.426  11.746
  388   1HB   PRO  52          2HB       PRO  52   1.813   5.130  13.737
  389   2HB   PRO  52          3HB       PRO  52   2.269   5.014  12.012
  390   1HG   PRO  52          2HG       PRO  52   2.469   7.461  13.801
  391   2HG   PRO  52          3HG       PRO  52   3.767   6.736  12.807
  392   1HD   PRO  52          2HD       PRO  52   2.266   8.817  11.926
  393   2HD   PRO  52          3HD       PRO  52   2.775   7.516  10.804
  394    H    ALA  53           H        ALA  53  -0.670   8.521  12.969
  395    HA   ALA  53           HA       ALA  53  -1.866   7.524  15.484
  396   1HB   ALA  53          1HB       ALA  53  -2.594   9.824  15.716
  397   2HB   ALA  53          2HB       ALA  53  -0.858   9.818  15.321
  398   3HB   ALA  53          3HB       ALA  53  -2.062  10.206  14.070
  399    H    GLU  54           H        GLU  54  -2.519   8.082  12.054
  400    HA   GLU  54           HA       GLU  54  -5.413   8.104  12.570
  401   1HB   GLU  54          2HB       GLU  54  -3.973   9.960  11.310
  402   2HB   GLU  54          3HB       GLU  54  -4.259   8.905   9.935
  403   1HG   GLU  54          2HG       GLU  54  -6.389  10.121  11.767
  404   2HG   GLU  54          3HG       GLU  54  -5.919  10.761  10.190
  405    H    THR  55           H        THR  55  -2.998   6.845  10.246
  406    HA   THR  55           HA       THR  55  -4.534   4.334  10.079
  407    HB   THR  55           HB       THR  55  -2.826   3.767   8.130
  408    HG1  THR  55           1HG      THR  55  -3.236   6.474   7.844
  409   1HG2  THR  55          1HG2      THR  55  -5.225   3.792   8.042
  410   2HG2  THR  55          2HG2      THR  55  -5.273   5.576   7.952
  411   3HG2  THR  55          3HG2      THR  55  -4.545   4.639   6.619
  412    H    GLY  56           H        GLY  56  -2.552   2.576   9.649
  413   1HA   GLY  56          2HA       GLY  56  -0.780   1.838  11.511
  414   2HA   GLY  56          3HA       GLY  56  -2.204   2.215  12.511
  415    H    THR  57           H        THR  57  -1.138   0.562   9.870
  416    HA   THR  57           HA       THR  57  -1.813  -0.327   8.099
  417    HB   THR  57           HB       THR  57  -1.564  -2.808   8.270
  418    HG1  THR  57           1HG      THR  57  -1.207  -3.616  10.413
  419   1HG2  THR  57          1HG2      THR  57   0.688  -2.840   9.224
  420   2HG2  THR  57          2HG2      THR  57   0.467  -1.381   8.247
  421   3HG2  THR  57          3HG2      THR  57   0.418  -1.286  10.027
  422    H    ALA  58           H        ALA  58  -4.168  -1.007  10.574
  423    HA   ALA  58           HA       ALA  58  -6.286  -2.264   9.653
  424   1HB   ALA  58          1HB       ALA  58  -6.083   0.635  10.530
  425   2HB   ALA  58          2HB       ALA  58  -7.606  -0.305  10.541
  426   3HB   ALA  58          3HB       ALA  58  -6.239  -0.773  11.586
  427    H    ALA  59           H        ALA  59  -5.510   0.994   8.320
  428    HA   ALA  59           HA       ALA  59  -7.966   0.699   6.671
  429   1HB   ALA  59          1HB       ALA  59  -7.658   2.833   5.788
  430   2HB   ALA  59          2HB       ALA  59  -7.226   2.950   7.503
  431   3HB   ALA  59          3HB       ALA  59  -5.954   2.877   6.226
  432    H    ILE  60           H        ILE  60  -4.501   0.660   6.209
  433    HA   ILE  60           HA       ILE  60  -4.319   0.323   3.419
  434    HB   ILE  60           HB       ILE  60  -2.602  -0.300   5.845
  435   1HG1  ILE  60          2HG1      ILE  60  -0.971   1.004   4.384
  436   2HG1  ILE  60          3HG1      ILE  60  -2.314   1.209   3.248
  437   1HG2  ILE  60          1HG2      ILE  60  -1.900  -1.378   3.103
  438   2HG2  ILE  60          2HG2      ILE  60  -0.817  -1.252   4.510
  439   3HG2  ILE  60          3HG2      ILE  60  -2.194  -2.336   4.580
  440   1HD1  ILE  60          1HD1      ILE  60  -3.494   2.544   5.036
  441   2HD1  ILE  60          2HD1      ILE  60  -2.244   2.067   6.215
  442   3HD1  ILE  60          3HD1      ILE  60  -1.833   3.145   4.876
  443    H    GLN  61           H        GLN  61  -4.535  -2.227   5.956
  444    HA   GLN  61           HA       GLN  61  -4.564  -4.274   3.986
  445   1HB   GLN  61          2HB       GLN  61  -4.442  -4.112   6.789
  446   2HB   GLN  61          3HB       GLN  61  -5.808  -5.173   6.429
  447   1HG   GLN  61          2HG       GLN  61  -4.461  -6.785   5.420
  448   2HG   GLN  61          3HG       GLN  61  -3.213  -5.633   4.933
  449   1HE2  GLN  61          1HE2      GLN  61  -1.967  -4.530   6.694
  450   2HE2  GLN  61          2HE2      GLN  61  -1.514  -5.544   8.061
  451    H    GLU  62           H        GLU  62  -7.259  -2.695   5.778
  452    HA   GLU  62           HA       GLU  62  -9.477  -4.030   4.732
  453   1HB   GLU  62          2HB       GLU  62  -8.848  -1.266   5.686
  454   2HB   GLU  62          3HB       GLU  62 -10.202  -1.333   4.582
  455   1HG   GLU  62          2HG       GLU  62 -10.025  -3.147   7.005
  456   2HG   GLU  62          3HG       GLU  62 -10.771  -1.542   7.036
  457    H    LYS  63           H        LYS  63  -7.851  -1.163   3.255
  458    HA   LYS  63           HA       LYS  63  -9.459  -1.297   0.917
  459   1HB   LYS  63          2HB       LYS  63  -6.938   0.149   1.775
  460   2HB   LYS  63          3HB       LYS  63  -7.709   0.406   0.242
  461   1HG   LYS  63          2HG       LYS  63  -9.040   0.807   2.984
  462   2HG   LYS  63          3HG       LYS  63  -8.297   2.052   2.004
  463   1HD   LYS  63          2HD       LYS  63 -10.515   2.380   1.641
  464   2HD   LYS  63          3HD       LYS  63 -10.010   1.522   0.174
  465   1HE   LYS  63          2HE       LYS  63 -11.300  -0.348   0.682
  466   2HE   LYS  63          3HE       LYS  63 -11.227  -0.077   2.437
  467   1HZ   LYS  63          1HZ       LYS  63 -12.769   1.504   0.486
  468   2HZ   LYS  63          2HZ       LYS  63 -13.374   0.353   1.500
  469   3HZ   LYS  63          3HZ       LYS  63 -12.752   1.738   2.119
  470    H    ILE  64           H        ILE  64  -6.204  -2.480   1.668
  471    HA   ILE  64           HA       ILE  64  -5.240  -3.059  -0.786
  472    HB   ILE  64           HB       ILE  64  -4.894  -4.028   1.933
  473   1HG1  ILE  64          2HG1      ILE  64  -3.565  -2.241   0.671
  474   2HG1  ILE  64          3HG1      ILE  64  -2.656  -3.448   1.579
  475   1HG2  ILE  64          1HG2      ILE  64  -5.096  -6.183   1.245
  476   2HG2  ILE  64          2HG2      ILE  64  -4.139  -5.906  -0.239
  477   3HG2  ILE  64          3HG2      ILE  64  -3.374  -5.851   1.370
  478   1HD1  ILE  64          1HD1      ILE  64  -3.181  -3.640  -1.413
  479   2HD1  ILE  64          2HD1      ILE  64  -1.689  -3.020  -0.663
  480   3HD1  ILE  64          3HD1      ILE  64  -2.161  -4.712  -0.435
  481    H    GLU  65           H        GLU  65  -7.241  -5.106   1.433
  482    HA   GLU  65           HA       GLU  65  -7.871  -7.248  -0.324
  483   1HB   GLU  65          2HB       GLU  65  -9.192  -6.081   2.153
  484   2HB   GLU  65          3HB       GLU  65  -9.886  -7.462   1.299
  485   1HG   GLU  65          2HG       GLU  65  -6.970  -7.637   2.010
  486   2HG   GLU  65          3HG       GLU  65  -8.161  -7.771   3.310
  487    H    LYS  66           H        LYS  66  -9.835  -4.346   0.519
  488    HA   LYS  66           HA       LYS  66 -11.977  -4.973  -1.156
  489   1HB   LYS  66          2HB       LYS  66 -11.374  -2.935   0.599
  490   2HB   LYS  66          3HB       LYS  66 -11.427  -2.058  -0.927
  491   1HG   LYS  66          2HG       LYS  66 -13.592  -3.917   0.179
  492   2HG   LYS  66          3HG       LYS  66 -13.554  -2.163   0.402
  493   1HD   LYS  66          2HD       LYS  66 -13.468  -1.975  -2.180
  494   2HD   LYS  66          3HD       LYS  66 -13.928  -3.674  -2.230
  495   1HE   LYS  66          2HE       LYS  66 -15.489  -1.400  -0.884
  496   2HE   LYS  66          3HE       LYS  66 -15.873  -2.121  -2.451
  497   1HZ   LYS  66          1HZ       LYS  66 -16.307  -4.195  -1.350
  498   2HZ   LYS  66          2HZ       LYS  66 -15.908  -3.570   0.119
  499   3HZ   LYS  66          3HZ       LYS  66 -17.227  -3.009  -0.682
  500    H    LEU  67           H        LEU  67  -8.974  -3.361  -2.041
  501    HA   LEU  67           HA       LEU  67  -9.732  -2.607  -4.733
  502   1HB   LEU  67          2HB       LEU  67  -7.135  -2.814  -3.182
  503   2HB   LEU  67          3HB       LEU  67  -7.130  -2.471  -4.906
  504    HG   LEU  67           HG       LEU  67  -8.903  -0.787  -3.128
  505   1HD1  LEU  67          1HD1      LEU  67  -6.814  -0.622  -1.933
  506   2HD1  LEU  67          2HD1      LEU  67  -5.896  -0.503  -3.427
  507   3HD1  LEU  67          3HD1      LEU  67  -6.957   0.832  -2.929
  508   1HD2  LEU  67          1HD2      LEU  67  -8.990  -0.593  -5.635
  509   2HD2  LEU  67          2HD2      LEU  67  -8.430   0.898  -4.859
  510   3HD2  LEU  67          3HD2      LEU  67  -7.262  -0.187  -5.638
  511    H    GLY  68           H        GLY  68  -8.878  -5.615  -3.238
  512   1HA   GLY  68          2HA       GLY  68  -9.041  -7.688  -4.239
  513   2HA   GLY  68          3HA       GLY  68  -8.870  -6.979  -5.851
  514    H    TYR  69           H        TYR  69  -6.794  -6.591  -2.884
  515    HA   TYR  69           HA       TYR  69  -4.559  -7.990  -4.269
  516   1HB   TYR  69          2HB       TYR  69  -4.891  -5.157  -3.919
  517   2HB   TYR  69          3HB       TYR  69  -3.644  -5.671  -2.806
  518    HD1  TYR  69           HD1      TYR  69  -1.509  -6.564  -3.616
  519    HD2  TYR  69           HD2      TYR  69  -4.716  -5.691  -6.367
  520    HE1  TYR  69           HE1      TYR  69   0.102  -6.475  -5.479
  521    HE2  TYR  69           HE2      TYR  69  -3.098  -5.569  -8.215
  522    HH   TYR  69           HH       TYR  69  -0.851  -5.091  -8.607
  523    H    HIS  70           H        HIS  70  -2.666  -8.150  -2.644
  524    HA   HIS  70           HA       HIS  70  -3.482  -8.245   0.158
  525   1HB   HIS  70          2HB       HIS  70  -4.160 -10.433  -0.848
  526   2HB   HIS  70          3HB       HIS  70  -2.474 -10.734  -1.266
  527    HD1  HIS  70           1HD      HIS  70  -3.168 -12.955   0.346
  528    HD2  HIS  70           2HD      HIS  70  -2.826  -9.202   2.216
  529    HE1  HIS  70           1HE      HIS  70  -2.982 -13.391   2.854
  530    H    VAL  71           H        VAL  71  -1.833  -7.579   1.366
  531    HA   VAL  71           HA       VAL  71   0.862  -7.215   0.202
  532    HB   VAL  71           HB       VAL  71  -0.324  -5.203   0.860
  533   1HG1  VAL  71          1HG1      VAL  71  -0.872  -4.658   3.164
  534   2HG1  VAL  71          2HG1      VAL  71  -1.674  -6.194   2.817
  535   3HG1  VAL  71          3HG1      VAL  71  -0.177  -6.173   3.758
  536   1HG2  VAL  71          1HG2      VAL  71   1.375  -4.216   2.375
  537   2HG2  VAL  71          2HG2      VAL  71   2.053  -5.840   2.604
  538   3HG2  VAL  71          3HG2      VAL  71   2.046  -5.076   0.990
  539    H    VAL  72           H        VAL  72   2.609  -8.197   1.210
  540    HA   VAL  72           HA       VAL  72   1.999 -10.212   3.310
  541    HB   VAL  72           HB       VAL  72   4.432 -10.065   1.649
  542   1HG1  VAL  72          1HG1      VAL  72   3.240 -12.324   3.275
  543   2HG1  VAL  72          2HG1      VAL  72   4.678 -12.450   2.243
  544   3HG1  VAL  72          3HG1      VAL  72   4.706 -11.393   3.657
  545   1HG2  VAL  72          1HG2      VAL  72   1.901 -11.679   1.106
  546   2HG2  VAL  72          2HG2      VAL  72   2.552 -10.389   0.069
  547   3HG2  VAL  72          3HG2      VAL  72   3.439 -11.904   0.248
  548    H    ILE  73           H        ILE  73   2.936 -10.067   5.205
  549    HA   ILE  73           HA       ILE  73   4.233  -7.526   5.942
  550    HB   ILE  73           HB       ILE  73   3.200  -9.714   7.752
  551   1HG1  ILE  73          2HG1      ILE  73   1.311  -8.998   6.454
  552   2HG1  ILE  73          3HG1      ILE  73   1.236  -8.253   8.044
  553   1HG2  ILE  73          1HG2      ILE  73   3.132  -7.815   9.391
  554   2HG2  ILE  73          2HG2      ILE  73   4.769  -8.214   8.870
  555   3HG2  ILE  73          3HG2      ILE  73   3.962  -6.790   8.200
  556   1HD1  ILE  73          1HD1      ILE  73   2.075  -6.111   7.091
  557   2HD1  ILE  73          2HD1      ILE  73   2.087  -6.854   5.471
  558   3HD1  ILE  73          3HD1      ILE  73   0.566  -6.657   6.346
  559    H    GLU  74           H        GLU  74   6.137  -8.258   4.697
  560    HA   GLU  74           HA       GLU  74   7.701 -10.339   5.632
  561   1HB   GLU  74          2HB       GLU  74   7.627  -8.908   3.412
  562   2HB   GLU  74          3HB       GLU  74   9.060  -8.160   4.127
  563   1HG   GLU  74          2HG       GLU  74   8.727 -11.201   3.808
  564   2HG   GLU  74          3HG       GLU  74   9.280 -10.175   2.484
  565    H    GLY  75           H        GLY  75   7.089  -7.720   7.305
  566   1HA   GLY  75          2HA       GLY  75   7.863  -6.850   9.299
  567   2HA   GLY  75          3HA       GLY  75   8.930  -8.257   9.380
  568    H    ARG  76           H        ARG  76   8.630  -5.023   7.760
  569    HA   ARG  76           HA       ARG  76  11.404  -4.365   8.152
  570   1HB   ARG  76          2HB       ARG  76  10.330  -5.654   5.704
  571   2HB   ARG  76          3HB       ARG  76  10.925  -4.041   5.379
  572   1HG   ARG  76          2HG       ARG  76  13.125  -4.569   6.042
  573   2HG   ARG  76          3HG       ARG  76  12.611  -5.956   7.024
  574   1HD   ARG  76          2HD       ARG  76  12.084  -7.279   5.124
  575   2HD   ARG  76          3HD       ARG  76  12.405  -5.948   3.992
  576    HE   ARG  76           HE       ARG  76  14.753  -6.095   5.318
  577   1HH1  ARG  76          2HH2      ARG  76  12.870  -8.756   3.858
  578   2HH1  ARG  76          1HH2      ARG  76  14.251  -9.641   3.352
  579   1HH2  ARG  76          2HH1      ARG  76  16.592  -7.317   4.711
  580   2HH2  ARG  76          1HH1      ARG  76  16.405  -8.828   3.876
  Start of MODEL   19
    1   1H    MET   1          H1        MET   1  -4.217  19.529  16.658
    2   2H    MET   1          H2        MET   1  -5.624  19.147  15.878
    3   3H    MET   1          H3        MET   1  -4.477  17.989  16.144
    4    HA   MET   1           HA       MET   1  -4.425  18.701  13.855
    5   1HB   MET   1          2HB       MET   1  -3.889  21.402  15.159
    6   2HB   MET   1          3HB       MET   1  -3.515  21.038  13.470
    7   1HG   MET   1          2HG       MET   1  -5.845  20.576  12.972
    8   2HG   MET   1          3HG       MET   1  -6.307  20.891  14.656
    9   1HE   MET   1          1HE       MET   1  -8.168  22.545  13.713
   10   2HE   MET   1          2HE       MET   1  -7.795  23.930  12.660
   11   3HE   MET   1          3HE       MET   1  -7.610  22.273  12.041
   12    H    LEU   2           H        LEU   2  -2.892  16.929  14.600
   13    HA   LEU   2           HA       LEU   2  -0.314  17.704  13.814
   14   1HB   LEU   2          2HB       LEU   2   0.998  17.014  15.738
   15   2HB   LEU   2          3HB       LEU   2  -0.014  18.385  16.149
   16    HG   LEU   2           HG       LEU   2  -1.653  16.338  16.983
   17   1HD1  LEU   2          1HD1      LEU   2  -0.284  14.680  18.168
   18   2HD1  LEU   2          2HD1      LEU   2   0.101  14.592  16.446
   19   3HD1  LEU   2          3HD1      LEU   2   1.207  15.417  17.555
   20   1HD2  LEU   2          1HD2      LEU   2  -0.827  16.832  19.250
   21   2HD2  LEU   2          2HD2      LEU   2   0.601  17.632  18.564
   22   3HD2  LEU   2          3HD2      LEU   2  -1.019  18.312  18.295
   23    H    SER   3           H        SER   3   0.520  15.932  12.778
   24    HA   SER   3           HA       SER   3  -0.254  13.213  13.550
   25   1HB   SER   3          2HB       SER   3  -0.549  14.146  10.643
   26   2HB   SER   3          3HB       SER   3  -0.938  12.580  11.340
   27    HG   SER   3           HG       SER   3  -2.831  13.719  11.150
   28    H    GLU   4           H        GLU   4   1.817  12.226  13.679
   29    HA   GLU   4           HA       GLU   4   4.046  13.366  12.124
   30   1HB   GLU   4          2HB       GLU   4   3.764  11.311  14.250
   31   2HB   GLU   4          3HB       GLU   4   5.103  11.239  13.149
   32   1HG   GLU   4          2HG       GLU   4   5.629  13.587  13.753
   33   2HG   GLU   4          3HG       GLU   4   4.433  13.430  15.049
   34    H    GLN   5           H        GLN   5   5.112  11.890  10.702
   35    HA   GLN   5           HA       GLN   5   3.300   9.970   9.286
   36   1HB   GLN   5          2HB       GLN   5   5.593  11.641   8.226
   37   2HB   GLN   5          3HB       GLN   5   4.710  10.395   7.347
   38   1HG   GLN   5          2HG       GLN   5   2.847  12.378   8.435
   39   2HG   GLN   5          3HG       GLN   5   4.127  13.179   7.547
   40   1HE2  GLN   5          1HE2      GLN   5   2.500  10.036   6.997
   41   2HE2  GLN   5          2HE2      GLN   5   2.047  10.350   5.342
   42    H    LYS   6           H        LYS   6   4.290   7.952   8.746
   43    HA   LYS   6           HA       LYS   6   7.199   7.835   9.004
   44   1HB   LYS   6          2HB       LYS   6   5.468   5.679  10.188
   45   2HB   LYS   6          3HB       LYS   6   7.200   5.542   9.950
   46   1HG   LYS   6          2HG       LYS   6   6.177   7.809  11.697
   47   2HG   LYS   6          3HG       LYS   6   6.126   6.163  12.267
   48   1HD   LYS   6          2HD       LYS   6   8.036   7.113  13.136
   49   2HD   LYS   6          3HD       LYS   6   8.539   5.867  12.006
   50   1HE   LYS   6          2HE       LYS   6   8.455   8.814  11.169
   51   2HE   LYS   6          3HE       LYS   6   9.746   8.223  12.207
   52   1HZ   LYS   6          1HZ       LYS   6  10.488   8.101   9.998
   53   2HZ   LYS   6          2HZ       LYS   6  10.259   6.552  10.476
   54   3HZ   LYS   6          3HZ       LYS   6   9.233   7.308   9.447
   55    H    GLU   7           H        GLU   7   8.096   6.416   7.648
   56    HA   GLU   7           HA       GLU   7   6.599   5.424   5.358
   57   1HB   GLU   7          2HB       GLU   7   9.481   4.708   5.731
   58   2HB   GLU   7          3HB       GLU   7   8.595   5.228   4.298
   59   1HG   GLU   7          2HG       GLU   7  10.142   6.923   4.699
   60   2HG   GLU   7          3HG       GLU   7   8.660   7.609   5.378
   61    H    ILE   8           H        ILE   8   6.280   3.223   4.990
   62    HA   ILE   8           HA       ILE   8   7.513   1.261   6.870
   63    HB   ILE   8           HB       ILE   8   5.347  -0.122   6.245
   64   1HG1  ILE   8          2HG1      ILE   8   4.487   1.796   4.801
   65   2HG1  ILE   8          3HG1      ILE   8   3.398   0.839   5.811
   66   1HG2  ILE   8          1HG2      ILE   8   4.362   0.532   8.374
   67   2HG2  ILE   8          2HG2      ILE   8   6.110   0.277   8.473
   68   3HG2  ILE   8          3HG2      ILE   8   5.473   1.929   8.446
   69   1HD1  ILE   8          1HD1      ILE   8   2.967   3.281   6.019
   70   2HD1  ILE   8          2HD1      ILE   8   3.360   2.429   7.536
   71   3HD1  ILE   8          3HD1      ILE   8   4.561   3.463   6.777
   72    H    ALA   9           H        ALA   9   7.696  -0.918   5.825
   73    HA   ALA   9           HA       ALA   9   7.951  -0.858   2.877
   74   1HB   ALA   9          1HB       ALA   9  10.138  -1.952   3.054
   75   2HB   ALA   9          2HB       ALA   9  10.206  -0.366   3.853
   76   3HB   ALA   9          3HB       ALA   9  10.087  -1.843   4.826
   77    H    MET  10           H        MET  10   6.862  -2.683   2.130
   78    HA   MET  10           HA       MET  10   6.700  -5.098   3.865
   79   1HB   MET  10          2HB       MET  10   4.294  -3.693   2.651
   80   2HB   MET  10          3HB       MET  10   4.253  -5.257   3.438
   81   1HG   MET  10          2HG       MET  10   4.695  -4.329   5.572
   82   2HG   MET  10          3HG       MET  10   5.177  -2.765   4.925
   83   1HE   MET  10          1HE       MET  10   2.952  -1.911   2.828
   84   2HE   MET  10          2HE       MET  10   1.981  -0.950   3.957
   85   3HE   MET  10          3HE       MET  10   3.755  -0.911   4.060
   86    H    GLN  11           H        GLN  11   5.569  -6.893   2.509
   87    HA   GLN  11           HA       GLN  11   6.783  -6.874  -0.216
   88   1HB   GLN  11          2HB       GLN  11   6.042  -9.083   1.756
   89   2HB   GLN  11          3HB       GLN  11   6.447  -9.408   0.073
   90   1HG   GLN  11          2HG       GLN  11   8.226  -8.108   2.198
   91   2HG   GLN  11          3HG       GLN  11   8.381  -9.745   1.548
   92   1HE2  GLN  11          1HE2      GLN  11   8.218  -9.617  -1.087
   93   2HE2  GLN  11          2HE2      GLN  11   9.090  -8.284  -1.822
   94    H    VAL  12           H        VAL  12   5.524  -8.109  -1.856
   95    HA   VAL  12           HA       VAL  12   2.627  -7.377  -1.698
   96    HB   VAL  12           HB       VAL  12   4.552  -7.148  -4.054
   97   1HG1  VAL  12          1HG1      VAL  12   2.286  -7.604  -4.848
   98   2HG1  VAL  12          2HG1      VAL  12   1.617  -6.381  -3.739
   99   3HG1  VAL  12          3HG1      VAL  12   2.644  -5.896  -5.101
  100   1HG2  VAL  12          1HG2      VAL  12   5.040  -5.390  -2.413
  101   2HG2  VAL  12          2HG2      VAL  12   4.185  -4.688  -3.787
  102   3HG2  VAL  12          3HG2      VAL  12   3.305  -5.008  -2.280
  103    H    SER  13           H        SER  13   1.157  -8.829  -2.761
  104    HA   SER  13           HA       SER  13   2.137 -10.935  -4.464
  105   1HB   SER  13          2HB       SER  13   0.980 -11.551  -1.712
  106   2HB   SER  13          3HB       SER  13   0.884 -12.711  -3.043
  107    HG   SER  13           HG       SER  13   3.378 -11.570  -2.467
  108    H    GLY  14           H        GLY  14   0.089 -12.259  -5.155
  109   1HA   GLY  14          2HA       GLY  14  -1.997 -12.250  -6.123
  110   2HA   GLY  14          3HA       GLY  14  -2.513 -11.092  -4.882
  111    H    MET  15           H        MET  15  -0.469 -11.274  -7.856
  112    HA   MET  15           HA       MET  15  -1.408  -8.599  -8.696
  113   1HB   MET  15          2HB       MET  15   0.857  -7.823  -9.009
  114   2HB   MET  15          3HB       MET  15   0.649  -8.335  -7.334
  115   1HG   MET  15          2HG       MET  15   2.736  -9.191  -7.856
  116   2HG   MET  15          3HG       MET  15   1.693 -10.589  -8.079
  117   1HE   MET  15          1HE       MET  15   2.576  -7.443 -10.401
  118   2HE   MET  15          2HE       MET  15   4.092  -8.006  -9.657
  119   3HE   MET  15          3HE       MET  15   3.832  -8.204 -11.405
  120    H    THR  16           H        THR  16  -1.187  -8.200 -10.925
  121    HA   THR  16           HA       THR  16  -0.751 -10.523 -12.715
  122    HB   THR  16           HB       THR  16  -1.697  -8.647 -14.309
  123    HG1  THR  16           1HG      THR  16  -2.919  -7.098 -13.082
  124   1HG2  THR  16          1HG2      THR  16  -2.985 -10.638 -13.646
  125   2HG2  THR  16          2HG2      THR  16  -3.440  -9.861 -12.115
  126   3HG2  THR  16          3HG2      THR  16  -4.022  -9.201 -13.661
  127    H    CYS  17           H        CYS  17  -0.117  -6.990 -12.645
  128    HA   CYS  17           HA       CYS  17   2.657  -7.449 -13.617
  129   1HB   CYS  17          2HB       CYS  17   2.360  -5.835 -15.377
  130   2HB   CYS  17          3HB       CYS  17   1.091  -7.056 -15.544
  131    H    ALA  18           H        ALA  18   3.990  -5.535 -13.471
  132    HA   ALA  18           HA       ALA  18   3.738  -4.249 -10.881
  133   1HB   ALA  18          1HB       ALA  18   5.963  -3.369 -11.414
  134   2HB   ALA  18          2HB       ALA  18   5.882  -5.103 -11.790
  135   3HB   ALA  18          3HB       ALA  18   5.800  -3.908 -13.099
  136    H    ALA  19           H        ALA  19   1.549  -3.461 -12.225
  137    HA   ALA  19           HA       ALA  19   1.958  -0.539 -12.532
  138   1HB   ALA  19          1HB       ALA  19   1.996  -1.467 -14.847
  139   2HB   ALA  19          2HB       ALA  19   0.382  -2.160 -14.573
  140   3HB   ALA  19          3HB       ALA  19   0.608  -0.404 -14.537
  141    H    CYS  20           H        CYS  20  -0.524  -3.220 -12.521
  142    HA   CYS  20           HA       CYS  20  -2.452  -1.657 -11.150
  143   1HB   CYS  20          2HB       CYS  20  -1.948  -4.673 -10.839
  144   2HB   CYS  20          3HB       CYS  20  -3.456  -3.801 -10.495
  145    H    ALA  21           H        ALA  21   0.339  -3.501 -10.037
  146    HA   ALA  21           HA       ALA  21   0.165  -3.232  -7.272
  147   1HB   ALA  21          1HB       ALA  21   1.897  -4.466  -8.619
  148   2HB   ALA  21          2HB       ALA  21   2.672  -2.901  -8.962
  149   3HB   ALA  21          3HB       ALA  21   2.552  -3.506  -7.293
  150    H    ALA  22           H        ALA  22   0.778  -0.670  -9.671
  151    HA   ALA  22           HA       ALA  22   1.585   1.316  -7.660
  152   1HB   ALA  22          1HB       ALA  22   0.661   1.737 -10.531
  153   2HB   ALA  22          2HB       ALA  22   1.545   2.863  -9.489
  154   3HB   ALA  22          3HB       ALA  22   2.345   1.389 -10.073
  155    H    ARG  23           H        ARG  23  -1.209   0.503  -9.725
  156    HA   ARG  23           HA       ARG  23  -2.912   2.605  -9.035
  157   1HB   ARG  23          2HB       ARG  23  -3.604  -0.278  -9.706
  158   2HB   ARG  23          3HB       ARG  23  -4.800   0.993  -9.581
  159   1HG   ARG  23          2HG       ARG  23  -2.410   1.249 -11.457
  160   2HG   ARG  23          3HG       ARG  23  -3.870   0.385 -11.926
  161   1HD   ARG  23          2HD       ARG  23  -3.803   3.297 -11.000
  162   2HD   ARG  23          3HD       ARG  23  -3.836   2.805 -12.678
  163    HE   ARG  23           HE       ARG  23  -6.035   2.864 -10.771
  164   1HH1  ARG  23          2HH2      ARG  23  -4.906   1.280 -13.706
  165   2HH1  ARG  23          1HH2      ARG  23  -6.484   0.881 -14.307
  166   1HH2  ARG  23          2HH1      ARG  23  -8.161   2.312 -11.501
  167   2HH2  ARG  23          1HH1      ARG  23  -8.378   1.473 -13.002
  168    H    ILE  24           H        ILE  24  -2.574  -0.548  -7.317
  169    HA   ILE  24           HA       ILE  24  -4.556   0.015  -5.402
  170    HB   ILE  24           HB       ILE  24  -3.619  -1.638  -3.957
  171   1HG1  ILE  24          2HG1      ILE  24  -1.236  -1.286  -5.738
  172   2HG1  ILE  24          3HG1      ILE  24  -1.333  -1.172  -3.970
  173   1HG2  ILE  24          1HG2      ILE  24  -4.864  -2.171  -6.152
  174   2HG2  ILE  24          2HG2      ILE  24  -3.284  -2.634  -6.805
  175   3HG2  ILE  24          3HG2      ILE  24  -3.943  -3.455  -5.375
  176   1HD1  ILE  24          1HD1      ILE  24  -1.680  -3.621  -3.843
  177   2HD1  ILE  24          2HD1      ILE  24  -1.470  -3.695  -5.616
  178   3HD1  ILE  24          3HD1      ILE  24  -0.128  -3.178  -4.594
  179    H    GLU  25           H        GLU  25  -1.032   0.760  -5.070
  180    HA   GLU  25           HA       GLU  25  -1.266   2.082  -2.587
  181   1HB   GLU  25          2HB       GLU  25   0.760   1.931  -4.781
  182   2HB   GLU  25          3HB       GLU  25   0.858   3.350  -3.731
  183   1HG   GLU  25          2HG       GLU  25   2.263   1.518  -2.898
  184   2HG   GLU  25          3HG       GLU  25   1.007   1.945  -1.731
  185    H    LYS  26           H        LYS  26  -1.717   3.302  -5.881
  186    HA   LYS  26           HA       LYS  26  -1.722   6.103  -5.031
  187   1HB   LYS  26          2HB       LYS  26  -2.418   4.756  -7.643
  188   2HB   LYS  26          3HB       LYS  26  -2.919   6.414  -7.312
  189   1HG   LYS  26          2HG       LYS  26  -0.923   6.669  -8.428
  190   2HG   LYS  26          3HG       LYS  26  -0.522   7.013  -6.739
  191   1HD   LYS  26          2HD       LYS  26   0.480   4.832  -6.440
  192   2HD   LYS  26          3HD       LYS  26  -0.108   4.309  -8.016
  193   1HE   LYS  26          2HE       LYS  26   1.922   6.554  -7.589
  194   2HE   LYS  26          3HE       LYS  26   2.349   4.879  -7.956
  195   1HZ   LYS  26          1HZ       LYS  26   0.794   6.658  -9.715
  196   2HZ   LYS  26          2HZ       LYS  26   2.350   6.188  -9.931
  197   3HZ   LYS  26          3HZ       LYS  26   1.142   5.081 -10.031
  198    H    GLY  27           H        GLY  27  -4.246   3.674  -5.775
  199   1HA   GLY  27          2HA       GLY  27  -6.537   5.288  -5.190
  200   2HA   GLY  27          3HA       GLY  27  -6.408   3.521  -5.034
  201    H    LEU  28           H        LEU  28  -4.393   3.221  -3.202
  202    HA   LEU  28           HA       LEU  28  -5.851   3.421  -0.811
  203   1HB   LEU  28          2HB       LEU  28  -4.290   1.673  -1.251
  204   2HB   LEU  28          3HB       LEU  28  -2.933   2.793  -1.309
  205    HG   LEU  28           HG       LEU  28  -3.220   1.307   0.737
  206   1HD1  LEU  28          1HD1      LEU  28  -2.989   4.281   1.226
  207   2HD1  LEU  28          2HD1      LEU  28  -2.302   3.018   2.230
  208   3HD1  LEU  28          3HD1      LEU  28  -1.683   3.260   0.594
  209   1HD2  LEU  28          1HD2      LEU  28  -5.409   3.318   1.457
  210   2HD2  LEU  28          2HD2      LEU  28  -5.601   1.593   1.109
  211   3HD2  LEU  28          3HD2      LEU  28  -4.696   2.144   2.530
  212    H    LYS  29           H        LYS  29  -3.174   5.499  -2.038
  213    HA   LYS  29           HA       LYS  29  -2.812   7.223   0.066
  214   1HB   LYS  29          2HB       LYS  29  -1.730   7.431  -2.192
  215   2HB   LYS  29          3HB       LYS  29  -3.224   8.181  -2.782
  216   1HG   LYS  29          2HG       LYS  29  -2.899   9.876  -0.783
  217   2HG   LYS  29          3HG       LYS  29  -1.288   9.220  -0.666
  218   1HD   LYS  29          2HD       LYS  29  -2.545  10.517  -3.151
  219   2HD   LYS  29          3HD       LYS  29  -1.606  11.364  -1.911
  220   1HE   LYS  29          2HE       LYS  29   0.126   9.336  -2.527
  221   2HE   LYS  29          3HE       LYS  29  -0.642   9.520  -4.084
  222   1HZ   LYS  29          1HZ       LYS  29   1.393  10.834  -3.560
  223   2HZ   LYS  29          2HZ       LYS  29   0.154  11.790  -4.141
  224   3HZ   LYS  29          3HZ       LYS  29   0.630  11.742  -2.539
  225    H    ARG  30           H        ARG  30  -5.807   7.000  -1.858
  226    HA   ARG  30           HA       ARG  30  -6.719   9.605  -1.129
  227   1HB   ARG  30          2HB       ARG  30  -7.333   8.082  -3.107
  228   2HB   ARG  30          3HB       ARG  30  -8.501   7.323  -2.017
  229   1HG   ARG  30          2HG       ARG  30  -9.646   9.465  -1.714
  230   2HG   ARG  30          3HG       ARG  30  -8.374  10.326  -2.591
  231   1HD   ARG  30          2HD       ARG  30 -10.142   8.149  -3.788
  232   2HD   ARG  30          3HD       ARG  30 -10.493   9.860  -3.945
  233    HE   ARG  30           HE       ARG  30  -8.495   8.277  -5.371
  234   1HH1  ARG  30          2HH2      ARG  30  -9.240  11.549  -4.324
  235   2HH1  ARG  30          1HH2      ARG  30  -8.476  12.345  -5.664
  236   1HH2  ARG  30          2HH1      ARG  30  -7.448   9.284  -7.178
  237   2HH2  ARG  30          1HH1      ARG  30  -7.410  11.009  -7.314
  238    H    MET  31           H        MET  31  -6.430   6.885   0.919
  239    HA   MET  31           HA       MET  31  -8.823   7.480   2.523
  240   1HB   MET  31          2HB       MET  31  -6.760   5.314   2.311
  241   2HB   MET  31          3HB       MET  31  -7.368   5.621   3.923
  242   1HG   MET  31          2HG       MET  31  -8.626   3.904   2.704
  243   2HG   MET  31          3HG       MET  31  -9.607   5.218   3.312
  244   1HE   MET  31          1HE       MET  31  -7.585   5.369  -0.203
  245   2HE   MET  31          2HE       MET  31  -7.973   3.677   0.115
  246   3HE   MET  31          3HE       MET  31  -8.797   4.558  -1.196
  247    HA   PRO  32           HA       PRO  32  -7.029  10.247   5.305
  248   1HB   PRO  32          2HB       PRO  32  -7.903   9.478   7.815
  249   2HB   PRO  32          3HB       PRO  32  -8.946  10.206   6.563
  250   1HG   PRO  32          2HG       PRO  32  -8.552   7.262   7.162
  251   2HG   PRO  32          3HG       PRO  32 -10.103   8.142   6.990
  252   1HD   PRO  32          2HD       PRO  32  -9.082   6.751   4.939
  253   2HD   PRO  32          3HD       PRO  32  -9.796   8.358   4.623
  254    H    GLY  33           H        GLY  33  -5.413  10.634   6.921
  255   1HA   GLY  33          2HA       GLY  33  -3.433  10.319   7.953
  256   2HA   GLY  33          3HA       GLY  33  -3.788   8.595   8.076
  257    H    VAL  34           H        VAL  34  -4.033   8.153   5.131
  258    HA   VAL  34           HA       VAL  34  -1.200   7.888   4.587
  259    HB   VAL  34           HB       VAL  34  -3.477   7.496   2.651
  260   1HG1  VAL  34          1HG1      VAL  34  -1.734   5.935   1.625
  261   2HG1  VAL  34          2HG1      VAL  34  -1.145   7.589   1.704
  262   3HG1  VAL  34          3HG1      VAL  34  -0.604   6.394   2.890
  263   1HG2  VAL  34          1HG2      VAL  34  -3.362   5.075   3.318
  264   2HG2  VAL  34          2HG2      VAL  34  -2.326   5.534   4.683
  265   3HG2  VAL  34          3HG2      VAL  34  -4.000   6.113   4.582
  266    H    THR  35           H        THR  35   0.099   9.265   3.506
  267    HA   THR  35           HA       THR  35  -1.184  11.609   2.141
  268    HB   THR  35           HB       THR  35   0.779  11.497   4.301
  269    HG1  THR  35           1HG      THR  35  -0.251  13.286   4.812
  270   1HG2  THR  35          1HG2      THR  35   2.404  12.136   2.719
  271   2HG2  THR  35          2HG2      THR  35   1.278  13.241   1.863
  272   3HG2  THR  35          3HG2      THR  35   1.849  13.635   3.490
  273    H    ASP  36           H        ASP  36   1.621   9.254   2.070
  274    HA   ASP  36           HA       ASP  36   1.193   9.369  -0.732
  275   1HB   ASP  36          2HB       ASP  36   3.438  10.911   0.205
  276   2HB   ASP  36          3HB       ASP  36   4.065   9.472  -0.618
  277    H    ALA  37           H        ALA  37   2.550   7.829  -1.926
  278    HA   ALA  37           HA       ALA  37   3.053   5.364  -0.459
  279   1HB   ALA  37          1HB       ALA  37   0.548   5.502  -0.402
  280   2HB   ALA  37          2HB       ALA  37   0.536   5.581  -2.177
  281   3HB   ALA  37          3HB       ALA  37   1.130   4.124  -1.349
  282    H    ASN  38           H        ASN  38   4.143   3.804  -1.725
  283    HA   ASN  38           HA       ASN  38   4.746   4.542  -4.524
  284   1HB   ASN  38          2HB       ASN  38   7.291   4.331  -3.313
  285   2HB   ASN  38          3HB       ASN  38   6.547   5.738  -4.044
  286   1HD2  ASN  38          1HD2      ASN  38   6.010   4.102  -0.850
  287   2HD2  ASN  38          2HD2      ASN  38   6.386   5.556   0.076
  288    H    VAL  39           H        VAL  39   4.357   2.530  -5.341
  289    HA   VAL  39           HA       VAL  39   5.185   0.198  -3.817
  290    HB   VAL  39           HB       VAL  39   3.159   0.333  -5.318
  291   1HG1  VAL  39          1HG1      VAL  39   5.171  -0.231  -7.550
  292   2HG1  VAL  39          2HG1      VAL  39   3.423  -0.242  -7.667
  293   3HG1  VAL  39          3HG1      VAL  39   4.261   1.288  -7.356
  294   1HG2  VAL  39          1HG2      VAL  39   3.940  -1.702  -4.297
  295   2HG2  VAL  39          2HG2      VAL  39   3.414  -2.034  -5.942
  296   3HG2  VAL  39          3HG2      VAL  39   5.155  -1.941  -5.569
  297    H    ASN  40           H        ASN  40   7.227  -0.726  -3.924
  298    HA   ASN  40           HA       ASN  40   9.161   0.368  -5.933
  299   1HB   ASN  40          2HB       ASN  40   9.640   0.887  -3.549
  300   2HB   ASN  40          3HB       ASN  40   9.682  -0.843  -3.195
  301   1HD2  ASN  40          1HD2      ASN  40  11.922   0.230  -2.479
  302   2HD2  ASN  40          2HD2      ASN  40  13.197   0.083  -3.679
  303    H    LEU  41           H        LEU  41   7.489  -1.253  -6.980
  304    HA   LEU  41           HA       LEU  41   7.811  -4.014  -6.461
  305   1HB   LEU  41          2HB       LEU  41   5.946  -2.523  -7.706
  306   2HB   LEU  41          3HB       LEU  41   6.822  -3.042  -9.133
  307    HG   LEU  41           HG       LEU  41   4.846  -4.379  -8.627
  308   1HD1  LEU  41          1HD1      LEU  41   5.766  -6.577  -8.907
  309   2HD1  LEU  41          2HD1      LEU  41   6.900  -5.458  -9.689
  310   3HD1  LEU  41          3HD1      LEU  41   7.266  -6.140  -8.092
  311   1HD2  LEU  41          1HD2      LEU  41   4.786  -4.172  -6.178
  312   2HD2  LEU  41          2HD2      LEU  41   4.586  -5.832  -6.749
  313   3HD2  LEU  41          3HD2      LEU  41   6.121  -5.331  -6.038
  314    H    ALA  42           H        ALA  42   9.663  -1.768  -8.323
  315    HA   ALA  42           HA       ALA  42  11.204  -3.304 -10.053
  316   1HB   ALA  42          1HB       ALA  42  11.484  -0.866  -9.689
  317   2HB   ALA  42          2HB       ALA  42  12.147  -1.198  -8.065
  318   3HB   ALA  42          3HB       ALA  42  13.023  -1.742  -9.507
  319    H    THR  43           H        THR  43  11.277  -3.251  -6.459
  320    HA   THR  43           HA       THR  43  13.042  -5.641  -6.595
  321    HB   THR  43           HB       THR  43  14.304  -3.685  -5.920
  322    HG1  THR  43           1HG      THR  43  15.222  -4.732  -4.095
  323   1HG2  THR  43          1HG2      THR  43  12.460  -2.565  -4.571
  324   2HG2  THR  43          2HG2      THR  43  12.795  -3.727  -3.276
  325   3HG2  THR  43          3HG2      THR  43  14.056  -2.603  -3.802
  326    H    GLU  44           H        GLU  44  10.298  -5.652  -6.822
  327    HA   GLU  44           HA       GLU  44   8.308  -6.267  -5.914
  328   1HB   GLU  44          2HB       GLU  44  10.255  -8.385  -4.932
  329   2HB   GLU  44          3HB       GLU  44   8.493  -8.560  -4.967
  330   1HG   GLU  44          2HG       GLU  44   8.522  -8.046  -7.440
  331   2HG   GLU  44          3HG       GLU  44  10.291  -8.149  -7.382
  332    H    THR  45           H        THR  45   9.083  -4.169  -4.339
  333    HA   THR  45           HA       THR  45   8.210  -4.977  -1.594
  334    HB   THR  45           HB       THR  45  10.290  -2.960  -2.558
  335    HG1  THR  45           1HG      THR  45  10.954  -5.163  -2.407
  336   1HG2  THR  45          1HG2      THR  45  10.726  -2.571  -0.138
  337   2HG2  THR  45          2HG2      THR  45   9.145  -1.963  -0.653
  338   3HG2  THR  45          3HG2      THR  45   9.261  -3.498   0.252
  339    H    VAL  46           H        VAL  46   6.874  -3.340  -0.539
  340    HA   VAL  46           HA       VAL  46   5.936  -1.101  -2.271
  341    HB   VAL  46           HB       VAL  46   4.090  -2.606  -2.226
  342   1HG1  VAL  46          1HG1      VAL  46   4.660  -4.081  -0.348
  343   2HG1  VAL  46          2HG1      VAL  46   4.434  -2.722   0.778
  344   3HG1  VAL  46          3HG1      VAL  46   3.050  -3.399  -0.100
  345   1HG2  VAL  46          1HG2      VAL  46   3.561  -0.218  -1.847
  346   2HG2  VAL  46          2HG2      VAL  46   2.391  -1.313  -1.075
  347   3HG2  VAL  46          3HG2      VAL  46   3.597  -0.489  -0.089
  348    H    ASN  47           H        ASN  47   5.827   0.948  -1.239
  349    HA   ASN  47           HA       ASN  47   6.555   0.974   1.625
  350   1HB   ASN  47          2HB       ASN  47   7.671   2.649  -0.676
  351   2HB   ASN  47          3HB       ASN  47   7.737   3.182   1.006
  352   1HD2  ASN  47          1HD2      ASN  47   8.743   1.569   2.588
  353   2HD2  ASN  47          2HD2      ASN  47  10.253   0.875   2.014
  354    H    VAL  48           H        VAL  48   5.351   2.615   2.822
  355    HA   VAL  48           HA       VAL  48   3.368   4.111   1.256
  356    HB   VAL  48           HB       VAL  48   2.583   2.430   3.665
  357   1HG1  VAL  48          1HG1      VAL  48   1.287   4.501   3.334
  358   2HG1  VAL  48          2HG1      VAL  48   0.981   4.053   1.643
  359   3HG1  VAL  48          3HG1      VAL  48   0.306   3.073   2.956
  360   1HG2  VAL  48          1HG2      VAL  48   2.991   0.862   1.839
  361   2HG2  VAL  48          2HG2      VAL  48   1.251   1.072   2.048
  362   3HG2  VAL  48          3HG2      VAL  48   2.079   1.890   0.707
  363    H    ILE  49           H        ILE  49   3.145   6.114   2.138
  364    HA   ILE  49           HA       ILE  49   4.743   6.711   4.535
  365    HB   ILE  49           HB       ILE  49   3.988   8.657   2.301
  366   1HG1  ILE  49          2HG1      ILE  49   5.325   7.007   1.201
  367   2HG1  ILE  49          3HG1      ILE  49   6.221   8.506   1.405
  368   1HG2  ILE  49          1HG2      ILE  49   5.998   8.804   4.579
  369   2HG2  ILE  49          2HG2      ILE  49   5.844   9.995   3.269
  370   3HG2  ILE  49          3HG2      ILE  49   4.506   9.737   4.395
  371   1HD1  ILE  49          1HD1      ILE  49   7.417   7.529   3.358
  372   2HD1  ILE  49          2HD1      ILE  49   6.557   5.997   3.096
  373   3HD1  ILE  49          3HD1      ILE  49   7.675   6.604   1.865
  374    H    TYR  50           H        TYR  50   3.113   6.582   6.117
  375    HA   TYR  50           HA       TYR  50   0.688   8.245   5.703
  376   1HB   TYR  50          2HB       TYR  50  -0.791   6.566   6.606
  377   2HB   TYR  50          3HB       TYR  50  -0.034   6.049   5.113
  378    HD1  TYR  50           HD1      TYR  50   1.020   5.682   8.774
  379    HD2  TYR  50           HD2      TYR  50  -0.218   3.773   5.113
  380    HE1  TYR  50           HE1      TYR  50   1.373   3.485   9.796
  381    HE2  TYR  50           HE2      TYR  50   0.102   1.568   6.164
  382    HH   TYR  50           HH       TYR  50   0.669   0.447   8.066
  383    H    ASP  51           H        ASP  51  -0.515   8.554   7.668
  384    HA   ASP  51           HA       ASP  51   1.371   9.189   9.831
  385   1HB   ASP  51          2HB       ASP  51  -1.577   9.832   9.696
  386   2HB   ASP  51          3HB       ASP  51  -0.320  10.452  10.805
  387    HA   PRO  52           HA       PRO  52  -0.086   5.243  11.580
  388   1HB   PRO  52          2HB       PRO  52   1.779   4.822  13.506
  389   2HB   PRO  52          3HB       PRO  52   2.087   4.573  11.770
  390   1HG   PRO  52          2HG       PRO  52   2.708   7.061  13.403
  391   2HG   PRO  52          3HG       PRO  52   3.822   6.142  12.345
  392   1HD   PRO  52          2HD       PRO  52   2.555   8.342  11.457
  393   2HD   PRO  52          3HD       PRO  52   2.741   6.920  10.389
  394    H    ALA  53           H        ALA  53  -0.520   8.345  12.704
  395    HA   ALA  53           HA       ALA  53  -1.535   7.659  15.383
  396   1HB   ALA  53          1HB       ALA  53  -1.502  10.235  13.751
  397   2HB   ALA  53          2HB       ALA  53  -2.070  10.063  15.427
  398   3HB   ALA  53          3HB       ALA  53  -0.353   9.812  15.043
  399    H    GLU  54           H        GLU  54  -2.421   7.992  11.980
  400    HA   GLU  54           HA       GLU  54  -5.284   8.031  12.688
  401   1HB   GLU  54          2HB       GLU  54  -3.809   9.847  11.064
  402   2HB   GLU  54          3HB       GLU  54  -4.780   8.865   9.958
  403   1HG   GLU  54          2HG       GLU  54  -6.816   9.399  11.208
  404   2HG   GLU  54          3HG       GLU  54  -5.867  10.392  12.335
  405    H    THR  55           H        THR  55  -3.052   6.997  10.067
  406    HA   THR  55           HA       THR  55  -4.538   4.508   9.847
  407    HB   THR  55           HB       THR  55  -2.901   4.267   7.640
  408    HG1  THR  55           1HG      THR  55  -4.020   6.642   7.283
  409   1HG2  THR  55          1HG2      THR  55  -4.997   4.806   6.507
  410   2HG2  THR  55          2HG2      THR  55  -5.305   3.745   7.917
  411   3HG2  THR  55          3HG2      THR  55  -5.671   5.502   8.007
  412    H    GLY  56           H        GLY  56  -2.507   2.861   8.890
  413   1HA   GLY  56          2HA       GLY  56  -0.632   2.022  10.687
  414   2HA   GLY  56          3HA       GLY  56  -2.234   1.703  11.408
  415    H    THR  57           H        THR  57  -2.396  -0.523  10.911
  416    HA   THR  57           HA       THR  57  -1.665  -1.626   8.295
  417    HB   THR  57           HB       THR  57  -2.412  -3.730   9.587
  418    HG1  THR  57           1HG      THR  57  -2.537  -3.347  11.865
  419   1HG2  THR  57          1HG2      THR  57  -0.318  -3.754  10.943
  420   2HG2  THR  57          2HG2      THR  57  -0.020  -3.048   9.345
  421   3HG2  THR  57          3HG2      THR  57  -0.163  -1.994  10.766
  422    H    ALA  58           H        ALA  58  -4.383  -0.855  10.374
  423    HA   ALA  58           HA       ALA  58  -6.323  -2.392   9.362
  424   1HB   ALA  58          1HB       ALA  58  -6.674   0.419  10.456
  425   2HB   ALA  58          2HB       ALA  58  -7.947  -0.819  10.345
  426   3HB   ALA  58          3HB       ALA  58  -6.550  -1.075  11.408
  427    H    ALA  59           H        ALA  59  -5.927   0.949   8.292
  428    HA   ALA  59           HA       ALA  59  -8.310   0.621   6.594
  429   1HB   ALA  59          1HB       ALA  59  -6.275   2.815   6.210
  430   2HB   ALA  59          2HB       ALA  59  -7.987   2.814   5.780
  431   3HB   ALA  59          3HB       ALA  59  -7.527   2.867   7.495
  432    H    ILE  60           H        ILE  60  -4.853   0.484   6.178
  433    HA   ILE  60           HA       ILE  60  -4.698   0.144   3.369
  434    HB   ILE  60           HB       ILE  60  -2.913  -0.491   5.741
  435   1HG1  ILE  60          2HG1      ILE  60  -1.428   1.024   4.362
  436   2HG1  ILE  60          3HG1      ILE  60  -2.737   1.096   3.175
  437   1HG2  ILE  60          1HG2      ILE  60  -2.365  -1.341   2.862
  438   2HG2  ILE  60          2HG2      ILE  60  -1.172  -1.307   4.175
  439   3HG2  ILE  60          3HG2      ILE  60  -2.526  -2.431   4.259
  440   1HD1  ILE  60          1HD1      ILE  60  -2.994   2.038   6.078
  441   2HD1  ILE  60          2HD1      ILE  60  -2.511   3.095   4.745
  442   3HD1  ILE  60          3HD1      ILE  60  -4.122   2.391   4.749
  443    H    GLN  61           H        GLN  61  -4.944  -2.367   5.961
  444    HA   GLN  61           HA       GLN  61  -4.933  -4.493   4.049
  445   1HB   GLN  61          2HB       GLN  61  -5.338  -4.204   6.926
  446   2HB   GLN  61          3HB       GLN  61  -6.485  -5.329   6.205
  447   1HG   GLN  61          2HG       GLN  61  -4.638  -6.617   6.906
  448   2HG   GLN  61          3HG       GLN  61  -4.678  -6.607   5.143
  449   1HE2  GLN  61          1HE2      GLN  61  -3.417  -3.616   6.625
  450   2HE2  GLN  61          2HE2      GLN  61  -1.740  -4.044   6.345
  451    H    GLU  62           H        GLU  62  -7.634  -2.737   5.670
  452    HA   GLU  62           HA       GLU  62  -9.817  -4.012   4.517
  453   1HB   GLU  62          2HB       GLU  62  -9.254  -1.268   5.582
  454   2HB   GLU  62          3HB       GLU  62 -10.651  -1.391   4.524
  455   1HG   GLU  62          2HG       GLU  62 -11.376  -1.683   6.796
  456   2HG   GLU  62          3HG       GLU  62 -11.575  -3.218   5.944
  457    H    LYS  63           H        LYS  63  -8.046  -1.181   3.095
  458    HA   LYS  63           HA       LYS  63  -9.627  -1.305   0.744
  459   1HB   LYS  63          2HB       LYS  63  -7.163   0.130   1.699
  460   2HB   LYS  63          3HB       LYS  63  -7.638   0.269   0.031
  461   1HG   LYS  63          2HG       LYS  63  -9.559   0.876   2.316
  462   2HG   LYS  63          3HG       LYS  63  -8.400   2.032   1.666
  463   1HD   LYS  63          2HD       LYS  63 -10.558   2.469   0.732
  464   2HD   LYS  63          3HD       LYS  63  -9.421   1.994  -0.541
  465   1HE   LYS  63          2HE       LYS  63 -10.487  -0.136  -0.825
  466   2HE   LYS  63          3HE       LYS  63 -11.446   0.067   0.671
  467   1HZ   LYS  63          1HZ       LYS  63 -12.720   0.462  -1.306
  468   2HZ   LYS  63          2HZ       LYS  63 -12.619   1.841  -0.418
  469   3HZ   LYS  63          3HZ       LYS  63 -11.714   1.667  -1.785
  470    H    ILE  64           H        ILE  64  -6.432  -2.643   1.567
  471    HA   ILE  64           HA       ILE  64  -5.344  -3.283  -0.891
  472    HB   ILE  64           HB       ILE  64  -5.259  -4.238   1.904
  473   1HG1  ILE  64          2HG1      ILE  64  -3.951  -2.278   1.037
  474   2HG1  ILE  64          3HG1      ILE  64  -3.034  -3.580   1.797
  475   1HG2  ILE  64          1HG2      ILE  64  -3.555  -5.926   1.336
  476   2HG2  ILE  64          2HG2      ILE  64  -5.243  -6.349   1.037
  477   3HG2  ILE  64          3HG2      ILE  64  -4.199  -5.894  -0.332
  478   1HD1  ILE  64          1HD1      ILE  64  -2.554  -4.452  -0.532
  479   2HD1  ILE  64          2HD1      ILE  64  -3.226  -2.932  -1.150
  480   3HD1  ILE  64          3HD1      ILE  64  -1.813  -2.902  -0.072
  481    H    GLU  65           H        GLU  65  -7.509  -5.150   1.321
  482    HA   GLU  65           HA       GLU  65  -8.200  -7.311  -0.351
  483   1HB   GLU  65          2HB       GLU  65  -9.585  -5.818   1.897
  484   2HB   GLU  65          3HB       GLU  65 -10.465  -6.981   0.888
  485   1HG   GLU  65          2HG       GLU  65  -8.137  -8.355   1.694
  486   2HG   GLU  65          3HG       GLU  65  -8.707  -7.489   3.125
  487    H    LYS  66           H        LYS  66 -10.102  -4.248   0.086
  488    HA   LYS  66           HA       LYS  66 -12.034  -5.054  -1.872
  489   1HB   LYS  66          2HB       LYS  66 -11.437  -2.493  -0.410
  490   2HB   LYS  66          3HB       LYS  66 -12.425  -2.427  -1.863
  491   1HG   LYS  66          2HG       LYS  66 -13.942  -2.553  -0.136
  492   2HG   LYS  66          3HG       LYS  66 -13.997  -4.135  -0.893
  493   1HD   LYS  66          2HD       LYS  66 -12.317  -3.586   1.580
  494   2HD   LYS  66          3HD       LYS  66 -14.048  -3.848   1.724
  495   1HE   LYS  66          2HE       LYS  66 -13.956  -6.085   0.922
  496   2HE   LYS  66          3HE       LYS  66 -12.319  -5.899   0.321
  497   1HZ   LYS  66          1HZ       LYS  66 -13.112  -6.000   3.166
  498   2HZ   LYS  66          2HZ       LYS  66 -12.225  -7.109   2.350
  499   3HZ   LYS  66          3HZ       LYS  66 -11.590  -5.655   2.644
  500    H    LEU  67           H        LEU  67  -8.982  -3.413  -2.274
  501    HA   LEU  67           HA       LEU  67  -9.342  -2.602  -5.035
  502   1HB   LEU  67          2HB       LEU  67  -6.934  -2.957  -3.240
  503   2HB   LEU  67          3HB       LEU  67  -6.818  -2.407  -4.908
  504    HG   LEU  67           HG       LEU  67  -8.621  -0.953  -2.935
  505   1HD1  LEU  67          1HD1      LEU  67  -5.675  -0.440  -3.465
  506   2HD1  LEU  67          2HD1      LEU  67  -6.753   0.592  -2.503
  507   3HD1  LEU  67          3HD1      LEU  67  -6.354  -1.046  -1.951
  508   1HD2  LEU  67          1HD2      LEU  67  -8.915  -0.402  -5.337
  509   2HD2  LEU  67          2HD2      LEU  67  -8.193   0.951  -4.455
  510   3HD2  LEU  67          3HD2      LEU  67  -7.175  -0.079  -5.478
  511    H    GLY  68           H        GLY  68  -8.688  -5.619  -3.405
  512   1HA   GLY  68          2HA       GLY  68  -8.775  -7.702  -4.345
  513   2HA   GLY  68          3HA       GLY  68  -8.572  -7.031  -5.967
  514    H    TYR  69           H        TYR  69  -6.505  -6.529  -3.028
  515    HA   TYR  69           HA       TYR  69  -4.296  -8.083  -4.313
  516   1HB   TYR  69          2HB       TYR  69  -4.475  -5.209  -3.722
  517   2HB   TYR  69          3HB       TYR  69  -3.174  -5.953  -2.822
  518    HD1  TYR  69           HD1      TYR  69  -1.132  -6.563  -3.882
  519    HD2  TYR  69           HD2      TYR  69  -4.633  -5.752  -6.262
  520    HE1  TYR  69           HE1      TYR  69   0.268  -6.388  -5.894
  521    HE2  TYR  69           HE2      TYR  69  -3.252  -5.593  -8.265
  522    HH   TYR  69           HH       TYR  69  -1.086  -5.622  -9.119
  523    H    HIS  70           H        HIS  70  -2.508  -8.437  -2.605
  524    HA   HIS  70           HA       HIS  70  -3.365  -8.132   0.135
  525   1HB   HIS  70          2HB       HIS  70  -4.308 -10.375  -0.542
  526   2HB   HIS  70          3HB       HIS  70  -2.654 -10.926  -0.824
  527    HD1  HIS  70           1HD      HIS  70  -2.663 -12.687   1.157
  528    HD2  HIS  70           2HD      HIS  70  -3.846  -8.803   2.263
  529    HE1  HIS  70           1HE      HIS  70  -2.917 -12.684   3.698
  530    H    VAL  71           H        VAL  71  -1.616  -7.434   1.288
  531    HA   VAL  71           HA       VAL  71   1.040  -7.551   0.062
  532    HB   VAL  71           HB       VAL  71   1.640  -6.180   2.019
  533   1HG1  VAL  71          1HG1      VAL  71  -0.750  -5.138   0.492
  534   2HG1  VAL  71          2HG1      VAL  71   0.462  -4.145   1.319
  535   3HG1  VAL  71          3HG1      VAL  71   0.927  -5.125  -0.088
  536   1HG2  VAL  71          1HG2      VAL  71  -1.308  -6.141   2.769
  537   2HG2  VAL  71          2HG2      VAL  71  -0.031  -6.989   3.668
  538   3HG2  VAL  71          3HG2      VAL  71   0.007  -5.227   3.515
  539    H    VAL  72           H        VAL  72   2.867  -8.120   1.611
  540    HA   VAL  72           HA       VAL  72   2.221 -10.436   3.354
  541    HB   VAL  72           HB       VAL  72   4.453 -10.457   1.379
  542   1HG1  VAL  72          1HG1      VAL  72   3.234 -12.654   3.106
  543   2HG1  VAL  72          2HG1      VAL  72   4.584 -12.850   1.969
  544   3HG1  VAL  72          3HG1      VAL  72   4.791 -11.859   3.415
  545   1HG2  VAL  72          1HG2      VAL  72   1.719 -11.771   1.188
  546   2HG2  VAL  72          2HG2      VAL  72   2.430 -10.597   0.055
  547   3HG2  VAL  72          3HG2      VAL  72   3.117 -12.219   0.192
  548    H    ILE  73           H        ILE  73   3.642 -10.637   5.101
  549    HA   ILE  73           HA       ILE  73   5.262  -8.190   5.704
  550    HB   ILE  73           HB       ILE  73   3.538  -9.748   7.616
  551   1HG1  ILE  73          2HG1      ILE  73   2.079  -8.603   6.007
  552   2HG1  ILE  73          3HG1      ILE  73   2.041  -7.898   7.610
  553   1HG2  ILE  73          1HG2      ILE  73   5.417  -8.658   8.727
  554   2HG2  ILE  73          2HG2      ILE  73   5.140  -7.159   7.835
  555   3HG2  ILE  73          3HG2      ILE  73   3.958  -7.713   9.044
  556   1HD1  ILE  73          1HD1      ILE  73   1.974  -6.186   5.855
  557   2HD1  ILE  73          2HD1      ILE  73   3.378  -5.990   6.913
  558   3HD1  ILE  73          3HD1      ILE  73   3.571  -6.684   5.287
  559    H    GLU  74           H        GLU  74   7.032  -9.638   4.746
  560    HA   GLU  74           HA       GLU  74   7.728 -11.957   6.110
  561   1HB   GLU  74          2HB       GLU  74   9.101 -10.286   3.993
  562   2HB   GLU  74          3HB       GLU  74   9.708 -11.815   4.590
  563   1HG   GLU  74          2HG       GLU  74   7.505 -12.895   3.944
  564   2HG   GLU  74          3HG       GLU  74   7.063 -11.373   3.144
  565    H    GLY  75           H        GLY  75   8.138  -9.017   7.217
  566   1HA   GLY  75          2HA       GLY  75   9.378  -8.204   9.073
  567   2HA   GLY  75          3HA       GLY  75  10.352  -9.682   9.055
  568    H    ARG  76           H        ARG  76   9.907  -6.457   7.621
  569    HA   ARG  76           HA       ARG  76  12.655  -6.244   6.739
  570   1HB   ARG  76          2HB       ARG  76  10.348  -6.523   4.886
  571   2HB   ARG  76          3HB       ARG  76  11.003  -4.898   4.837
  572   1HG   ARG  76          2HG       ARG  76  11.980  -6.198   3.108
  573   2HG   ARG  76          3HG       ARG  76  13.227  -5.731   4.267
  574   1HD   ARG  76          2HD       ARG  76  11.814  -8.436   4.393
  575   2HD   ARG  76          3HD       ARG  76  13.157  -8.210   3.289
  576    HE   ARG  76           HE       ARG  76  13.207  -8.488   6.185
  577   1HH1  ARG  76          2HH2      ARG  76  14.963  -7.102   3.480
  578   2HH1  ARG  76          1HH2      ARG  76  16.521  -7.079   4.253
  579   1HH2  ARG  76          2HH1      ARG  76  15.216  -8.460   7.284
  580   2HH2  ARG  76          1HH1      ARG  76  16.661  -7.872   6.513
  Start of MODEL   20
    1   1H    MET   1          H1        MET   1   3.323  16.578  17.995
    2   2H    MET   1          H2        MET   1   4.598  17.620  18.098
    3   3H    MET   1          H3        MET   1   3.049  18.095  18.526
    4    HA   MET   1           HA       MET   1   3.413  19.008  16.409
    5   1HB   MET   1          2HB       MET   1   3.946  17.396  14.500
    6   2HB   MET   1          3HB       MET   1   5.276  17.750  15.601
    7   1HG   MET   1          2HG       MET   1   3.539  15.316  16.095
    8   2HG   MET   1          3HG       MET   1   4.807  15.272  14.877
    9   1HE   MET   1          1HE       MET   1   4.305  13.915  18.264
   10   2HE   MET   1          2HE       MET   1   4.998  13.140  16.828
   11   3HE   MET   1          3HE       MET   1   5.999  13.366  18.270
   12    H    LEU   2           H        LEU   2   1.978  18.416  14.375
   13    HA   LEU   2           HA       LEU   2  -0.594  17.187  15.164
   14   1HB   LEU   2          2HB       LEU   2   0.540  18.627  12.740
   15   2HB   LEU   2          3HB       LEU   2  -0.825  17.546  12.518
   16    HG   LEU   2           HG       LEU   2  -2.155  18.756  14.182
   17   1HD1  LEU   2          1HD1      LEU   2  -1.435  21.034  14.881
   18   2HD1  LEU   2          2HD1      LEU   2  -0.416  19.777  15.589
   19   3HD1  LEU   2          3HD1      LEU   2   0.178  20.726  14.205
   20   1HD2  LEU   2          1HD2      LEU   2  -2.303  19.252  11.766
   21   2HD2  LEU   2          2HD2      LEU   2  -2.596  20.701  12.743
   22   3HD2  LEU   2          3HD2      LEU   2  -1.029  20.479  11.934
   23    H    SER   3           H        SER   3  -1.302  15.567  13.211
   24    HA   SER   3           HA       SER   3  -0.453  13.134  13.089
   25   1HB   SER   3          2HB       SER   3  -0.943  14.988  10.712
   26   2HB   SER   3          3HB       SER   3  -1.089  13.229  10.659
   27    HG   SER   3           HG       SER   3  -2.735  13.298  12.081
   28    H    GLU   4           H        GLU   4   1.506  12.263  13.175
   29    HA   GLU   4           HA       GLU   4   3.874  13.436  11.948
   30   1HB   GLU   4          2HB       GLU   4   3.255  11.155  13.719
   31   2HB   GLU   4          3HB       GLU   4   4.594  10.872  12.636
   32   1HG   GLU   4          2HG       GLU   4   5.483  13.106  13.431
   33   2HG   GLU   4          3HG       GLU   4   4.262  12.962  14.706
   34    H    GLN   5           H        GLN   5   5.220  11.568  10.673
   35    HA   GLN   5           HA       GLN   5   3.469  10.102   8.828
   36   1HB   GLN   5          2HB       GLN   5   5.826  11.837   8.099
   37   2HB   GLN   5          3HB       GLN   5   5.147  10.659   6.981
   38   1HG   GLN   5          2HG       GLN   5   3.263  12.742   8.115
   39   2HG   GLN   5          3HG       GLN   5   4.503  13.270   6.994
   40   1HE2  GLN   5          1HE2      GLN   5   2.708  10.119   6.979
   41   2HE2  GLN   5          2HE2      GLN   5   1.850  10.485   5.490
   42    H    LYS   6           H        LYS   6   4.397   8.086   8.323
   43    HA   LYS   6           HA       LYS   6   7.250   7.783   8.569
   44   1HB   LYS   6          2HB       LYS   6   5.440   5.941  10.186
   45   2HB   LYS   6          3HB       LYS   6   7.071   5.506   9.664
   46   1HG   LYS   6          2HG       LYS   6   7.903   7.662  10.730
   47   2HG   LYS   6          3HG       LYS   6   6.347   7.779  11.550
   48   1HD   LYS   6          2HD       LYS   6   8.226   5.370  11.717
   49   2HD   LYS   6          3HD       LYS   6   8.274   6.749  12.830
   50   1HE   LYS   6          2HE       LYS   6   5.914   6.336  13.485
   51   2HE   LYS   6          3HE       LYS   6   5.872   4.902  12.425
   52   1HZ   LYS   6          1HZ       LYS   6   7.577   3.937  13.797
   53   2HZ   LYS   6          2HZ       LYS   6   7.636   5.281  14.750
   54   3HZ   LYS   6          3HZ       LYS   6   6.278   4.358  14.716
   55    H    GLU   7           H        GLU   7   8.018   5.902   7.519
   56    HA   GLU   7           HA       GLU   7   6.494   5.360   5.054
   57   1HB   GLU   7          2HB       GLU   7   9.511   5.403   5.358
   58   2HB   GLU   7          3HB       GLU   7   8.481   5.610   3.945
   59   1HG   GLU   7          2HG       GLU   7   9.348   7.754   4.414
   60   2HG   GLU   7          3HG       GLU   7   7.731   7.838   5.135
   61    H    ILE   8           H        ILE   8   5.646   3.372   5.756
   62    HA   ILE   8           HA       ILE   8   7.393   1.401   7.039
   63    HB   ILE   8           HB       ILE   8   4.537   1.367   6.214
   64   1HG1  ILE   8          2HG1      ILE   8   4.178   1.387   8.795
   65   2HG1  ILE   8          3HG1      ILE   8   5.885   1.799   8.959
   66   1HG2  ILE   8          1HG2      ILE   8   5.331  -0.830   6.351
   67   2HG2  ILE   8          2HG2      ILE   8   6.101  -0.465   7.940
   68   3HG2  ILE   8          3HG2      ILE   8   4.311  -0.475   7.750
   69   1HD1  ILE   8          1HD1      ILE   8   4.020   3.440   7.260
   70   2HD1  ILE   8          2HD1      ILE   8   4.036   3.625   9.034
   71   3HD1  ILE   8          3HD1      ILE   8   5.512   3.938   8.106
   72    H    ALA   9           H        ALA   9   7.360  -0.819   6.007
   73    HA   ALA   9           HA       ALA   9   7.515  -0.798   3.050
   74   1HB   ALA   9          1HB       ALA   9   9.797  -0.195   3.908
   75   2HB   ALA   9          2HB       ALA   9   9.813  -1.701   4.839
   76   3HB   ALA   9          3HB       ALA   9   9.752  -1.758   3.065
   77    H    MET  10           H        MET  10   6.740  -2.786   2.272
   78    HA   MET  10           HA       MET  10   7.096  -5.245   3.809
   79   1HB   MET  10          2HB       MET  10   4.613  -5.777   3.760
   80   2HB   MET  10          3HB       MET  10   5.187  -4.701   5.029
   81   1HG   MET  10          2HG       MET  10   4.244  -3.355   2.551
   82   2HG   MET  10          3HG       MET  10   3.029  -4.239   3.449
   83   1HE   MET  10          1HE       MET  10   4.071  -0.092   4.243
   84   2HE   MET  10          2HE       MET  10   5.193  -1.092   3.309
   85   3HE   MET  10          3HE       MET  10   3.501  -0.984   2.796
   86    H    GLN  11           H        GLN  11   5.760  -7.082   2.597
   87    HA   GLN  11           HA       GLN  11   6.617  -6.882  -0.240
   88   1HB   GLN  11          2HB       GLN  11   6.175  -9.177   1.738
   89   2HB   GLN  11          3HB       GLN  11   6.302  -9.461   0.007
   90   1HG   GLN  11          2HG       GLN  11   8.416  -8.125   1.774
   91   2HG   GLN  11          3HG       GLN  11   8.476  -9.788   1.159
   92   1HE2  GLN  11          1HE2      GLN  11   7.944  -9.852  -1.380
   93   2HE2  GLN  11          2HE2      GLN  11   8.548  -8.501  -2.314
   94    H    VAL  12           H        VAL  12   5.220  -8.017  -1.832
   95    HA   VAL  12           HA       VAL  12   2.356  -7.302  -1.310
   96    HB   VAL  12           HB       VAL  12   3.956  -7.052  -3.892
   97   1HG1  VAL  12          1HG1      VAL  12   1.542  -7.247  -4.288
   98   2HG1  VAL  12          2HG1      VAL  12   1.208  -6.030  -3.033
   99   3HG1  VAL  12          3HG1      VAL  12   2.043  -5.569  -4.528
  100   1HG2  VAL  12          1HG2      VAL  12   3.247  -4.985  -1.784
  101   2HG2  VAL  12          2HG2      VAL  12   4.888  -5.444  -2.303
  102   3HG2  VAL  12          3HG2      VAL  12   3.822  -4.576  -3.408
  103    H    SER  13           H        SER  13   0.736  -8.623  -2.495
  104    HA   SER  13           HA       SER  13   1.681 -10.776  -4.164
  105   1HB   SER  13          2HB       SER  13   1.984 -11.841  -1.961
  106   2HB   SER  13          3HB       SER  13   0.279 -11.523  -1.563
  107    HG   SER  13           HG       SER  13   0.706 -13.654  -2.424
  108    H    GLY  14           H        GLY  14  -0.366 -12.200  -4.638
  109   1HA   GLY  14          2HA       GLY  14  -2.267 -12.222  -5.978
  110   2HA   GLY  14          3HA       GLY  14  -2.940 -11.054  -4.826
  111    H    MET  15           H        MET  15  -0.769 -11.310  -7.704
  112    HA   MET  15           HA       MET  15  -1.659  -8.667  -8.662
  113   1HB   MET  15          2HB       MET  15   0.667  -7.902  -8.909
  114   2HB   MET  15          3HB       MET  15   0.249  -8.216  -7.215
  115   1HG   MET  15          2HG       MET  15   2.409  -9.004  -7.441
  116   2HG   MET  15          3HG       MET  15   1.418 -10.460  -7.443
  117   1HE   MET  15          1HE       MET  15   3.393 -11.913  -8.277
  118   2HE   MET  15          2HE       MET  15   4.428 -11.496  -9.663
  119   3HE   MET  15          3HE       MET  15   4.455 -10.483  -8.200
  120    H    THR  16           H        THR  16  -1.171  -8.300 -10.896
  121    HA   THR  16           HA       THR  16  -0.484 -10.665 -12.532
  122    HB   THR  16           HB       THR  16  -1.181  -8.717 -14.287
  123    HG1  THR  16           1HG      THR  16  -2.225  -7.136 -13.315
  124   1HG2  THR  16          1HG2      THR  16  -2.283 -10.878 -14.119
  125   2HG2  THR  16          2HG2      THR  16  -3.099 -10.402 -12.614
  126   3HG2  THR  16          3HG2      THR  16  -3.507  -9.599 -14.150
  127    H    CYS  17           H        CYS  17   0.252  -7.114 -12.558
  128    HA   CYS  17           HA       CYS  17   3.064  -7.685 -13.280
  129   1HB   CYS  17          2HB       CYS  17   2.640  -6.129 -15.315
  130   2HB   CYS  17          3HB       CYS  17   2.084  -7.802 -15.426
  131    H    ALA  18           H        ALA  18   4.291  -5.684 -13.544
  132    HA   ALA  18           HA       ALA  18   4.043  -4.142 -11.160
  133   1HB   ALA  18          1HB       ALA  18   5.952  -3.827 -13.511
  134   2HB   ALA  18          2HB       ALA  18   6.182  -3.179 -11.874
  135   3HB   ALA  18          3HB       ALA  18   6.180  -4.931 -12.136
  136    H    ALA  19           H        ALA  19   1.830  -3.632 -12.929
  137    HA   ALA  19           HA       ALA  19   1.999  -0.659 -13.223
  138   1HB   ALA  19          1HB       ALA  19   0.236  -2.634 -14.739
  139   2HB   ALA  19          2HB       ALA  19   0.178  -0.863 -14.867
  140   3HB   ALA  19          3HB       ALA  19   1.623  -1.747 -15.401
  141    H    CYS  20           H        CYS  20  -0.063  -3.515 -12.354
  142    HA   CYS  20           HA       CYS  20  -2.204  -1.924 -11.447
  143   1HB   CYS  20          2HB       CYS  20  -1.507  -4.809 -10.688
  144   2HB   CYS  20          3HB       CYS  20  -3.112  -4.053 -10.636
  145    H    ALA  21           H        ALA  21   0.529  -3.386  -9.736
  146    HA   ALA  21           HA       ALA  21  -0.172  -2.694  -7.109
  147   1HB   ALA  21          1HB       ALA  21   2.651  -2.612  -8.220
  148   2HB   ALA  21          2HB       ALA  21   2.100  -3.026  -6.572
  149   3HB   ALA  21          3HB       ALA  21   1.770  -4.124  -7.906
  150    H    ALA  22           H        ALA  22   0.874  -0.556  -9.770
  151    HA   ALA  22           HA       ALA  22   1.489   1.701  -8.024
  152   1HB   ALA  22          1HB       ALA  22   0.569   1.743 -10.927
  153   2HB   ALA  22          2HB       ALA  22   1.364   3.035 -10.035
  154   3HB   ALA  22          3HB       ALA  22   2.263   1.547 -10.412
  155    H    ARG  23           H        ARG  23  -1.340   0.475  -9.840
  156    HA   ARG  23           HA       ARG  23  -3.093   2.657  -9.298
  157   1HB   ARG  23          2HB       ARG  23  -3.778  -0.283  -9.769
  158   2HB   ARG  23          3HB       ARG  23  -4.916   1.041  -9.783
  159   1HG   ARG  23          2HG       ARG  23  -2.562   0.661 -11.705
  160   2HG   ARG  23          3HG       ARG  23  -4.264   0.363 -12.061
  161   1HD   ARG  23          2HD       ARG  23  -2.936   3.038 -11.495
  162   2HD   ARG  23          3HD       ARG  23  -3.644   2.482 -13.021
  163    HE   ARG  23           HE       ARG  23  -5.738   2.297 -11.242
  164   1HH1  ARG  23          2HH2      ARG  23  -3.673   4.888 -12.406
  165   2HH1  ARG  23          1HH2      ARG  23  -4.795   6.173 -12.080
  166   1HH2  ARG  23          2HH1      ARG  23  -7.263   3.958 -10.751
  167   2HH2  ARG  23          1HH1      ARG  23  -6.917   5.611 -11.138
  168    H    ILE  24           H        ILE  24  -2.577  -0.443  -7.506
  169    HA   ILE  24           HA       ILE  24  -4.526   0.230  -5.564
  170    HB   ILE  24           HB       ILE  24  -3.866  -1.399  -4.167
  171   1HG1  ILE  24          2HG1      ILE  24  -1.169  -1.264  -5.398
  172   2HG1  ILE  24          3HG1      ILE  24  -1.671  -0.990  -3.712
  173   1HG2  ILE  24          1HG2      ILE  24  -4.013  -3.270  -5.538
  174   2HG2  ILE  24          2HG2      ILE  24  -4.719  -1.995  -6.527
  175   3HG2  ILE  24          3HG2      ILE  24  -3.059  -2.543  -6.854
  176   1HD1  ILE  24          1HD1      ILE  24  -2.266  -3.428  -3.579
  177   2HD1  ILE  24          2HD1      ILE  24  -1.529  -3.590  -5.204
  178   3HD1  ILE  24          3HD1      ILE  24  -0.533  -3.101  -3.826
  179    H    GLU  25           H        GLU  25  -0.952   0.719  -5.190
  180    HA   GLU  25           HA       GLU  25  -1.111   2.217  -2.866
  181   1HB   GLU  25          2HB       GLU  25   0.851   2.018  -5.094
  182   2HB   GLU  25          3HB       GLU  25   0.987   3.462  -4.071
  183   1HG   GLU  25          2HG       GLU  25   2.350   1.531  -3.255
  184   2HG   GLU  25          3HG       GLU  25   1.205   2.143  -2.061
  185    H    LYS  26           H        LYS  26  -1.703   3.476  -6.148
  186    HA   LYS  26           HA       LYS  26  -1.736   6.221  -5.189
  187   1HB   LYS  26          2HB       LYS  26  -2.403   4.970  -7.833
  188   2HB   LYS  26          3HB       LYS  26  -2.972   6.592  -7.439
  189   1HG   LYS  26          2HG       LYS  26  -0.947   6.971  -8.520
  190   2HG   LYS  26          3HG       LYS  26  -0.588   7.246  -6.808
  191   1HD   LYS  26          2HD       LYS  26   0.494   5.070  -6.638
  192   2HD   LYS  26          3HD       LYS  26  -0.036   4.698  -8.290
  193   1HE   LYS  26          2HE       LYS  26   1.323   6.523  -9.219
  194   2HE   LYS  26          3HE       LYS  26   1.831   7.009  -7.592
  195   1HZ   LYS  26          1HZ       LYS  26   2.464   4.426  -8.862
  196   2HZ   LYS  26          2HZ       LYS  26   3.487   5.702  -8.725
  197   3HZ   LYS  26          3HZ       LYS  26   2.966   4.925  -7.375
  198    H    GLY  27           H        GLY  27  -4.270   3.765  -5.895
  199   1HA   GLY  27          2HA       GLY  27  -6.513   5.470  -5.213
  200   2HA   GLY  27          3HA       GLY  27  -6.501   3.703  -5.292
  201    H    LEU  28           H        LEU  28  -4.295   3.385  -3.425
  202    HA   LEU  28           HA       LEU  28  -5.737   3.283  -0.964
  203   1HB   LEU  28          2HB       LEU  28  -4.095   1.627  -1.612
  204   2HB   LEU  28          3HB       LEU  28  -2.824   2.840  -1.695
  205    HG   LEU  28           HG       LEU  28  -2.729   1.261   0.218
  206   1HD1  LEU  28          1HD1      LEU  28  -1.606   3.515   0.186
  207   2HD1  LEU  28          2HD1      LEU  28  -2.976   4.148   1.116
  208   3HD1  LEU  28          3HD1      LEU  28  -1.954   2.872   1.799
  209   1HD2  LEU  28          1HD2      LEU  28  -4.176   1.706   2.168
  210   2HD2  LEU  28          2HD2      LEU  28  -5.224   2.709   1.161
  211   3HD2  LEU  28          3HD2      LEU  28  -4.990   0.986   0.774
  212    H    LYS  29           H        LYS  29  -3.049   5.381  -2.198
  213    HA   LYS  29           HA       LYS  29  -2.710   7.023  -0.022
  214   1HB   LYS  29          2HB       LYS  29  -1.551   7.116  -2.326
  215   2HB   LYS  29          3HB       LYS  29  -2.896   8.155  -2.829
  216   1HG   LYS  29          2HG       LYS  29  -2.268   9.525  -0.626
  217   2HG   LYS  29          3HG       LYS  29  -0.767   8.627  -0.724
  218   1HD   LYS  29          2HD       LYS  29  -1.987  10.490  -2.828
  219   2HD   LYS  29          3HD       LYS  29  -0.644  10.864  -1.760
  220   1HE   LYS  29          2HE       LYS  29   0.415   8.661  -2.948
  221   2HE   LYS  29          3HE       LYS  29  -0.705   9.149  -4.227
  222   1HZ   LYS  29          1HZ       LYS  29   0.461  11.439  -3.899
  223   2HZ   LYS  29          2HZ       LYS  29   1.603  10.551  -3.106
  224   3HZ   LYS  29          3HZ       LYS  29   1.322  10.230  -4.641
  225    H    ARG  30           H        ARG  30  -5.473   7.066  -2.240
  226    HA   ARG  30           HA       ARG  30  -6.548   9.593  -1.511
  227   1HB   ARG  30          2HB       ARG  30  -7.325   7.335  -3.151
  228   2HB   ARG  30          3HB       ARG  30  -8.664   7.714  -2.101
  229   1HG   ARG  30          2HG       ARG  30  -9.127   9.004  -3.910
  230   2HG   ARG  30          3HG       ARG  30  -8.276  10.199  -2.922
  231   1HD   ARG  30          2HD       ARG  30  -6.226   9.856  -4.248
  232   2HD   ARG  30          3HD       ARG  30  -6.965   8.457  -5.062
  233    HE   ARG  30           HE       ARG  30  -8.517  10.882  -5.391
  234   1HH1  ARG  30          2HH2      ARG  30  -5.699   9.192  -6.641
  235   2HH1  ARG  30          1HH2      ARG  30  -5.892   9.726  -8.285
  236   1HH2  ARG  30          2HH1      ARG  30  -8.854  11.576  -7.570
  237   2HH2  ARG  30          1HH1      ARG  30  -7.740  11.133  -8.817
  238    H    MET  31           H        MET  31  -6.402   6.671   0.376
  239    HA   MET  31           HA       MET  31  -8.874   6.922   1.762
  240   1HB   MET  31          2HB       MET  31  -8.071   5.053   3.025
  241   2HB   MET  31          3HB       MET  31  -7.386   4.887   1.416
  242   1HG   MET  31          2HG       MET  31  -5.420   4.641   2.409
  243   2HG   MET  31          3HG       MET  31  -5.429   6.351   2.744
  244   1HE   MET  31          1HE       MET  31  -5.131   2.926   5.495
  245   2HE   MET  31          2HE       MET  31  -6.172   2.718   4.055
  246   3HE   MET  31          3HE       MET  31  -4.495   3.281   3.897
  247    HA   PRO  32           HA       PRO  32  -7.746   9.876   4.925
  248   1HB   PRO  32          2HB       PRO  32  -9.142   9.121   7.126
  249   2HB   PRO  32          3HB       PRO  32  -9.930   9.751   5.651
  250   1HG   PRO  32          2HG       PRO  32  -9.572   6.852   6.457
  251   2HG   PRO  32          3HG       PRO  32 -11.046   7.677   5.886
  252   1HD   PRO  32          2HD       PRO  32  -9.431   6.213   4.242
  253   2HD   PRO  32          3HD       PRO  32 -10.304   7.654   3.644
  254    H    GLY  33           H        GLY  33  -5.726   9.839   5.620
  255   1HA   GLY  33          2HA       GLY  33  -4.477   9.460   7.709
  256   2HA   GLY  33          3HA       GLY  33  -4.785   7.733   7.552
  257    H    VAL  34           H        VAL  34  -4.263   7.611   4.610
  258    HA   VAL  34           HA       VAL  34  -1.324   7.702   4.739
  259    HB   VAL  34           HB       VAL  34  -3.184   6.833   2.519
  260   1HG1  VAL  34          1HG1      VAL  34  -0.993   7.488   1.604
  261   2HG1  VAL  34          2HG1      VAL  34  -0.160   6.534   2.844
  262   3HG1  VAL  34          3HG1      VAL  34  -1.131   5.727   1.603
  263   1HG2  VAL  34          1HG2      VAL  34  -3.150   5.444   4.726
  264   2HG2  VAL  34          2HG2      VAL  34  -2.762   4.586   3.239
  265   3HG2  VAL  34          3HG2      VAL  34  -1.479   5.060   4.333
  266    H    THR  35           H        THR  35   0.020   9.095   3.599
  267    HA   THR  35           HA       THR  35  -1.338  11.535   2.520
  268    HB   THR  35           HB       THR  35   1.390  11.439   3.661
  269    HG1  THR  35           1HG      THR  35  -1.078  11.739   5.024
  270   1HG2  THR  35          1HG2      THR  35  -0.691  13.643   3.300
  271   2HG2  THR  35          2HG2      THR  35   0.849  13.850   4.152
  272   3HG2  THR  35          3HG2      THR  35   0.843  13.458   2.426
  273    H    ASP  36           H        ASP  36   1.431   9.257   2.081
  274    HA   ASP  36           HA       ASP  36   1.187   9.760  -0.734
  275   1HB   ASP  36          2HB       ASP  36   3.266  11.124   0.388
  276   2HB   ASP  36          3HB       ASP  36   4.065   9.590  -0.002
  277    H    ALA  37           H        ALA  37   2.568   8.116  -1.943
  278    HA   ALA  37           HA       ALA  37   2.954   5.598  -0.606
  279   1HB   ALA  37          1HB       ALA  37   1.095   4.323  -1.595
  280   2HB   ALA  37          2HB       ALA  37   0.440   5.635  -0.604
  281   3HB   ALA  37          3HB       ALA  37   0.475   5.790  -2.376
  282    H    ASN  38           H        ASN  38   4.023   4.021  -1.837
  283    HA   ASN  38           HA       ASN  38   4.666   4.693  -4.631
  284   1HB   ASN  38          2HB       ASN  38   7.199   4.456  -3.395
  285   2HB   ASN  38          3HB       ASN  38   6.493   5.855  -4.184
  286   1HD2  ASN  38          1HD2      ASN  38   5.868   4.342  -0.936
  287   2HD2  ASN  38          2HD2      ASN  38   6.238   5.831  -0.071
  288    H    VAL  39           H        VAL  39   4.232   2.685  -5.384
  289    HA   VAL  39           HA       VAL  39   5.030   0.351  -3.844
  290    HB   VAL  39           HB       VAL  39   3.023   0.573  -5.409
  291   1HG1  VAL  39          1HG1      VAL  39   5.077  -0.052  -7.578
  292   2HG1  VAL  39          2HG1      VAL  39   3.327   0.011  -7.752
  293   3HG1  VAL  39          3HG1      VAL  39   4.222   1.497  -7.392
  294   1HG2  VAL  39          1HG2      VAL  39   4.625  -1.653  -4.663
  295   2HG2  VAL  39          2HG2      VAL  39   2.916  -1.599  -5.080
  296   3HG2  VAL  39          3HG2      VAL  39   4.124  -1.900  -6.347
  297    H    ASN  40           H        ASN  40   6.948  -0.894  -4.164
  298    HA   ASN  40           HA       ASN  40   8.886   0.143  -6.188
  299   1HB   ASN  40          2HB       ASN  40   9.377   0.918  -3.840
  300   2HB   ASN  40          3HB       ASN  40   9.554  -0.780  -3.367
  301   1HD2  ASN  40          1HD2      ASN  40  11.744   0.635  -2.884
  302   2HD2  ASN  40          2HD2      ASN  40  12.966   0.409  -4.124
  303    H    LEU  41           H        LEU  41   7.224  -1.625  -6.966
  304    HA   LEU  41           HA       LEU  41   7.806  -4.358  -6.416
  305   1HB   LEU  41          2HB       LEU  41   6.119  -2.805  -8.245
  306   2HB   LEU  41          3HB       LEU  41   6.802  -4.189  -9.071
  307    HG   LEU  41           HG       LEU  41   4.548  -4.440  -7.966
  308   1HD1  LEU  41          1HD1      LEU  41   5.769  -6.349  -8.842
  309   2HD1  LEU  41          2HD1      LEU  41   6.717  -6.479  -7.348
  310   3HD1  LEU  41          3HD1      LEU  41   4.969  -6.793  -7.324
  311   1HD2  LEU  41          1HD2      LEU  41   5.947  -5.183  -5.398
  312   2HD2  LEU  41          2HD2      LEU  41   5.526  -3.492  -5.670
  313   3HD2  LEU  41          3HD2      LEU  41   4.261  -4.739  -5.699
  314    H    ALA  42           H        ALA  42   9.504  -1.996  -8.285
  315    HA   ALA  42           HA       ALA  42  11.159  -3.578  -9.904
  316   1HB   ALA  42          1HB       ALA  42  11.952  -1.212  -8.166
  317   2HB   ALA  42          2HB       ALA  42  12.858  -1.854  -9.545
  318   3HB   ALA  42          3HB       ALA  42  11.264  -1.109  -9.808
  319    H    THR  43           H        THR  43  11.209  -3.180  -6.320
  320    HA   THR  43           HA       THR  43  13.197  -5.408  -6.261
  321    HB   THR  43           HB       THR  43  14.168  -3.357  -5.412
  322    HG1  THR  43           1HG      THR  43  13.668  -5.466  -3.603
  323   1HG2  THR  43          1HG2      THR  43  13.498  -2.360  -3.330
  324   2HG2  THR  43          2HG2      THR  43  12.036  -2.438  -4.331
  325   3HG2  THR  43          3HG2      THR  43  12.279  -3.609  -3.028
  326    H    GLU  44           H        GLU  44  10.228  -5.408  -6.513
  327    HA   GLU  44           HA       GLU  44   8.461  -6.510  -5.808
  328   1HB   GLU  44          2HB       GLU  44  10.759  -8.140  -5.396
  329   2HB   GLU  44          3HB       GLU  44   9.684  -8.488  -4.057
  330   1HG   GLU  44          2HG       GLU  44   7.873  -9.024  -5.624
  331   2HG   GLU  44          3HG       GLU  44   8.850  -8.454  -6.996
  332    H    THR  45           H        THR  45   9.311  -4.194  -3.966
  333    HA   THR  45           HA       THR  45   7.871  -5.043  -1.495
  334    HB   THR  45           HB       THR  45  10.084  -2.994  -1.931
  335    HG1  THR  45           1HG      THR  45  10.149  -5.707  -1.095
  336   1HG2  THR  45          1HG2      THR  45   9.051  -4.251   0.628
  337   2HG2  THR  45          2HG2      THR  45  10.424  -3.139   0.476
  338   3HG2  THR  45          3HG2      THR  45   8.791  -2.554   0.122
  339    H    VAL  46           H        VAL  46   6.699  -3.189  -0.408
  340    HA   VAL  46           HA       VAL  46   5.979  -0.941  -2.245
  341    HB   VAL  46           HB       VAL  46   4.130  -2.489  -2.323
  342   1HG1  VAL  46          1HG1      VAL  46   2.841  -3.139  -0.320
  343   2HG1  VAL  46          2HG1      VAL  46   4.495  -3.741  -0.178
  344   3HG1  VAL  46          3HG1      VAL  46   3.993  -2.278   0.706
  345   1HG2  VAL  46          1HG2      VAL  46   2.326  -1.146  -1.448
  346   2HG2  VAL  46          2HG2      VAL  46   3.419  -0.180  -0.459
  347   3HG2  VAL  46          3HG2      VAL  46   3.538  -0.114  -2.233
  348    H    ASN  47           H        ASN  47   5.650   1.133  -1.217
  349    HA   ASN  47           HA       ASN  47   6.201   1.159   1.687
  350   1HB   ASN  47          2HB       ASN  47   7.445   2.838  -0.548
  351   2HB   ASN  47          3HB       ASN  47   7.354   3.426   1.114
  352   1HD2  ASN  47          1HD2      ASN  47   8.270   1.875   2.838
  353   2HD2  ASN  47          2HD2      ASN  47   9.882   1.319   2.410
  354    H    VAL  48           H        VAL  48   4.772   2.685   2.785
  355    HA   VAL  48           HA       VAL  48   3.026   4.365   1.133
  356    HB   VAL  48           HB       VAL  48   1.338   3.690   2.957
  357   1HG1  VAL  48          1HG1      VAL  48   0.805   3.257   0.667
  358   2HG1  VAL  48          2HG1      VAL  48   2.014   1.959   0.554
  359   3HG1  VAL  48          3HG1      VAL  48   0.545   1.723   1.514
  360   1HG2  VAL  48          1HG2      VAL  48   1.405   1.418   3.750
  361   2HG2  VAL  48          2HG2      VAL  48   2.852   1.097   2.796
  362   3HG2  VAL  48          3HG2      VAL  48   2.942   2.179   4.212
  363    H    ILE  49           H        ILE  49   2.954   6.351   1.987
  364    HA   ILE  49           HA       ILE  49   4.613   6.847   4.370
  365    HB   ILE  49           HB       ILE  49   3.739   8.812   2.234
  366   1HG1  ILE  49          2HG1      ILE  49   4.924   7.209   0.960
  367   2HG1  ILE  49          3HG1      ILE  49   5.962   8.611   1.194
  368   1HG2  ILE  49          1HG2      ILE  49   6.275   9.228   3.736
  369   2HG2  ILE  49          2HG2      ILE  49   5.044  10.367   3.190
  370   3HG2  ILE  49          3HG2      ILE  49   4.774   9.403   4.649
  371   1HD1  ILE  49          1HD1      ILE  49   6.191   5.965   2.698
  372   2HD1  ILE  49          2HD1      ILE  49   7.275   6.571   1.434
  373   3HD1  ILE  49          3HD1      ILE  49   7.192   7.401   2.979
  374    H    TYR  50           H        TYR  50   3.146   6.861   6.111
  375    HA   TYR  50           HA       TYR  50   0.606   8.414   5.809
  376   1HB   TYR  50          2HB       TYR  50  -0.703   6.602   6.712
  377   2HB   TYR  50          3HB       TYR  50   0.117   6.133   5.238
  378    HD1  TYR  50           HD1      TYR  50   1.383   4.137   5.149
  379    HD2  TYR  50           HD2      TYR  50   0.178   5.757   8.938
  380    HE1  TYR  50           HE1      TYR  50   1.781   1.939   6.224
  381    HE2  TYR  50           HE2      TYR  50   0.842   3.651  10.049
  382    HH   TYR  50           HH       TYR  50   1.671   0.731   8.166
  383    H    ASP  51           H        ASP  51  -0.550   8.547   7.891
  384    HA   ASP  51           HA       ASP  51   1.403   9.321   9.999
  385   1HB   ASP  51          2HB       ASP  51  -0.198  11.008   9.516
  386   2HB   ASP  51          3HB       ASP  51  -1.541   9.877   9.667
  387    HA   PRO  52           HA       PRO  52   0.174   5.257  11.589
  388   1HB   PRO  52          2HB       PRO  52   2.220   4.682  13.229
  389   2HB   PRO  52          3HB       PRO  52   2.416   4.705  11.463
  390   1HG   PRO  52          2HG       PRO  52   3.025   6.987  13.399
  391   2HG   PRO  52          3HG       PRO  52   4.096   6.321  12.128
  392   1HD   PRO  52          2HD       PRO  52   2.581   8.532  11.716
  393   2HD   PRO  52          3HD       PRO  52   2.915   7.337  10.425
  394    H    ALA  53           H        ALA  53  -0.215   8.293  12.990
  395    HA   ALA  53           HA       ALA  53  -1.019   7.262  15.639
  396   1HB   ALA  53          1HB       ALA  53   0.082   9.508  15.400
  397   2HB   ALA  53          2HB       ALA  53  -1.297  10.027  14.402
  398   3HB   ALA  53          3HB       ALA  53  -1.555   9.565  16.092
  399    H    GLU  54           H        GLU  54  -2.171   7.946  12.352
  400    HA   GLU  54           HA       GLU  54  -4.960   7.821  13.307
  401   1HB   GLU  54          2HB       GLU  54  -3.788   9.670  11.557
  402   2HB   GLU  54          3HB       GLU  54  -4.590   8.536  10.467
  403   1HG   GLU  54          2HG       GLU  54  -6.674   8.788  11.939
  404   2HG   GLU  54          3HG       GLU  54  -5.823  10.117  12.750
  405    H    THR  55           H        THR  55  -2.848   6.794  10.669
  406    HA   THR  55           HA       THR  55  -4.264   4.237  10.416
  407    HB   THR  55           HB       THR  55  -2.600   4.173   8.198
  408    HG1  THR  55           1HG      THR  55  -3.245   6.846   8.708
  409   1HG2  THR  55          1HG2      THR  55  -4.985   3.726   8.348
  410   2HG2  THR  55          2HG2      THR  55  -5.349   5.469   8.546
  411   3HG2  THR  55          3HG2      THR  55  -4.606   4.865   7.038
  412    H    GLY  56           H        GLY  56  -2.431   2.691   9.410
  413   1HA   GLY  56          2HA       GLY  56  -0.267   1.873  10.917
  414   2HA   GLY  56          3HA       GLY  56  -1.776   1.367  11.730
  415    H    THR  57           H        THR  57  -2.026  -0.726  10.994
  416    HA   THR  57           HA       THR  57  -1.507  -1.598   8.244
  417    HB   THR  57           HB       THR  57  -2.070  -3.799   9.381
  418    HG1  THR  57           1HG      THR  57  -2.473  -3.728  11.557
  419   1HG2  THR  57          1HG2      THR  57   0.043  -3.837  10.725
  420   2HG2  THR  57          2HG2      THR  57   0.291  -2.942   9.213
  421   3HG2  THR  57          3HG2      THR  57   0.105  -2.065  10.739
  422    H    ALA  58           H        ALA  58  -3.977  -0.890  10.613
  423    HA   ALA  58           HA       ALA  58  -6.017  -2.362   9.942
  424   1HB   ALA  58          1HB       ALA  58  -6.237   0.535  10.819
  425   2HB   ALA  58          2HB       ALA  58  -7.517  -0.688  10.964
  426   3HB   ALA  58          3HB       ALA  58  -6.006  -0.876  11.873
  427    H    ALA  59           H        ALA  59  -5.651   0.809   8.516
  428    HA   ALA  59           HA       ALA  59  -8.146   0.310   6.929
  429   1HB   ALA  59          1HB       ALA  59  -6.481   2.807   7.140
  430   2HB   ALA  59          2HB       ALA  59  -7.874   2.607   6.056
  431   3HB   ALA  59          3HB       ALA  59  -8.077   2.488   7.814
  432    H    ILE  60           H        ILE  60  -4.684   0.267   6.599
  433    HA   ILE  60           HA       ILE  60  -4.531   0.232   3.768
  434    HB   ILE  60           HB       ILE  60  -2.698  -0.427   6.056
  435   1HG1  ILE  60          2HG1      ILE  60  -2.378   1.007   3.422
  436   2HG1  ILE  60          3HG1      ILE  60  -3.139   1.784   4.813
  437   1HG2  ILE  60          1HG2      ILE  60  -0.952  -1.272   4.482
  438   2HG2  ILE  60          2HG2      ILE  60  -2.279  -2.404   4.622
  439   3HG2  ILE  60          3HG2      ILE  60  -2.164  -1.359   3.192
  440   1HD1  ILE  60          1HD1      ILE  60  -0.745   2.408   4.565
  441   2HD1  ILE  60          2HD1      ILE  60  -1.199   1.748   6.143
  442   3HD1  ILE  60          3HD1      ILE  60  -0.307   0.738   4.995
  443    H    GLN  61           H        GLN  61  -4.659  -2.538   6.085
  444    HA   GLN  61           HA       GLN  61  -4.591  -4.471   3.979
  445   1HB   GLN  61          2HB       GLN  61  -5.112  -4.486   6.865
  446   2HB   GLN  61          3HB       GLN  61  -6.186  -5.560   5.958
  447   1HG   GLN  61          2HG       GLN  61  -4.581  -7.046   6.371
  448   2HG   GLN  61          3HG       GLN  61  -4.009  -6.462   4.812
  449   1HE2  GLN  61          1HE2      GLN  61  -2.951  -3.884   5.914
  450   2HE2  GLN  61          2HE2      GLN  61  -1.518  -4.348   6.819
  451    H    GLU  62           H        GLU  62  -7.285  -2.830   5.657
  452    HA   GLU  62           HA       GLU  62  -9.459  -4.076   4.477
  453   1HB   GLU  62          2HB       GLU  62  -9.093  -1.938   6.211
  454   2HB   GLU  62          3HB       GLU  62  -9.747  -1.118   4.794
  455   1HG   GLU  62          2HG       GLU  62 -10.988  -3.477   6.277
  456   2HG   GLU  62          3HG       GLU  62 -11.515  -1.791   6.360
  457    H    LYS  63           H        LYS  63  -7.797  -1.090   3.270
  458    HA   LYS  63           HA       LYS  63  -9.283  -0.993   0.875
  459   1HB   LYS  63          2HB       LYS  63  -6.769   0.248   1.986
  460   2HB   LYS  63          3HB       LYS  63  -7.175   0.475   0.306
  461   1HG   LYS  63          2HG       LYS  63  -9.007   1.266   2.600
  462   2HG   LYS  63          3HG       LYS  63  -7.810   2.314   1.831
  463   1HD   LYS  63          2HD       LYS  63  -9.816   2.946   0.890
  464   2HD   LYS  63          3HD       LYS  63  -8.958   2.061  -0.372
  465   1HE   LYS  63          2HE       LYS  63 -10.487   0.284  -0.353
  466   2HE   LYS  63          3HE       LYS  63 -10.960   0.555   1.345
  467   1HZ   LYS  63          1HZ       LYS  63 -12.167   2.481   0.621
  468   2HZ   LYS  63          2HZ       LYS  63 -11.730   2.225  -0.950
  469   3HZ   LYS  63          3HZ       LYS  63 -12.680   1.137  -0.165
  470    H    ILE  64           H        ILE  64  -6.114  -2.485   1.644
  471    HA   ILE  64           HA       ILE  64  -5.110  -3.095  -0.869
  472    HB   ILE  64           HB       ILE  64  -4.958  -4.092   1.891
  473   1HG1  ILE  64          2HG1      ILE  64  -3.597  -2.218   1.091
  474   2HG1  ILE  64          3HG1      ILE  64  -2.697  -3.607   1.694
  475   1HG2  ILE  64          1HG2      ILE  64  -4.049  -5.833  -0.360
  476   2HG2  ILE  64          2HG2      ILE  64  -3.400  -5.891   1.304
  477   3HG2  ILE  64          3HG2      ILE  64  -5.111  -6.208   1.019
  478   1HD1  ILE  64          1HD1      ILE  64  -3.007  -2.685  -1.157
  479   2HD1  ILE  64          2HD1      ILE  64  -1.538  -2.939  -0.192
  480   3HD1  ILE  64          3HD1      ILE  64  -2.485  -4.335  -0.761
  481    H    GLU  65           H        GLU  65  -7.319  -4.989   1.268
  482    HA   GLU  65           HA       GLU  65  -8.025  -7.060  -0.512
  483   1HB   GLU  65          2HB       GLU  65  -9.404  -5.718   1.813
  484   2HB   GLU  65          3HB       GLU  65 -10.183  -7.043   0.939
  485   1HG   GLU  65          2HG       GLU  65  -7.383  -7.314   2.052
  486   2HG   GLU  65          3HG       GLU  65  -8.790  -7.529   3.096
  487    H    LYS  66           H        LYS  66  -9.872  -3.977   0.097
  488    HA   LYS  66           HA       LYS  66 -11.853  -4.556  -1.890
  489   1HB   LYS  66          2HB       LYS  66 -10.976  -2.051  -0.465
  490   2HB   LYS  66          3HB       LYS  66 -11.953  -1.895  -1.918
  491   1HG   LYS  66          2HG       LYS  66 -13.491  -1.828  -0.214
  492   2HG   LYS  66          3HG       LYS  66 -13.698  -3.432  -0.910
  493   1HD   LYS  66          2HD       LYS  66 -11.904  -2.925   1.478
  494   2HD   LYS  66          3HD       LYS  66 -13.630  -3.023   1.723
  495   1HE   LYS  66          2HE       LYS  66 -13.781  -5.288   1.100
  496   2HE   LYS  66          3HE       LYS  66 -12.204  -5.308   0.311
  497   1HZ   LYS  66          1HZ       LYS  66 -12.607  -4.934   3.203
  498   2HZ   LYS  66          2HZ       LYS  66 -12.095  -6.338   2.486
  499   3HZ   LYS  66          3HZ       LYS  66 -11.183  -4.952   2.451
  500    H    LEU  67           H        LEU  67  -8.705  -3.016  -2.231
  501    HA   LEU  67           HA       LEU  67  -9.049  -2.127  -4.953
  502   1HB   LEU  67          2HB       LEU  67  -6.628  -2.569  -3.197
  503   2HB   LEU  67          3HB       LEU  67  -6.527  -1.925  -4.836
  504    HG   LEU  67           HG       LEU  67  -8.330  -0.609  -2.764
  505   1HD1  LEU  67          1HD1      LEU  67  -6.013  -0.727  -1.852
  506   2HD1  LEU  67          2HD1      LEU  67  -5.430   0.080  -3.317
  507   3HD1  LEU  67          3HD1      LEU  67  -6.535   0.928  -2.221
  508   1HD2  LEU  67          1HD2      LEU  67  -8.696   0.086  -5.106
  509   2HD2  LEU  67          2HD2      LEU  67  -7.952   1.390  -4.173
  510   3HD2  LEU  67          3HD2      LEU  67  -6.963   0.427  -5.286
  511    H    GLY  68           H        GLY  68  -8.534  -5.234  -3.498
  512   1HA   GLY  68          2HA       GLY  68  -8.780  -7.230  -4.593
  513   2HA   GLY  68          3HA       GLY  68  -8.468  -6.463  -6.156
  514    H    TYR  69           H        TYR  69  -6.439  -6.264  -3.164
  515    HA   TYR  69           HA       TYR  69  -4.301  -7.856  -4.523
  516   1HB   TYR  69          2HB       TYR  69  -4.397  -5.002  -3.861
  517   2HB   TYR  69          3HB       TYR  69  -3.121  -5.795  -2.966
  518    HD1  TYR  69           HD1      TYR  69  -4.567  -5.522  -6.414
  519    HD2  TYR  69           HD2      TYR  69  -1.093  -6.407  -4.026
  520    HE1  TYR  69           HE1      TYR  69  -3.166  -5.333  -8.403
  521    HE2  TYR  69           HE2      TYR  69   0.331  -6.114  -6.001
  522    HH   TYR  69           HH       TYR  69   0.393  -5.843  -8.290
  523    H    HIS  70           H        HIS  70  -2.476  -8.280  -2.860
  524    HA   HIS  70           HA       HIS  70  -3.424  -8.270  -0.093
  525   1HB   HIS  70          2HB       HIS  70  -3.973 -10.521  -1.239
  526   2HB   HIS  70          3HB       HIS  70  -2.230 -10.806  -1.264
  527    HD1  HIS  70           1HD      HIS  70  -3.470  -9.133   1.926
  528    HD2  HIS  70           2HD      HIS  70  -3.181 -12.993   0.279
  529    HE1  HIS  70           1HE      HIS  70  -3.681 -10.766   3.858
  530    H    VAL  71           H        VAL  71  -1.435  -8.961   1.344
  531    HA   VAL  71           HA       VAL  71   1.065  -7.811   0.319
  532    HB   VAL  71           HB       VAL  71  -0.700  -6.710   2.525
  533   1HG1  VAL  71          1HG1      VAL  71   0.992  -5.196   3.217
  534   2HG1  VAL  71          2HG1      VAL  71   1.692  -6.810   3.350
  535   3HG1  VAL  71          3HG1      VAL  71   2.119  -5.760   1.973
  536   1HG2  VAL  71          1HG2      VAL  71  -1.166  -5.773   0.317
  537   2HG2  VAL  71          2HG2      VAL  71  -0.371  -4.550   1.319
  538   3HG2  VAL  71          3HG2      VAL  71   0.551  -5.407   0.069
  539    H    VAL  72           H        VAL  72   2.804  -8.508   1.603
  540    HA   VAL  72           HA       VAL  72   2.199 -10.751   3.464
  541    HB   VAL  72           HB       VAL  72   4.517 -10.701   1.608
  542   1HG1  VAL  72          1HG1      VAL  72   4.727 -12.148   3.602
  543   2HG1  VAL  72          2HG1      VAL  72   3.180 -12.929   3.201
  544   3HG1  VAL  72          3HG1      VAL  72   4.584 -13.126   2.135
  545   1HG2  VAL  72          1HG2      VAL  72   3.267 -12.417   0.244
  546   2HG2  VAL  72          2HG2      VAL  72   1.805 -12.030   1.177
  547   3HG2  VAL  72          3HG2      VAL  72   2.565 -10.800   0.139
  548    H    ILE  73           H        ILE  73   3.369 -10.748   5.274
  549    HA   ILE  73           HA       ILE  73   5.199  -8.433   5.825
  550    HB   ILE  73           HB       ILE  73   3.405  -9.914   7.760
  551   1HG1  ILE  73          2HG1      ILE  73   1.990  -8.595   6.296
  552   2HG1  ILE  73          3HG1      ILE  73   2.127  -7.844   7.880
  553   1HG2  ILE  73          1HG2      ILE  73   4.046  -7.994   9.263
  554   2HG2  ILE  73          2HG2      ILE  73   5.385  -9.065   8.856
  555   3HG2  ILE  73          3HG2      ILE  73   5.257  -7.502   8.054
  556   1HD1  ILE  73          1HD1      ILE  73   3.553  -6.929   5.366
  557   2HD1  ILE  73          2HD1      ILE  73   2.185  -6.142   6.155
  558   3HD1  ILE  73          3HD1      ILE  73   3.755  -6.188   6.970
  559    H    GLU  74           H        GLU  74   6.761  -9.915   4.748
  560    HA   GLU  74           HA       GLU  74   7.425 -12.318   5.985
  561   1HB   GLU  74          2HB       GLU  74   7.763 -11.343   3.539
  562   2HB   GLU  74          3HB       GLU  74   9.414 -11.108   4.143
  563   1HG   GLU  74          2HG       GLU  74   7.881 -13.761   4.252
  564   2HG   GLU  74          3HG       GLU  74   8.858 -13.261   2.871
  565    H    GLY  75           H        GLY  75   7.904  -9.346   7.021
  566   1HA   GLY  75          2HA       GLY  75  10.155 -10.016   8.867
  567   2HA   GLY  75          3HA       GLY  75  10.100  -8.444   8.044
  568    H    ARG  76           H        ARG  76   7.879 -10.647   9.790
  569    HA   ARG  76           HA       ARG  76   6.324  -8.482  10.961
  570   1HB   ARG  76          2HB       ARG  76   5.524 -10.911  10.419
  571   2HB   ARG  76          3HB       ARG  76   6.431 -11.368  11.868
  572   1HG   ARG  76          2HG       ARG  76   4.956  -9.236  12.824
  573   2HG   ARG  76          3HG       ARG  76   3.868  -9.840  11.569
  574   1HD   ARG  76          2HD       ARG  76   3.945 -12.093  12.625
  575   2HD   ARG  76          3HD       ARG  76   5.128 -11.469  13.813
  576    HE   ARG  76           HE       ARG  76   2.783  -9.843  13.835
  577   1HH1  ARG  76          2HH2      ARG  76   3.937 -12.990  14.881
  578   2HH1  ARG  76          1HH2      ARG  76   2.907 -13.112  16.275
  579   1HH2  ARG  76          2HH1      ARG  76   1.377  -9.940  15.673
  580   2HH2  ARG  76          1HH1      ARG  76   1.398 -11.318  16.724
  Start of MODEL   21
    1   1H    MET   1          H1        MET   1  -0.819  20.041  12.571
    2   2H    MET   1          H2        MET   1  -1.855  21.233  13.088
    3   3H    MET   1          H3        MET   1  -0.553  20.761  14.019
    4    HA   MET   1           HA       MET   1  -2.635  19.928  14.863
    5   1HB   MET   1          2HB       MET   1  -2.431  18.187  12.356
    6   2HB   MET   1          3HB       MET   1  -3.487  17.869  13.747
    7   1HG   MET   1          2HG       MET   1  -4.651  19.986  13.427
    8   2HG   MET   1          3HG       MET   1  -3.716  20.288  11.948
    9   1HE   MET   1          1HE       MET   1  -6.117  20.653  10.778
   10   2HE   MET   1          2HE       MET   1  -7.378  19.398  10.750
   11   3HE   MET   1          3HE       MET   1  -6.964  20.201  12.281
   12    H    LEU   2           H        LEU   2  -2.017  16.841  14.417
   13    HA   LEU   2           HA       LEU   2   0.611  16.675  15.725
   14   1HB   LEU   2          2HB       LEU   2  -0.471  15.480  17.681
   15   2HB   LEU   2          3HB       LEU   2  -0.653  17.218  17.598
   16    HG   LEU   2           HG       LEU   2  -2.983  16.231  16.277
   17   1HD1  LEU   2          1HD1      LEU   2  -2.563  13.995  17.190
   18   2HD1  LEU   2          2HD1      LEU   2  -2.474  14.675  18.832
   19   3HD1  LEU   2          3HD1      LEU   2  -3.993  14.750  17.912
   20   1HD2  LEU   2          1HD2      LEU   2  -2.787  18.251  17.694
   21   2HD2  LEU   2          2HD2      LEU   2  -4.130  17.211  18.195
   22   3HD2  LEU   2          3HD2      LEU   2  -2.621  17.217  19.131
   23    H    SER   3           H        SER   3  -0.282  15.882  13.199
   24    HA   SER   3           HA       SER   3  -0.456  12.916  13.340
   25   1HB   SER   3          2HB       SER   3  -0.646  14.712  10.885
   26   2HB   SER   3          3HB       SER   3  -1.139  13.035  11.050
   27    HG   SER   3           HG       SER   3  -2.810  13.694  12.401
   28    H    GLU   4           H        GLU   4   1.704  12.332  13.849
   29    HA   GLU   4           HA       GLU   4   3.963  13.425  12.327
   30   1HB   GLU   4          2HB       GLU   4   3.569  11.358  14.412
   31   2HB   GLU   4          3HB       GLU   4   4.839  11.052  13.256
   32   1HG   GLU   4          2HG       GLU   4   5.670  13.367  13.772
   33   2HG   GLU   4          3HG       GLU   4   4.576  13.315  15.162
   34    H    GLN   5           H        GLN   5   5.164  11.710  10.971
   35    HA   GLN   5           HA       GLN   5   3.296  10.001   9.391
   36   1HB   GLN   5          2HB       GLN   5   5.484  11.850   8.425
   37   2HB   GLN   5          3HB       GLN   5   4.737  10.590   7.455
   38   1HG   GLN   5          2HG       GLN   5   2.700  12.350   8.637
   39   2HG   GLN   5          3HG       GLN   5   3.897  13.277   7.737
   40   1HE2  GLN   5          1HE2      GLN   5   2.636   9.973   7.161
   41   2HE2  GLN   5          2HE2      GLN   5   1.930  10.339   5.604
   42    H    LYS   6           H        LYS   6   4.272   8.041   8.703
   43    HA   LYS   6           HA       LYS   6   7.142   7.880   8.776
   44   1HB   LYS   6          2HB       LYS   6   5.559   5.979  10.539
   45   2HB   LYS   6          3HB       LYS   6   7.177   5.625   9.926
   46   1HG   LYS   6          2HG       LYS   6   7.970   7.823  10.895
   47   2HG   LYS   6          3HG       LYS   6   6.446   7.915  11.790
   48   1HD   LYS   6          2HD       LYS   6   8.435   5.607  11.950
   49   2HD   LYS   6          3HD       LYS   6   8.413   7.006  13.041
   50   1HE   LYS   6          2HE       LYS   6   6.045   6.465  13.676
   51   2HE   LYS   6          3HE       LYS   6   6.132   4.997  12.680
   52   1HZ   LYS   6          1HZ       LYS   6   7.826   5.613  15.010
   53   2HZ   LYS   6          2HZ       LYS   6   6.567   4.557  14.991
   54   3HZ   LYS   6          3HZ       LYS   6   7.917   4.239  14.102
   55    H    GLU   7           H        GLU   7   8.012   6.167   7.746
   56    HA   GLU   7           HA       GLU   7   6.432   5.101   5.508
   57   1HB   GLU   7          2HB       GLU   7   9.382   4.638   5.693
   58   2HB   GLU   7          3HB       GLU   7   8.363   5.074   4.322
   59   1HG   GLU   7          2HG       GLU   7   9.696   6.938   4.576
   60   2HG   GLU   7          3HG       GLU   7   8.288   7.462   5.500
   61    H    ILE   8           H        ILE   8   6.363   2.903   5.127
   62    HA   ILE   8           HA       ILE   8   7.584   0.981   7.034
   63    HB   ILE   8           HB       ILE   8   5.287  -0.274   6.223
   64   1HG1  ILE   8          2HG1      ILE   8   4.447   1.885   5.178
   65   2HG1  ILE   8          3HG1      ILE   8   3.376   0.894   6.159
   66   1HG2  ILE   8          1HG2      ILE   8   6.102  -0.347   8.417
   67   2HG2  ILE   8          2HG2      ILE   8   5.665   1.358   8.682
   68   3HG2  ILE   8          3HG2      ILE   8   4.386   0.131   8.411
   69   1HD1  ILE   8          1HD1      ILE   8   3.324   3.389   6.703
   70   2HD1  ILE   8          2HD1      ILE   8   3.505   2.213   8.034
   71   3HD1  ILE   8          3HD1      ILE   8   4.889   3.140   7.479
   72    H    ALA   9           H        ALA   9   7.986  -1.129   5.925
   73    HA   ALA   9           HA       ALA   9   8.035  -0.974   2.958
   74   1HB   ALA   9          1HB       ALA   9  10.341  -1.805   2.976
   75   2HB   ALA   9          2HB       ALA   9  10.273  -0.258   3.850
   76   3HB   ALA   9          3HB       ALA   9  10.370  -1.769   4.753
   77    H    MET  10           H        MET  10   7.207  -2.886   2.122
   78    HA   MET  10           HA       MET  10   7.407  -5.371   3.686
   79   1HB   MET  10          2HB       MET  10   5.041  -5.613   4.087
   80   2HB   MET  10          3HB       MET  10   5.523  -4.046   4.720
   81   1HG   MET  10          2HG       MET  10   4.907  -3.355   2.164
   82   2HG   MET  10          3HG       MET  10   3.835  -4.733   2.361
   83   1HE   MET  10          1HE       MET  10   3.735  -0.612   4.363
   84   2HE   MET  10          2HE       MET  10   5.144  -1.704   4.488
   85   3HE   MET  10          3HE       MET  10   4.636  -1.079   2.905
   86    H    GLN  11           H        GLN  11   5.734  -7.015   2.514
   87    HA   GLN  11           HA       GLN  11   6.734  -7.084  -0.286
   88   1HB   GLN  11          2HB       GLN  11   5.994  -9.136   1.839
   89   2HB   GLN  11          3HB       GLN  11   6.110  -9.610   0.145
   90   1HG   GLN  11          2HG       GLN  11   8.291  -8.426   1.937
   91   2HG   GLN  11          3HG       GLN  11   8.192 -10.099   1.358
   92   1HE2  GLN  11          1HE2      GLN  11   7.525  -9.793  -1.302
   93   2HE2  GLN  11          2HE2      GLN  11   8.576  -8.658  -2.125
   94    H    VAL  12           H        VAL  12   5.274  -8.158  -1.866
   95    HA   VAL  12           HA       VAL  12   2.466  -7.166  -1.531
   96    HB   VAL  12           HB       VAL  12   4.218  -7.311  -4.021
   97   1HG1  VAL  12          1HG1      VAL  12   1.407  -6.198  -3.577
   98   2HG1  VAL  12          2HG1      VAL  12   2.396  -5.879  -5.014
   99   3HG1  VAL  12          3HG1      VAL  12   1.870  -7.522  -4.671
  100   1HG2  VAL  12          1HG2      VAL  12   4.132  -4.805  -3.873
  101   2HG2  VAL  12          2HG2      VAL  12   3.329  -4.970  -2.305
  102   3HG2  VAL  12          3HG2      VAL  12   5.007  -5.526  -2.520
  103    H    SER  13           H        SER  13   0.759  -8.438  -2.670
  104    HA   SER  13           HA       SER  13   1.553 -10.858  -4.057
  105   1HB   SER  13          2HB       SER  13   0.170 -10.967  -1.360
  106   2HB   SER  13          3HB       SER  13  -0.108 -12.231  -2.565
  107    HG   SER  13           HG       SER  13   2.525 -11.462  -1.942
  108    H    GLY  14           H        GLY  14  -0.468 -12.006  -4.867
  109   1HA   GLY  14          2HA       GLY  14  -2.302 -11.870  -6.255
  110   2HA   GLY  14          3HA       GLY  14  -2.938 -10.612  -5.180
  111    H    MET  15           H        MET  15  -0.251 -11.020  -7.582
  112    HA   MET  15           HA       MET  15  -0.983  -8.511  -8.916
  113   1HB   MET  15          2HB       MET  15   1.270  -7.587  -8.664
  114   2HB   MET  15          3HB       MET  15   0.510  -7.849  -7.093
  115   1HG   MET  15          2HG       MET  15   2.699  -8.503  -6.771
  116   2HG   MET  15          3HG       MET  15   1.849 -10.036  -6.949
  117   1HE   MET  15          1HE       MET  15   5.461 -10.688  -8.347
  118   2HE   MET  15          2HE       MET  15   5.006  -9.631  -6.991
  119   3HE   MET  15          3HE       MET  15   4.214 -11.215  -7.191
  120    H    THR  16           H        THR  16   0.425  -8.194 -10.831
  121    HA   THR  16           HA       THR  16   1.848 -10.532 -11.873
  122    HB   THR  16           HB       THR  16   0.579  -9.985 -14.160
  123    HG1  THR  16           1HG      THR  16  -1.430  -9.563 -12.205
  124   1HG2  THR  16          1HG2      THR  16  -0.573 -11.818 -12.014
  125   2HG2  THR  16          2HG2      THR  16  -0.944 -11.874 -13.745
  126   3HG2  THR  16          3HG2      THR  16   0.699 -12.212 -13.184
  127    H    CYS  17           H        CYS  17   0.569  -7.352 -13.086
  128    HA   CYS  17           HA       CYS  17   3.343  -6.777 -13.989
  129   1HB   CYS  17          2HB       CYS  17   2.488  -5.302 -15.559
  130   2HB   CYS  17          3HB       CYS  17   1.455  -6.732 -15.655
  131    H    ALA  18           H        ALA  18   4.338  -4.799 -13.576
  132    HA   ALA  18           HA       ALA  18   3.781  -3.651 -10.951
  133   1HB   ALA  18          1HB       ALA  18   5.867  -2.934 -13.049
  134   2HB   ALA  18          2HB       ALA  18   5.843  -2.397 -11.356
  135   3HB   ALA  18          3HB       ALA  18   6.078  -4.115 -11.738
  136    H    ALA  19           H        ALA  19   1.553  -3.221 -12.476
  137    HA   ALA  19           HA       ALA  19   1.548  -0.255 -12.757
  138   1HB   ALA  19          1HB       ALA  19   0.186  -2.056 -14.791
  139   2HB   ALA  19          2HB       ALA  19   0.251  -0.289 -14.765
  140   3HB   ALA  19          3HB       ALA  19   1.734  -1.220 -15.055
  141    H    CYS  20           H        CYS  20  -0.645  -3.199 -12.784
  142    HA   CYS  20           HA       CYS  20  -2.719  -1.868 -11.374
  143   1HB   CYS  20          2HB       CYS  20  -1.892  -4.802 -10.995
  144   2HB   CYS  20          3HB       CYS  20  -3.483  -4.077 -10.705
  145    H    ALA  21           H        ALA  21   0.254  -3.447 -10.287
  146    HA   ALA  21           HA       ALA  21  -0.092  -3.211  -7.524
  147   1HB   ALA  21          1HB       ALA  21   1.751  -4.372  -8.937
  148   2HB   ALA  21          2HB       ALA  21   2.583  -2.803  -8.880
  149   3HB   ALA  21          3HB       ALA  21   2.181  -3.684  -7.380
  150    H    ALA  22           H        ALA  22   0.346  -0.569  -9.812
  151    HA   ALA  22           HA       ALA  22   1.227   1.381  -7.806
  152   1HB   ALA  22          1HB       ALA  22  -0.015   1.807 -10.551
  153   2HB   ALA  22          2HB       ALA  22   0.849   2.995  -9.566
  154   3HB   ALA  22          3HB       ALA  22   1.732   1.617 -10.262
  155    H    ARG  23           H        ARG  23  -1.765   0.106  -9.245
  156    HA   ARG  23           HA       ARG  23  -3.444   2.323  -8.646
  157   1HB   ARG  23          2HB       ARG  23  -4.149  -0.618  -9.022
  158   2HB   ARG  23          3HB       ARG  23  -5.316   0.688  -8.959
  159   1HG   ARG  23          2HG       ARG  23  -3.043   0.814 -10.973
  160   2HG   ARG  23          3HG       ARG  23  -4.443  -0.202 -11.293
  161   1HD   ARG  23          2HD       ARG  23  -4.732   2.726 -10.537
  162   2HD   ARG  23          3HD       ARG  23  -4.497   2.184 -12.214
  163    HE   ARG  23           HE       ARG  23  -6.560   0.603 -11.295
  164   1HH1  ARG  23          2HH2      ARG  23  -6.051   4.072 -11.592
  165   2HH1  ARG  23          1HH2      ARG  23  -7.695   4.455 -12.002
  166   1HH2  ARG  23          2HH1      ARG  23  -8.746   1.049 -11.896
  167   2HH2  ARG  23          1HH1      ARG  23  -9.270   2.675 -12.172
  168    H    ILE  24           H        ILE  24  -2.540  -0.594  -6.752
  169    HA   ILE  24           HA       ILE  24  -4.395  -0.018  -4.722
  170    HB   ILE  24           HB       ILE  24  -2.712  -1.263  -3.170
  171   1HG1  ILE  24          2HG1      ILE  24  -1.945  -2.492  -5.838
  172   2HG1  ILE  24          3HG1      ILE  24  -1.008  -1.153  -5.197
  173   1HG2  ILE  24          1HG2      ILE  24  -4.300  -2.584  -5.394
  174   2HG2  ILE  24          2HG2      ILE  24  -3.650  -3.358  -3.929
  175   3HG2  ILE  24          3HG2      ILE  24  -4.868  -2.114  -3.771
  176   1HD1  ILE  24          1HD1      ILE  24  -1.465  -3.789  -3.733
  177   2HD1  ILE  24          2HD1      ILE  24   0.030  -3.286  -4.550
  178   3HD1  ILE  24          3HD1      ILE  24  -0.548  -2.427  -3.108
  179    H    GLU  25           H        GLU  25  -0.806   0.612  -4.304
  180    HA   GLU  25           HA       GLU  25  -0.878   2.365  -2.303
  181   1HB   GLU  25          2HB       GLU  25   0.804   2.157  -4.771
  182   2HB   GLU  25          3HB       GLU  25   1.054   3.561  -3.731
  183   1HG   GLU  25          2HG       GLU  25   2.509   1.524  -3.197
  184   2HG   GLU  25          3HG       GLU  25   1.615   2.136  -1.811
  185    H    LYS  26           H        LYS  26  -1.689   3.293  -5.649
  186    HA   LYS  26           HA       LYS  26  -1.903   6.129  -4.925
  187   1HB   LYS  26          2HB       LYS  26  -2.392   4.516  -7.417
  188   2HB   LYS  26          3HB       LYS  26  -3.003   6.168  -7.290
  189   1HG   LYS  26          2HG       LYS  26  -0.731   5.966  -8.363
  190   2HG   LYS  26          3HG       LYS  26  -0.856   7.107  -7.014
  191   1HD   LYS  26          2HD       LYS  26   0.233   5.463  -5.515
  192   2HD   LYS  26          3HD       LYS  26   0.357   4.323  -6.876
  193   1HE   LYS  26          2HE       LYS  26   1.829   5.901  -8.070
  194   2HE   LYS  26          3HE       LYS  26   1.560   7.140  -6.829
  195   1HZ   LYS  26          1HZ       LYS  26   3.637   6.054  -6.488
  196   2HZ   LYS  26          2HZ       LYS  26   2.643   5.720  -5.230
  197   3HZ   LYS  26          3HZ       LYS  26   2.917   4.577  -6.380
  198    H    GLY  27           H        GLY  27  -4.200   3.401  -5.101
  199   1HA   GLY  27          2HA       GLY  27  -6.523   5.050  -4.499
  200   2HA   GLY  27          3HA       GLY  27  -6.388   3.298  -4.360
  201    H    LEU  28           H        LEU  28  -3.945   3.459  -2.635
  202    HA   LEU  28           HA       LEU  28  -5.234   3.729  -0.032
  203   1HB   LEU  28          2HB       LEU  28  -2.494   3.050  -1.016
  204   2HB   LEU  28          3HB       LEU  28  -2.664   3.598   0.640
  205    HG   LEU  28           HG       LEU  28  -3.992   1.762   1.291
  206   1HD1  LEU  28          1HD1      LEU  28  -4.253   0.803  -1.557
  207   2HD1  LEU  28          2HD1      LEU  28  -4.855   0.028  -0.090
  208   3HD1  LEU  28          3HD1      LEU  28  -5.544   1.571  -0.604
  209   1HD2  LEU  28          1HD2      LEU  28  -1.909   0.740  -0.694
  210   2HD2  LEU  28          2HD2      LEU  28  -1.538   1.348   0.928
  211   3HD2  LEU  28          3HD2      LEU  28  -2.518  -0.121   0.731
  212    H    LYS  29           H        LYS  29  -2.845   5.725  -1.844
  213    HA   LYS  29           HA       LYS  29  -2.515   7.816  -0.029
  214   1HB   LYS  29          2HB       LYS  29  -1.303   7.634  -2.138
  215   2HB   LYS  29          3HB       LYS  29  -2.783   7.965  -3.057
  216   1HG   LYS  29          2HG       LYS  29  -2.928  10.215  -2.076
  217   2HG   LYS  29          3HG       LYS  29  -1.515   9.874  -1.066
  218   1HD   LYS  29          2HD       LYS  29  -0.151   9.552  -3.150
  219   2HD   LYS  29          3HD       LYS  29  -1.560   9.968  -4.127
  220   1HE   LYS  29          2HE       LYS  29  -0.007  11.760  -2.189
  221   2HE   LYS  29          3HE       LYS  29  -0.054  11.885  -3.934
  222   1HZ   LYS  29          1HZ       LYS  29  -2.412  12.438  -3.735
  223   2HZ   LYS  29          2HZ       LYS  29  -2.302  12.341  -2.087
  224   3HZ   LYS  29          3HZ       LYS  29  -1.459  13.492  -2.898
  225    H    ARG  30           H        ARG  30  -5.359   7.087  -1.966
  226    HA   ARG  30           HA       ARG  30  -6.674   9.643  -1.481
  227   1HB   ARG  30          2HB       ARG  30  -7.260   7.069  -2.898
  228   2HB   ARG  30          3HB       ARG  30  -8.653   7.985  -2.355
  229   1HG   ARG  30          2HG       ARG  30  -7.909   9.964  -3.534
  230   2HG   ARG  30          3HG       ARG  30  -6.377   9.183  -3.995
  231   1HD   ARG  30          2HD       ARG  30  -7.465   7.616  -5.413
  232   2HD   ARG  30          3HD       ARG  30  -9.069   7.991  -4.726
  233    HE   ARG  30           HE       ARG  30  -8.016  10.365  -5.855
  234   1HH1  ARG  30          2HH2      ARG  30  -9.180   7.217  -6.882
  235   2HH1  ARG  30          1HH2      ARG  30  -9.956   7.771  -8.335
  236   1HH2  ARG  30          2HH1      ARG  30  -9.043  11.176  -7.780
  237   2HH2  ARG  30          1HH1      ARG  30  -9.841  10.090  -8.867
  238    H    MET  31           H        MET  31  -6.063   7.159   0.714
  239    HA   MET  31           HA       MET  31  -8.724   7.289   1.992
  240   1HB   MET  31          2HB       MET  31  -6.219   5.689   2.675
  241   2HB   MET  31          3HB       MET  31  -7.785   5.493   3.444
  242   1HG   MET  31          2HG       MET  31  -7.161   5.022   0.508
  243   2HG   MET  31          3HG       MET  31  -7.385   3.803   1.735
  244   1HE   MET  31          1HE       MET  31 -10.132   4.957   3.282
  245   2HE   MET  31          2HE       MET  31 -11.282   3.993   2.350
  246   3HE   MET  31          3HE       MET  31  -9.739   3.286   2.877
  247    HA   PRO  32           HA       PRO  32  -7.407  10.284   5.007
  248   1HB   PRO  32          2HB       PRO  32  -8.622   9.395   7.316
  249   2HB   PRO  32          3HB       PRO  32  -9.509  10.176   5.976
  250   1HG   PRO  32          2HG       PRO  32  -9.159   7.210   6.469
  251   2HG   PRO  32          3HG       PRO  32 -10.688   8.088   6.164
  252   1HD   PRO  32          2HD       PRO  32  -9.405   6.827   4.180
  253   2HD   PRO  32          3HD       PRO  32 -10.106   8.434   3.859
  254    H    GLY  33           H        GLY  33  -5.692  10.472   6.479
  255   1HA   GLY  33          2HA       GLY  33  -4.040   9.770   7.933
  256   2HA   GLY  33          3HA       GLY  33  -4.532   8.081   7.707
  257    H    VAL  34           H        VAL  34  -4.347   8.299   4.672
  258    HA   VAL  34           HA       VAL  34  -1.430   7.797   4.602
  259    HB   VAL  34           HB       VAL  34  -3.455   7.401   2.398
  260   1HG1  VAL  34          1HG1      VAL  34  -0.691   6.192   2.929
  261   2HG1  VAL  34          2HG1      VAL  34  -1.735   5.820   1.547
  262   3HG1  VAL  34          3HG1      VAL  34  -1.041   7.437   1.722
  263   1HG2  VAL  34          1HG2      VAL  34  -3.389   4.969   3.105
  264   2HG2  VAL  34          2HG2      VAL  34  -2.553   5.483   4.590
  265   3HG2  VAL  34          3HG2      VAL  34  -4.213   6.021   4.261
  266    H    THR  35           H        THR  35   0.014   9.113   3.506
  267    HA   THR  35           HA       THR  35  -1.157  11.558   2.218
  268    HB   THR  35           HB       THR  35   1.011  11.233   4.153
  269    HG1  THR  35           1HG      THR  35  -0.630  13.387   3.338
  270   1HG2  THR  35          1HG2      THR  35   2.151  13.301   3.326
  271   2HG2  THR  35          2HG2      THR  35   2.470  11.848   2.372
  272   3HG2  THR  35          3HG2      THR  35   1.337  13.090   1.768
  273    H    ASP  36           H        ASP  36   1.371   8.969   1.866
  274    HA   ASP  36           HA       ASP  36   0.908   9.161  -0.981
  275   1HB   ASP  36          2HB       ASP  36   3.422  10.253   0.251
  276   2HB   ASP  36          3HB       ASP  36   3.669   9.089  -1.047
  277    H    ALA  37           H        ALA  37   2.072   7.343  -2.078
  278    HA   ALA  37           HA       ALA  37   3.107   5.266  -0.390
  279   1HB   ALA  37          1HB       ALA  37   1.358   3.684  -0.474
  280   2HB   ALA  37          2HB       ALA  37   0.505   5.172  -0.110
  281   3HB   ALA  37          3HB       ALA  37   0.499   4.567  -1.768
  282    H    ASN  38           H        ASN  38   4.130   3.595  -1.619
  283    HA   ASN  38           HA       ASN  38   4.513   4.202  -4.495
  284   1HB   ASN  38          2HB       ASN  38   7.067   3.904  -3.065
  285   2HB   ASN  38          3HB       ASN  38   6.583   5.022  -4.326
  286   1HD2  ASN  38          1HD2      ASN  38   6.219   4.382  -0.799
  287   2HD2  ASN  38          2HD2      ASN  38   6.324   6.082  -0.350
  288    H    VAL  39           H        VAL  39   4.308   2.287  -5.476
  289    HA   VAL  39           HA       VAL  39   5.114  -0.174  -4.097
  290    HB   VAL  39           HB       VAL  39   3.017   0.100  -5.450
  291   1HG1  VAL  39          1HG1      VAL  39   3.091  -0.159  -7.850
  292   2HG1  VAL  39          2HG1      VAL  39   4.050   1.268  -7.446
  293   3HG1  VAL  39          3HG1      VAL  39   4.838  -0.272  -7.874
  294   1HG2  VAL  39          1HG2      VAL  39   4.921  -2.142  -6.179
  295   2HG2  VAL  39          2HG2      VAL  39   3.941  -2.046  -4.700
  296   3HG2  VAL  39          3HG2      VAL  39   3.145  -2.161  -6.264
  297    H    ASN  40           H        ASN  40   7.163  -0.911  -4.143
  298    HA   ASN  40           HA       ASN  40   8.987   0.086  -6.292
  299   1HB   ASN  40          2HB       ASN  40   9.560   0.692  -3.930
  300   2HB   ASN  40          3HB       ASN  40   9.684  -1.033  -3.553
  301   1HD2  ASN  40          1HD2      ASN  40  11.950   0.122  -3.007
  302   2HD2  ASN  40          2HD2      ASN  40  13.131  -0.015  -4.300
  303    H    LEU  41           H        LEU  41   7.302  -1.580  -7.212
  304    HA   LEU  41           HA       LEU  41   7.745  -4.360  -6.698
  305   1HB   LEU  41          2HB       LEU  41   5.863  -2.810  -8.146
  306   2HB   LEU  41          3HB       LEU  41   6.678  -3.756  -9.374
  307    HG   LEU  41           HG       LEU  41   4.621  -4.807  -8.532
  308   1HD1  LEU  41          1HD1      LEU  41   7.089  -6.437  -7.851
  309   2HD1  LEU  41          2HD1      LEU  41   5.471  -7.057  -8.219
  310   3HD1  LEU  41          3HD1      LEU  41   6.396  -6.206  -9.465
  311   1HD2  LEU  41          1HD2      LEU  41   5.102  -5.993  -6.122
  312   2HD2  LEU  41          2HD2      LEU  41   5.796  -4.391  -5.834
  313   3HD2  LEU  41          3HD2      LEU  41   4.128  -4.544  -6.373
  314    H    ALA  42           H        ALA  42   9.442  -2.043  -8.612
  315    HA   ALA  42           HA       ALA  42  10.999  -3.574 -10.340
  316   1HB   ALA  42          1HB       ALA  42  12.772  -1.945  -9.887
  317   2HB   ALA  42          2HB       ALA  42  11.203  -1.111 -10.037
  318   3HB   ALA  42          3HB       ALA  42  11.927  -1.399  -8.430
  319    H    THR  43           H        THR  43  11.106  -3.439  -6.749
  320    HA   THR  43           HA       THR  43  12.877  -5.810  -6.884
  321    HB   THR  43           HB       THR  43  14.268  -3.955  -6.220
  322    HG1  THR  43           1HG      THR  43  13.625  -5.818  -4.196
  323   1HG2  THR  43          1HG2      THR  43  13.996  -2.716  -4.195
  324   2HG2  THR  43          2HG2      THR  43  12.451  -2.607  -5.054
  325   3HG2  THR  43          3HG2      THR  43  12.620  -3.695  -3.667
  326    H    GLU  44           H        GLU  44  10.075  -5.764  -6.935
  327    HA   GLU  44           HA       GLU  44   8.209  -6.599  -5.930
  328   1HB   GLU  44          2HB       GLU  44  10.431  -8.408  -4.898
  329   2HB   GLU  44          3HB       GLU  44   8.713  -8.813  -4.850
  330   1HG   GLU  44          2HG       GLU  44   8.528  -8.617  -7.292
  331   2HG   GLU  44          3HG       GLU  44  10.246  -8.199  -7.407
  332    H    THR  45           H        THR  45   9.152  -4.314  -4.366
  333    HA   THR  45           HA       THR  45   8.265  -5.120  -1.631
  334    HB   THR  45           HB       THR  45  10.352  -3.084  -2.545
  335    HG1  THR  45           1HG      THR  45  10.993  -5.332  -2.642
  336   1HG2  THR  45          1HG2      THR  45   9.469  -3.970   0.221
  337   2HG2  THR  45          2HG2      THR  45  10.899  -2.969  -0.123
  338   3HG2  THR  45          3HG2      THR  45   9.282  -2.336  -0.481
  339    H    VAL  46           H        VAL  46   7.030  -3.397  -0.520
  340    HA   VAL  46           HA       VAL  46   6.226  -1.096  -2.211
  341    HB   VAL  46           HB       VAL  46   4.482  -2.773  -2.474
  342   1HG1  VAL  46          1HG1      VAL  46   3.023  -3.457  -0.641
  343   2HG1  VAL  46          2HG1      VAL  46   4.681  -3.955  -0.251
  344   3HG1  VAL  46          3HG1      VAL  46   3.956  -2.498   0.497
  345   1HG2  VAL  46          1HG2      VAL  46   3.887  -0.305  -2.365
  346   2HG2  VAL  46          2HG2      VAL  46   2.609  -1.465  -1.975
  347   3HG2  VAL  46          3HG2      VAL  46   3.415  -0.556  -0.681
  348    H    ASN  47           H        ASN  47   5.806   0.788  -1.128
  349    HA   ASN  47           HA       ASN  47   6.424   0.848   1.774
  350   1HB   ASN  47          2HB       ASN  47   7.441   2.626  -0.503
  351   2HB   ASN  47          3HB       ASN  47   7.524   3.105   1.196
  352   1HD2  ASN  47          1HD2      ASN  47   8.616   1.439   2.696
  353   2HD2  ASN  47          2HD2      ASN  47  10.145   0.841   2.059
  354    H    VAL  48           H        VAL  48   5.041   2.343   2.973
  355    HA   VAL  48           HA       VAL  48   3.051   3.799   1.307
  356    HB   VAL  48           HB       VAL  48   2.388   2.135   3.738
  357   1HG1  VAL  48          1HG1      VAL  48   0.172   2.706   3.328
  358   2HG1  VAL  48          2HG1      VAL  48   1.006   4.230   2.997
  359   3HG1  VAL  48          3HG1      VAL  48   0.466   3.202   1.656
  360   1HG2  VAL  48          1HG2      VAL  48   1.920   1.408   0.822
  361   2HG2  VAL  48          2HG2      VAL  48   2.930   0.524   1.984
  362   3HG2  VAL  48          3HG2      VAL  48   1.183   0.597   2.216
  363    H    ILE  49           H        ILE  49   2.982   5.907   2.009
  364    HA   ILE  49           HA       ILE  49   4.543   6.537   4.430
  365    HB   ILE  49           HB       ILE  49   3.821   8.370   2.101
  366   1HG1  ILE  49          2HG1      ILE  49   5.146   6.652   1.139
  367   2HG1  ILE  49          3HG1      ILE  49   6.127   8.104   1.317
  368   1HG2  ILE  49          1HG2      ILE  49   5.670   9.751   3.000
  369   2HG2  ILE  49          2HG2      ILE  49   4.310   9.591   4.118
  370   3HG2  ILE  49          3HG2      ILE  49   5.789   8.659   4.398
  371   1HD1  ILE  49          1HD1      ILE  49   7.468   6.180   1.925
  372   2HD1  ILE  49          2HD1      ILE  49   7.141   7.113   3.397
  373   3HD1  ILE  49          3HD1      ILE  49   6.249   5.613   3.074
  374    H    TYR  50           H        TYR  50   3.131   6.797   6.156
  375    HA   TYR  50           HA       TYR  50   0.643   8.349   5.716
  376   1HB   TYR  50          2HB       TYR  50  -0.757   6.663   6.650
  377   2HB   TYR  50          3HB       TYR  50  -0.015   6.098   5.183
  378    HD1  TYR  50           HD1      TYR  50   0.542   5.907   8.938
  379    HD2  TYR  50           HD2      TYR  50   0.665   3.882   5.156
  380    HE1  TYR  50           HE1      TYR  50   1.032   3.803  10.084
  381    HE2  TYR  50           HE2      TYR  50   0.760   1.705   6.332
  382    HH   TYR  50           HH       TYR  50   1.258   1.464   9.798
  383    H    ASP  51           H        ASP  51  -0.527   8.703   7.664
  384    HA   ASP  51           HA       ASP  51   1.290   9.429   9.811
  385   1HB   ASP  51          2HB       ASP  51  -1.690   9.875   9.817
  386   2HB   ASP  51          3HB       ASP  51  -0.401  10.666  10.767
  387    HA   PRO  52           HA       PRO  52   0.074   5.492  11.770
  388   1HB   PRO  52          2HB       PRO  52   1.922   5.339  13.753
  389   2HB   PRO  52          3HB       PRO  52   2.311   5.055  12.033
  390   1HG   PRO  52          2HG       PRO  52   2.635   7.647  13.577
  391   2HG   PRO  52          3HG       PRO  52   3.873   6.802  12.597
  392   1HD   PRO  52          2HD       PRO  52   2.425   8.817  11.582
  393   2HD   PRO  52          3HD       PRO  52   2.794   7.386  10.573
  394    H    ALA  53           H        ALA  53  -0.707   8.563  12.669
  395    HA   ALA  53           HA       ALA  53  -1.743   7.944  15.365
  396   1HB   ALA  53          1HB       ALA  53  -1.855  10.421  13.589
  397   2HB   ALA  53          2HB       ALA  53  -2.505  10.292  15.238
  398   3HB   ALA  53          3HB       ALA  53  -0.753  10.177  14.965
  399    H    GLU  54           H        GLU  54  -2.513   7.925  11.935
  400    HA   GLU  54           HA       GLU  54  -5.415   7.853  12.516
  401   1HB   GLU  54          2HB       GLU  54  -3.883   9.599  10.813
  402   2HB   GLU  54          3HB       GLU  54  -4.870   8.553   9.790
  403   1HG   GLU  54          2HG       GLU  54  -6.041  10.098  12.123
  404   2HG   GLU  54          3HG       GLU  54  -5.922  10.737  10.476
  405    H    THR  55           H        THR  55  -2.952   6.770  10.126
  406    HA   THR  55           HA       THR  55  -4.349   4.155  10.027
  407    HB   THR  55           HB       THR  55  -2.871   3.674   7.945
  408    HG1  THR  55           1HG      THR  55  -3.169   6.425   7.843
  409   1HG2  THR  55          1HG2      THR  55  -5.247   3.746   8.030
  410   2HG2  THR  55          2HG2      THR  55  -5.274   5.529   7.974
  411   3HG2  THR  55          3HG2      THR  55  -4.648   4.607   6.583
  412    H    GLY  56           H        GLY  56  -1.984   2.644   9.333
  413   1HA   GLY  56          2HA       GLY  56  -0.431   1.741  11.228
  414   2HA   GLY  56          3HA       GLY  56  -1.836   2.151  12.227
  415    H    THR  57           H        THR  57  -0.872   0.542   9.499
  416    HA   THR  57           HA       THR  57  -1.644  -0.307   7.740
  417    HB   THR  57           HB       THR  57  -1.337  -2.781   7.882
  418    HG1  THR  57           1HG      THR  57  -0.898  -3.611   9.990
  419   1HG2  THR  57          1HG2      THR  57   0.952  -2.781   8.709
  420   2HG2  THR  57          2HG2      THR  57   0.664  -1.272   7.823
  421   3HG2  THR  57          3HG2      THR  57   0.690  -1.277   9.604
  422    H    ALA  58           H        ALA  58  -3.839  -1.040  10.332
  423    HA   ALA  58           HA       ALA  58  -5.965  -2.379   9.549
  424   1HB   ALA  58          1HB       ALA  58  -7.283  -0.473  10.543
  425   2HB   ALA  58          2HB       ALA  58  -5.814  -0.871  11.475
  426   3HB   ALA  58          3HB       ALA  58  -5.812   0.532  10.404
  427    H    ALA  59           H        ALA  59  -5.335   0.883   8.152
  428    HA   ALA  59           HA       ALA  59  -7.919   0.554   6.683
  429   1HB   ALA  59          1HB       ALA  59  -5.975   2.798   6.206
  430   2HB   ALA  59          2HB       ALA  59  -7.695   2.725   5.821
  431   3HB   ALA  59          3HB       ALA  59  -7.206   2.811   7.522
  432    H    ILE  60           H        ILE  60  -4.487   0.578   6.029
  433    HA   ILE  60           HA       ILE  60  -4.493   0.340   3.214
  434    HB   ILE  60           HB       ILE  60  -2.593  -0.284   5.495
  435   1HG1  ILE  60          2HG1      ILE  60  -1.158   1.113   3.854
  436   2HG1  ILE  60          3HG1      ILE  60  -2.671   1.453   3.026
  437   1HG2  ILE  60          1HG2      ILE  60  -2.013  -1.226   2.681
  438   2HG2  ILE  60          2HG2      ILE  60  -0.860  -1.099   4.032
  439   3HG2  ILE  60          3HG2      ILE  60  -2.187  -2.245   4.132
  440   1HD1  ILE  60          1HD1      ILE  60  -3.542   2.497   5.134
  441   2HD1  ILE  60          2HD1      ILE  60  -2.069   1.986   5.993
  442   3HD1  ILE  60          3HD1      ILE  60  -1.975   3.203   4.712
  443    H    GLN  61           H        GLN  61  -4.506  -2.187   5.754
  444    HA   GLN  61           HA       GLN  61  -4.476  -4.276   3.836
  445   1HB   GLN  61          2HB       GLN  61  -4.049  -4.044   6.508
  446   2HB   GLN  61          3HB       GLN  61  -5.557  -4.963   6.504
  447   1HG   GLN  61          2HG       GLN  61  -4.516  -6.787   5.375
  448   2HG   GLN  61          3HG       GLN  61  -3.201  -5.785   4.743
  449   1HE2  GLN  61          1HE2      GLN  61  -1.730  -4.725   6.389
  450   2HE2  GLN  61          2HE2      GLN  61  -1.297  -5.721   7.775
  451    H    GLU  62           H        GLU  62  -7.168  -2.799   5.719
  452    HA   GLU  62           HA       GLU  62  -9.380  -4.188   4.707
  453   1HB   GLU  62          2HB       GLU  62  -8.795  -1.399   5.665
  454   2HB   GLU  62          3HB       GLU  62 -10.254  -1.568   4.718
  455   1HG   GLU  62          2HG       GLU  62  -9.634  -3.316   7.132
  456   2HG   GLU  62          3HG       GLU  62 -10.563  -1.810   7.203
  457    H    LYS  63           H        LYS  63  -7.813  -1.282   3.235
  458    HA   LYS  63           HA       LYS  63  -9.464  -1.354   0.949
  459   1HB   LYS  63          2HB       LYS  63  -6.955   0.056   1.846
  460   2HB   LYS  63          3HB       LYS  63  -7.436   0.154   0.182
  461   1HG   LYS  63          2HG       LYS  63  -9.377   0.711   2.461
  462   2HG   LYS  63          3HG       LYS  63  -8.315   1.935   1.779
  463   1HD   LYS  63          2HD       LYS  63 -10.475   0.423   0.212
  464   2HD   LYS  63          3HD       LYS  63 -10.581   2.062   0.818
  465   1HE   LYS  63          2HE       LYS  63  -8.210   2.218  -0.604
  466   2HE   LYS  63          3HE       LYS  63  -9.073   0.962  -1.519
  467   1HZ   LYS  63          1HZ       LYS  63 -10.871   2.544  -1.786
  468   2HZ   LYS  63          2HZ       LYS  63 -10.033   3.652  -0.876
  469   3HZ   LYS  63          3HZ       LYS  63  -9.450   3.180  -2.340
  470    H    ILE  64           H        ILE  64  -6.260  -2.763   1.610
  471    HA   ILE  64           HA       ILE  64  -5.323  -3.160  -0.930
  472    HB   ILE  64           HB       ILE  64  -4.876  -4.195   1.747
  473   1HG1  ILE  64          2HG1      ILE  64  -3.640  -2.348   0.595
  474   2HG1  ILE  64          3HG1      ILE  64  -2.669  -3.609   1.350
  475   1HG2  ILE  64          1HG2      ILE  64  -3.343  -6.001   1.030
  476   2HG2  ILE  64          2HG2      ILE  64  -5.066  -6.365   0.930
  477   3HG2  ILE  64          3HG2      ILE  64  -4.157  -5.973  -0.554
  478   1HD1  ILE  64          1HD1      ILE  64  -2.293  -4.674  -0.849
  479   2HD1  ILE  64          2HD1      ILE  64  -3.261  -3.408  -1.625
  480   3HD1  ILE  64          3HD1      ILE  64  -1.740  -2.990  -0.804
  481    H    GLU  65           H        GLU  65  -7.317  -5.284   1.211
  482    HA   GLU  65           HA       GLU  65  -7.994  -7.366  -0.588
  483   1HB   GLU  65          2HB       GLU  65  -9.359  -6.166   1.855
  484   2HB   GLU  65          3HB       GLU  65 -10.052  -7.529   0.975
  485   1HG   GLU  65          2HG       GLU  65  -7.193  -7.657   1.942
  486   2HG   GLU  65          3HG       GLU  65  -8.546  -8.018   3.022
  487    H    LYS  66           H        LYS  66  -9.952  -4.462   0.292
  488    HA   LYS  66           HA       LYS  66 -12.044  -4.914  -1.518
  489   1HB   LYS  66          2HB       LYS  66 -10.955  -2.588  -0.024
  490   2HB   LYS  66          3HB       LYS  66 -11.930  -2.142  -1.415
  491   1HG   LYS  66          2HG       LYS  66 -12.918  -4.181   0.609
  492   2HG   LYS  66          3HG       LYS  66 -13.081  -2.444   0.894
  493   1HD   LYS  66          2HD       LYS  66 -14.298  -2.129  -1.205
  494   2HD   LYS  66          3HD       LYS  66 -14.114  -3.845  -1.620
  495   1HE   LYS  66          2HE       LYS  66 -15.460  -4.501   0.337
  496   2HE   LYS  66          3HE       LYS  66 -15.574  -2.814   0.866
  497   1HZ   LYS  66          1HZ       LYS  66 -16.686  -3.877  -1.649
  498   2HZ   LYS  66          2HZ       LYS  66 -17.543  -3.534  -0.289
  499   3HZ   LYS  66          3HZ       LYS  66 -16.811  -2.321  -1.121
  500    H    LEU  67           H        LEU  67  -8.937  -3.402  -2.196
  501    HA   LEU  67           HA       LEU  67  -9.578  -2.464  -4.851
  502   1HB   LEU  67          2HB       LEU  67  -7.008  -2.903  -3.332
  503   2HB   LEU  67          3HB       LEU  67  -7.040  -2.246  -4.975
  504    HG   LEU  67           HG       LEU  67  -8.732  -0.982  -2.806
  505   1HD1  LEU  67          1HD1      LEU  67  -6.998   0.554  -2.203
  506   2HD1  LEU  67          2HD1      LEU  67  -6.405  -1.096  -1.926
  507   3HD1  LEU  67          3HD1      LEU  67  -5.888  -0.172  -3.338
  508   1HD2  LEU  67          1HD2      LEU  67  -9.086  -0.273  -5.183
  509   2HD2  LEU  67          2HD2      LEU  67  -8.452   1.042  -4.182
  510   3HD2  LEU  67          3HD2      LEU  67  -7.370   0.168  -5.282
  511    H    GLY  68           H        GLY  68  -8.869  -5.589  -3.535
  512   1HA   GLY  68          2HA       GLY  68  -9.039  -7.592  -4.644
  513   2HA   GLY  68          3HA       GLY  68  -8.875  -6.793  -6.215
  514    H    TYR  69           H        TYR  69  -6.748  -6.553  -3.282
  515    HA   TYR  69           HA       TYR  69  -4.519  -7.878  -4.755
  516   1HB   TYR  69          2HB       TYR  69  -4.946  -5.076  -4.140
  517   2HB   TYR  69          3HB       TYR  69  -3.605  -5.656  -3.168
  518    HD1  TYR  69           HD1      TYR  69  -1.477  -6.180  -4.166
  519    HD2  TYR  69           HD2      TYR  69  -4.906  -5.375  -6.651
  520    HE1  TYR  69           HE1      TYR  69  -0.004  -5.868  -6.095
  521    HE2  TYR  69           HE2      TYR  69  -3.452  -5.341  -8.639
  522    HH   TYR  69           HH       TYR  69   0.095  -5.806  -8.412
  523    H    HIS  70           H        HIS  70  -2.604  -8.113  -3.069
  524    HA   HIS  70           HA       HIS  70  -3.586  -8.256  -0.314
  525   1HB   HIS  70          2HB       HIS  70  -3.944 -10.501  -1.464
  526   2HB   HIS  70          3HB       HIS  70  -2.193 -10.634  -1.588
  527    HD1  HIS  70           1HD      HIS  70  -2.680 -12.896  -0.059
  528    HD2  HIS  70           2HD      HIS  70  -3.614  -9.204   1.729
  529    HE1  HIS  70           1HE      HIS  70  -3.036 -13.344   2.425
  530    H    VAL  71           H        VAL  71  -1.717  -8.381   1.232
  531    HA   VAL  71           HA       VAL  71   0.844  -7.475   0.089
  532    HB   VAL  71           HB       VAL  71  -0.635  -5.493   0.622
  533   1HG1  VAL  71          1HG1      VAL  71  -1.035  -4.847   2.916
  534   2HG1  VAL  71          2HG1      VAL  71  -1.749  -6.452   2.675
  535   3HG1  VAL  71          3HG1      VAL  71  -0.207  -6.284   3.536
  536   1HG2  VAL  71          1HG2      VAL  71   1.785  -5.290   0.537
  537   2HG2  VAL  71          2HG2      VAL  71   1.114  -4.249   1.800
  538   3HG2  VAL  71          3HG2      VAL  71   1.896  -5.783   2.248
  539    H    VAL  72           H        VAL  72   2.596  -8.110   1.412
  540    HA   VAL  72           HA       VAL  72   1.867 -10.098   3.510
  541    HB   VAL  72           HB       VAL  72   4.272 -10.324   1.804
  542   1HG1  VAL  72          1HG1      VAL  72   2.687 -12.340   3.451
  543   2HG1  VAL  72          2HG1      VAL  72   4.191 -12.664   2.567
  544   3HG1  VAL  72          3HG1      VAL  72   4.204 -11.567   3.954
  545   1HG2  VAL  72          1HG2      VAL  72   1.550 -11.586   1.280
  546   2HG2  VAL  72          2HG2      VAL  72   2.406 -10.443   0.217
  547   3HG2  VAL  72          3HG2      VAL  72   3.070 -12.058   0.488
  548    H    ILE  73           H        ILE  73   2.857  -9.893   5.370
  549    HA   ILE  73           HA       ILE  73   4.435  -7.394   5.806
  550    HB   ILE  73           HB       ILE  73   2.724  -8.929   7.766
  551   1HG1  ILE  73          2HG1      ILE  73   1.274  -7.968   6.069
  552   2HG1  ILE  73          3HG1      ILE  73   1.166  -7.051   7.563
  553   1HG2  ILE  73          1HG2      ILE  73   2.965  -6.763   9.068
  554   2HG2  ILE  73          2HG2      ILE  73   4.448  -7.709   8.944
  555   3HG2  ILE  73          3HG2      ILE  73   4.237  -6.287   7.917
  556   1HD1  ILE  73          1HD1      ILE  73   2.656  -5.288   6.584
  557   2HD1  ILE  73          2HD1      ILE  73   2.660  -6.191   5.050
  558   3HD1  ILE  73          3HD1      ILE  73   1.152  -5.531   5.688
  559    H    GLU  74           H        GLU  74   6.229  -8.714   4.944
  560    HA   GLU  74           HA       GLU  74   7.294 -10.794   6.438
  561   1HB   GLU  74          2HB       GLU  74   7.912  -9.455   4.021
  562   2HB   GLU  74          3HB       GLU  74   9.393  -9.647   4.969
  563   1HG   GLU  74          2HG       GLU  74   9.156 -11.580   3.547
  564   2HG   GLU  74          3HG       GLU  74   8.847 -12.098   5.210
  565    H    GLY  75           H        GLY  75   7.073  -7.832   7.526
  566   1HA   GLY  75          2HA       GLY  75   8.001  -6.670   9.319
  567   2HA   GLY  75          3HA       GLY  75   8.958  -8.118   9.676
  568    H    ARG  76           H        ARG  76   8.825  -5.156   7.627
  569    HA   ARG  76           HA       ARG  76  11.706  -4.935   7.678
  570   1HB   ARG  76          2HB       ARG  76  10.250  -5.672   5.220
  571   2HB   ARG  76          3HB       ARG  76  10.828  -4.018   5.117
  572   1HG   ARG  76          2HG       ARG  76  12.608  -5.223   4.241
  573   2HG   ARG  76          3HG       ARG  76  13.109  -4.873   5.894
  574   1HD   ARG  76          2HD       ARG  76  11.876  -7.327   6.248
  575   2HD   ARG  76          3HD       ARG  76  12.330  -7.462   4.572
  576    HE   ARG  76           HE       ARG  76  14.593  -7.418   5.085
  577   1HH1  ARG  76          2HH2      ARG  76  12.666  -7.147   8.088
  578   2HH1  ARG  76          1HH2      ARG  76  14.037  -7.263   9.126
  579   1HH2  ARG  76          2HH1      ARG  76  16.398  -7.626   6.493
  580   2HH2  ARG  76          1HH1      ARG  76  16.180  -7.595   8.212
  Start of MODEL   22
    1   1H    MET   1          H1        MET   1   1.930  21.659  15.838
    2   2H    MET   1          H2        MET   1   2.494  22.554  14.546
    3   3H    MET   1          H3        MET   1   0.907  22.070  14.631
    4    HA   MET   1           HA       MET   1   1.902  20.574  13.149
    5   1HB   MET   1          2HB       MET   1   4.005  20.370  15.350
    6   2HB   MET   1          3HB       MET   1   3.839  19.162  14.071
    7   1HG   MET   1          2HG       MET   1   4.312  20.778  12.346
    8   2HG   MET   1          3HG       MET   1   4.333  22.113  13.511
    9   1HE   MET   1          1HE       MET   1   6.600  22.927  12.462
   10   2HE   MET   1          2HE       MET   1   8.047  21.902  12.339
   11   3HE   MET   1          3HE       MET   1   6.621  21.542  11.340
   12    H    LEU   2           H        LEU   2   1.193  18.355  13.212
   13    HA   LEU   2           HA       LEU   2   0.711  16.891  15.561
   14   1HB   LEU   2          2HB       LEU   2  -1.370  18.676  15.228
   15   2HB   LEU   2          3HB       LEU   2  -1.862  17.432  14.086
   16    HG   LEU   2           HG       LEU   2  -1.343  15.808  16.175
   17   1HD1  LEU   2          1HD1      LEU   2  -2.062  18.450  17.524
   18   2HD1  LEU   2          2HD1      LEU   2  -1.867  16.874  18.314
   19   3HD1  LEU   2          3HD1      LEU   2  -0.462  17.681  17.592
   20   1HD2  LEU   2          1HD2      LEU   2  -3.841  17.530  15.940
   21   2HD2  LEU   2          2HD2      LEU   2  -3.521  16.000  15.091
   22   3HD2  LEU   2          3HD2      LEU   2  -3.706  16.011  16.854
   23    H    SER   3           H        SER   3  -0.485  14.755  14.646
   24    HA   SER   3           HA       SER   3  -0.400  13.032  13.215
   25   1HB   SER   3          2HB       SER   3  -0.793  15.196  11.100
   26   2HB   SER   3          3HB       SER   3  -1.036  13.466  10.866
   27    HG   SER   3           HG       SER   3  -2.678  13.465  12.293
   28    H    GLU   4           H        GLU   4   1.731  12.343  13.635
   29    HA   GLU   4           HA       GLU   4   4.027  13.351  12.229
   30   1HB   GLU   4          2HB       GLU   4   3.386  11.065  14.012
   31   2HB   GLU   4          3HB       GLU   4   4.796  10.912  13.001
   32   1HG   GLU   4          2HG       GLU   4   5.466  13.191  13.909
   33   2HG   GLU   4          3HG       GLU   4   4.250  12.875  15.156
   34    H    GLN   5           H        GLN   5   5.330  11.583  10.907
   35    HA   GLN   5           HA       GLN   5   3.540  10.053   9.115
   36   1HB   GLN   5          2HB       GLN   5   5.843  11.867   8.382
   37   2HB   GLN   5          3HB       GLN   5   5.121  10.774   7.224
   38   1HG   GLN   5          2HG       GLN   5   3.449  12.914   8.673
   39   2HG   GLN   5          3HG       GLN   5   4.392  13.257   7.242
   40   1HE2  GLN   5          1HE2      GLN   5   3.209  10.008   7.142
   41   2HE2  GLN   5          2HE2      GLN   5   1.904  10.324   6.041
   42    H    LYS   6           H        LYS   6   4.357   8.109   8.585
   43    HA   LYS   6           HA       LYS   6   7.222   7.559   8.841
   44   1HB   LYS   6          2HB       LYS   6   5.074   5.859  10.092
   45   2HB   LYS   6          3HB       LYS   6   6.594   5.171   9.609
   46   1HG   LYS   6          2HG       LYS   6   7.099   7.587  11.191
   47   2HG   LYS   6          3HG       LYS   6   6.014   6.518  12.041
   48   1HD   LYS   6          2HD       LYS   6   8.225   6.058  12.723
   49   2HD   LYS   6          3HD       LYS   6   7.658   4.642  11.841
   50   1HE   LYS   6          2HE       LYS   6   9.231   6.835  10.416
   51   2HE   LYS   6          3HE       LYS   6  10.103   5.720  11.463
   52   1HZ   LYS   6          1HZ       LYS   6   9.824   5.279   8.992
   53   2HZ   LYS   6          2HZ       LYS   6   9.742   3.981  10.025
   54   3HZ   LYS   6          3HZ       LYS   6   8.405   4.640   9.322
   55    H    GLU   7           H        GLU   7   7.886   5.855   7.612
   56    HA   GLU   7           HA       GLU   7   6.387   5.279   5.150
   57   1HB   GLU   7          2HB       GLU   7   9.302   4.681   5.295
   58   2HB   GLU   7          3HB       GLU   7   8.376   5.430   4.020
   59   1HG   GLU   7          2HG       GLU   7   9.867   7.082   4.622
   60   2HG   GLU   7          3HG       GLU   7   8.473   7.585   5.578
   61    H    ILE   8           H        ILE   8   5.628   3.127   5.338
   62    HA   ILE   8           HA       ILE   8   7.184   1.261   7.020
   63    HB   ILE   8           HB       ILE   8   4.453   1.071   5.874
   64   1HG1  ILE   8          2HG1      ILE   8   4.226   2.872   7.398
   65   2HG1  ILE   8          3HG1      ILE   8   3.498   1.409   8.084
   66   1HG2  ILE   8          1HG2      ILE   8   6.075  -0.511   7.782
   67   2HG2  ILE   8          2HG2      ILE   8   4.294  -0.714   7.684
   68   3HG2  ILE   8          3HG2      ILE   8   5.297  -1.042   6.256
   69   1HD1  ILE   8          1HD1      ILE   8   5.510   0.978   9.369
   70   2HD1  ILE   8          2HD1      ILE   8   6.240   2.458   8.710
   71   3HD1  ILE   8          3HD1      ILE   8   4.807   2.572   9.763
   72    H    ALA   9           H        ALA   9   7.362  -0.919   5.916
   73    HA   ALA   9           HA       ALA   9   7.563  -0.816   2.982
   74   1HB   ALA   9          1HB       ALA   9   9.810  -1.738   3.004
   75   2HB   ALA   9          2HB       ALA   9   9.845  -0.221   3.932
   76   3HB   ALA   9          3HB       ALA   9   9.836  -1.772   4.779
   77    H    MET  10           H        MET  10   6.746  -2.801   2.188
   78    HA   MET  10           HA       MET  10   7.201  -5.213   3.679
   79   1HB   MET  10          2HB       MET  10   4.963  -5.891   4.158
   80   2HB   MET  10          3HB       MET  10   5.294  -4.409   5.019
   81   1HG   MET  10          2HG       MET  10   3.908  -4.311   2.335
   82   2HG   MET  10          3HG       MET  10   3.039  -4.778   3.797
   83   1HE   MET  10          1HE       MET  10   3.172  -3.275   6.065
   84   2HE   MET  10          2HE       MET  10   2.288  -1.760   5.745
   85   3HE   MET  10          3HE       MET  10   1.675  -3.298   5.101
   86    H    GLN  11           H        GLN  11   5.602  -7.034   2.515
   87    HA   GLN  11           HA       GLN  11   6.530  -6.929  -0.310
   88   1HB   GLN  11          2HB       GLN  11   5.862  -9.115   1.713
   89   2HB   GLN  11          3HB       GLN  11   5.856  -9.477  -0.008
   90   1HG   GLN  11          2HG       GLN  11   8.209  -8.427   1.626
   91   2HG   GLN  11          3HG       GLN  11   7.999 -10.083   1.029
   92   1HE2  GLN  11          1HE2      GLN  11   7.175  -9.834  -1.577
   93   2HE2  GLN  11          2HE2      GLN  11   8.149  -8.704  -2.474
   94    H    VAL  12           H        VAL  12   5.022  -8.023  -1.919
   95    HA   VAL  12           HA       VAL  12   2.156  -7.781  -1.220
   96    HB   VAL  12           HB       VAL  12   1.924  -6.952  -3.672
   97   1HG1  VAL  12          1HG1      VAL  12   2.898  -5.103  -1.483
   98   2HG1  VAL  12          2HG1      VAL  12   2.000  -4.600  -2.929
   99   3HG1  VAL  12          3HG1      VAL  12   1.226  -5.651  -1.730
  100   1HG2  VAL  12          1HG2      VAL  12   4.714  -5.851  -3.109
  101   2HG2  VAL  12          2HG2      VAL  12   4.347  -7.149  -4.272
  102   3HG2  VAL  12          3HG2      VAL  12   3.676  -5.521  -4.500
  103    H    SER  13           H        SER  13   0.733  -8.980  -2.565
  104    HA   SER  13           HA       SER  13   1.847 -11.042  -4.315
  105   1HB   SER  13          2HB       SER  13   0.397 -11.695  -1.704
  106   2HB   SER  13          3HB       SER  13   0.631 -12.852  -3.028
  107    HG   SER  13           HG       SER  13   2.277 -13.028  -1.449
  108    H    GLY  14           H        GLY  14   0.000 -12.283  -5.306
  109   1HA   GLY  14          2HA       GLY  14  -2.066 -12.372  -6.346
  110   2HA   GLY  14          3HA       GLY  14  -2.698 -11.204  -5.171
  111    H    MET  15           H        MET  15  -0.402 -11.419  -7.960
  112    HA   MET  15           HA       MET  15  -1.385  -8.884  -9.052
  113   1HB   MET  15          2HB       MET  15   0.765  -7.850  -9.054
  114   2HB   MET  15          3HB       MET  15   0.446  -8.369  -7.388
  115   1HG   MET  15          2HG       MET  15   2.625  -9.043  -7.592
  116   2HG   MET  15          3HG       MET  15   1.836 -10.511  -8.162
  117   1HE   MET  15          1HE       MET  15   4.137 -11.029 -11.036
  118   2HE   MET  15          2HE       MET  15   4.137 -11.268  -9.269
  119   3HE   MET  15          3HE       MET  15   2.680 -11.650 -10.229
  120    H    THR  16           H        THR  16  -0.331  -8.504 -11.193
  121    HA   THR  16           HA       THR  16   0.823 -10.929 -12.484
  122    HB   THR  16           HB       THR  16  -0.382  -9.975 -14.618
  123    HG1  THR  16           1HG      THR  16  -2.188  -9.205 -12.568
  124   1HG2  THR  16          1HG2      THR  16  -0.776 -12.217 -13.800
  125   2HG2  THR  16          2HG2      THR  16  -1.810 -11.622 -12.486
  126   3HG2  THR  16          3HG2      THR  16  -2.335 -11.465 -14.179
  127    H    CYS  17           H        CYS  17   0.132  -7.439 -13.114
  128    HA   CYS  17           HA       CYS  17   2.908  -7.194 -14.161
  129   1HB   CYS  17          2HB       CYS  17   2.075  -5.383 -15.520
  130   2HB   CYS  17          3HB       CYS  17   1.094  -6.836 -15.774
  131    H    ALA  18           H        ALA  18   4.153  -5.389 -13.662
  132    HA   ALA  18           HA       ALA  18   3.809  -4.265 -10.991
  133   1HB   ALA  18          1HB       ALA  18   5.953  -3.129 -11.541
  134   2HB   ALA  18          2HB       ALA  18   6.026  -4.877 -11.836
  135   3HB   ALA  18          3HB       ALA  18   5.850  -3.756 -13.199
  136    H    ALA  19           H        ALA  19   1.549  -3.560 -12.207
  137    HA   ALA  19           HA       ALA  19   1.815  -0.631 -12.648
  138   1HB   ALA  19          1HB       ALA  19   1.965  -1.660 -14.901
  139   2HB   ALA  19          2HB       ALA  19   0.376  -2.410 -14.648
  140   3HB   ALA  19          3HB       ALA  19   0.525  -0.645 -14.689
  141    H    CYS  20           H        CYS  20  -0.599  -3.371 -12.494
  142    HA   CYS  20           HA       CYS  20  -2.625  -1.707 -11.302
  143   1HB   CYS  20          2HB       CYS  20  -3.472  -3.902 -10.343
  144   2HB   CYS  20          3HB       CYS  20  -3.342  -3.850 -12.109
  145    H    ALA  21           H        ALA  21   0.108  -3.496 -10.037
  146    HA   ALA  21           HA       ALA  21  -0.009  -3.090  -7.328
  147   1HB   ALA  21          1HB       ALA  21   2.290  -3.496  -7.327
  148   2HB   ALA  21          2HB       ALA  21   1.796  -4.216  -8.851
  149   3HB   ALA  21          3HB       ALA  21   2.564  -2.621  -8.854
  150    H    ALA  22           H        ALA  22   0.515  -0.564  -9.782
  151    HA   ALA  22           HA       ALA  22   1.363   1.462  -7.837
  152   1HB   ALA  22          1HB       ALA  22   0.326   1.791 -10.682
  153   2HB   ALA  22          2HB       ALA  22   1.146   3.006  -9.686
  154   3HB   ALA  22          3HB       ALA  22   2.035   1.568 -10.237
  155    H    ARG  23           H        ARG  23  -1.586   0.645  -9.724
  156    HA   ARG  23           HA       ARG  23  -3.134   2.826  -8.740
  157   1HB   ARG  23          2HB       ARG  23  -3.934   0.164  -9.974
  158   2HB   ARG  23          3HB       ARG  23  -5.114   1.350  -9.411
  159   1HG   ARG  23          2HG       ARG  23  -4.937   2.514 -11.308
  160   2HG   ARG  23          3HG       ARG  23  -3.262   2.877 -10.923
  161   1HD   ARG  23          2HD       ARG  23  -3.167   1.966 -13.038
  162   2HD   ARG  23          3HD       ARG  23  -2.626   0.646 -11.981
  163    HE   ARG  23           HE       ARG  23  -5.412   0.359 -12.295
  164   1HH1  ARG  23          2HH2      ARG  23  -2.513   0.169 -14.262
  165   2HH1  ARG  23          1HH2      ARG  23  -3.250  -0.648 -15.606
  166   1HH2  ARG  23          2HH1      ARG  23  -6.480  -0.698 -14.085
  167   2HH2  ARG  23          1HH1      ARG  23  -5.570  -1.173 -15.479
  168    H    ILE  24           H        ILE  24  -2.736  -0.493  -7.409
  169    HA   ILE  24           HA       ILE  24  -4.652  -0.108  -5.386
  170    HB   ILE  24           HB       ILE  24  -3.699  -1.832  -4.094
  171   1HG1  ILE  24          2HG1      ILE  24  -1.302  -1.356  -5.787
  172   2HG1  ILE  24          3HG1      ILE  24  -1.412  -1.278  -4.011
  173   1HG2  ILE  24          1HG2      ILE  24  -3.968  -3.558  -5.637
  174   2HG2  ILE  24          2HG2      ILE  24  -4.837  -2.231  -6.408
  175   3HG2  ILE  24          3HG2      ILE  24  -3.214  -2.666  -6.969
  176   1HD1  ILE  24          1HD1      ILE  24  -1.514  -3.772  -5.695
  177   2HD1  ILE  24          2HD1      ILE  24  -0.169  -3.256  -4.674
  178   3HD1  ILE  24          3HD1      ILE  24  -1.716  -3.719  -3.921
  179    H    GLU  25           H        GLU  25  -1.140   0.630  -5.190
  180    HA   GLU  25           HA       GLU  25  -1.165   1.802  -2.642
  181   1HB   GLU  25          2HB       GLU  25   0.629   2.005  -5.056
  182   2HB   GLU  25          3HB       GLU  25   0.877   3.113  -3.699
  183   1HG   GLU  25          2HG       GLU  25   0.663   0.113  -3.253
  184   2HG   GLU  25          3HG       GLU  25   2.187   0.942  -3.600
  185    H    LYS  26           H        LYS  26  -1.955   3.200  -5.794
  186    HA   LYS  26           HA       LYS  26  -1.897   5.943  -4.820
  187   1HB   LYS  26          2HB       LYS  26  -3.090   4.780  -7.344
  188   2HB   LYS  26          3HB       LYS  26  -2.873   6.507  -7.031
  189   1HG   LYS  26          2HG       LYS  26  -0.503   4.602  -6.879
  190   2HG   LYS  26          3HG       LYS  26  -1.085   5.191  -8.435
  191   1HD   LYS  26          2HD       LYS  26  -0.600   7.470  -7.815
  192   2HD   LYS  26          3HD       LYS  26  -0.247   7.012  -6.130
  193   1HE   LYS  26          2HE       LYS  26   1.684   5.695  -6.777
  194   2HE   LYS  26          3HE       LYS  26   1.301   5.856  -8.498
  195   1HZ   LYS  26          1HZ       LYS  26   1.780   8.202  -8.320
  196   2HZ   LYS  26          2HZ       LYS  26   2.152   8.045  -6.717
  197   3HZ   LYS  26          3HZ       LYS  26   3.068   7.298  -7.853
  198    H    GLY  27           H        GLY  27  -4.550   3.591  -5.486
  199   1HA   GLY  27          2HA       GLY  27  -6.678   5.305  -4.537
  200   2HA   GLY  27          3HA       GLY  27  -6.718   3.540  -4.621
  201    H    LEU  28           H        LEU  28  -4.450   2.985  -2.990
  202    HA   LEU  28           HA       LEU  28  -5.501   3.072  -0.322
  203   1HB   LEU  28          2HB       LEU  28  -4.172   1.363  -1.197
  204   2HB   LEU  28          3HB       LEU  28  -2.792   2.434  -1.421
  205    HG   LEU  28           HG       LEU  28  -4.029   2.024   1.315
  206   1HD1  LEU  28          1HD1      LEU  28  -2.328   0.183   1.547
  207   2HD1  LEU  28          2HD1      LEU  28  -3.687  -0.148   0.461
  208   3HD1  LEU  28          3HD1      LEU  28  -2.084   0.261  -0.206
  209   1HD2  LEU  28          1HD2      LEU  28  -1.956   3.676   0.290
  210   2HD2  LEU  28          2HD2      LEU  28  -2.166   3.238   1.978
  211   3HD2  LEU  28          3HD2      LEU  28  -1.093   2.278   0.919
  212    H    LYS  29           H        LYS  29  -3.161   5.185  -2.064
  213    HA   LYS  29           HA       LYS  29  -2.531   6.831   0.098
  214   1HB   LYS  29          2HB       LYS  29  -1.632   6.826  -2.377
  215   2HB   LYS  29          3HB       LYS  29  -2.912   8.006  -2.654
  216   1HG   LYS  29          2HG       LYS  29  -1.566   8.831  -0.240
  217   2HG   LYS  29          3HG       LYS  29  -0.335   8.234  -1.326
  218   1HD   LYS  29          2HD       LYS  29  -0.291  10.269  -2.228
  219   2HD   LYS  29          3HD       LYS  29  -1.794   9.889  -3.047
  220   1HE   LYS  29          2HE       LYS  29  -1.506  11.165  -0.274
  221   2HE   LYS  29          3HE       LYS  29  -1.745  12.073  -1.769
  222   1HZ   LYS  29          1HZ       LYS  29  -3.767  11.824  -0.576
  223   2HZ   LYS  29          2HZ       LYS  29  -3.901  10.847  -1.903
  224   3HZ   LYS  29          3HZ       LYS  29  -3.588  10.212  -0.412
  225    H    ARG  30           H        ARG  30  -5.541   6.661  -1.721
  226    HA   ARG  30           HA       ARG  30  -6.405   9.368  -1.052
  227   1HB   ARG  30          2HB       ARG  30  -7.410   7.079  -2.621
  228   2HB   ARG  30          3HB       ARG  30  -8.681   7.918  -1.785
  229   1HG   ARG  30          2HG       ARG  30  -6.573   9.346  -3.477
  230   2HG   ARG  30          3HG       ARG  30  -7.997   8.584  -4.176
  231   1HD   ARG  30          2HD       ARG  30  -9.394  10.020  -2.475
  232   2HD   ARG  30          3HD       ARG  30  -7.910  10.914  -2.214
  233    HE   ARG  30           HE       ARG  30  -8.206  11.992  -4.209
  234   1HH1  ARG  30          2HH2      ARG  30 -10.140   9.058  -4.247
  235   2HH1  ARG  30          1HH2      ARG  30 -10.981   9.411  -5.726
  236   1HH2  ARG  30          2HH1      ARG  30  -9.289  12.518  -6.199
  237   2HH2  ARG  30          1HH1      ARG  30 -10.464  11.432  -6.862
  238    H    MET  31           H        MET  31  -6.012   6.646   0.942
  239    HA   MET  31           HA       MET  31  -8.480   6.999   2.432
  240   1HB   MET  31          2HB       MET  31  -5.925   5.481   3.120
  241   2HB   MET  31          3HB       MET  31  -7.473   5.305   3.942
  242   1HG   MET  31          2HG       MET  31  -6.787   4.541   1.095
  243   2HG   MET  31          3HG       MET  31  -7.245   3.504   2.421
  244   1HE   MET  31          1HE       MET  31  -9.968   5.053   3.498
  245   2HE   MET  31          2HE       MET  31 -11.144   4.171   2.514
  246   3HE   MET  31          3HE       MET  31  -9.777   3.305   3.255
  247    HA   PRO  32           HA       PRO  32  -7.254  10.286   5.105
  248   1HB   PRO  32          2HB       PRO  32  -8.365   9.569   7.527
  249   2HB   PRO  32          3HB       PRO  32  -9.323  10.162   6.139
  250   1HG   PRO  32          2HG       PRO  32  -8.811   7.284   6.922
  251   2HG   PRO  32          3HG       PRO  32 -10.384   8.048   6.546
  252   1HD   PRO  32          2HD       PRO  32  -9.041   6.644   4.707
  253   2HD   PRO  32          3HD       PRO  32  -9.851   8.158   4.211
  254    H    GLY  33           H        GLY  33  -5.521  10.722   6.543
  255   1HA   GLY  33          2HA       GLY  33  -3.734  10.282   7.880
  256   2HA   GLY  33          3HA       GLY  33  -4.166   8.575   7.950
  257    H    VAL  34           H        VAL  34  -4.135   8.696   4.715
  258    HA   VAL  34           HA       VAL  34  -1.247   8.071   4.631
  259    HB   VAL  34           HB       VAL  34  -3.333   7.471   2.536
  260   1HG1  VAL  34          1HG1      VAL  34  -0.974   7.462   1.745
  261   2HG1  VAL  34          2HG1      VAL  34  -0.499   6.450   3.110
  262   3HG1  VAL  34          3HG1      VAL  34  -1.567   5.795   1.869
  263   1HG2  VAL  34          1HG2      VAL  34  -2.301   5.747   4.837
  264   2HG2  VAL  34          2HG2      VAL  34  -3.972   6.299   4.599
  265   3HG2  VAL  34          3HG2      VAL  34  -3.254   5.151   3.463
  266    H    THR  35           H        THR  35   0.204   9.347   3.707
  267    HA   THR  35           HA       THR  35  -0.751  11.868   2.427
  268    HB   THR  35           HB       THR  35   1.280  11.152   4.395
  269    HG1  THR  35           1HG      THR  35   0.711  13.131   5.122
  270   1HG2  THR  35          1HG2      THR  35   2.042  13.173   2.267
  271   2HG2  THR  35          2HG2      THR  35   2.790  13.033   3.872
  272   3HG2  THR  35          3HG2      THR  35   2.921  11.692   2.734
  273    H    ASP  36           H        ASP  36   1.529   9.104   1.987
  274    HA   ASP  36           HA       ASP  36   1.407   9.644  -0.850
  275   1HB   ASP  36          2HB       ASP  36   3.831  10.405   0.684
  276   2HB   ASP  36          3HB       ASP  36   4.159   9.252  -0.613
  277    H    ALA  37           H        ALA  37   2.410   7.887  -2.062
  278    HA   ALA  37           HA       ALA  37   2.842   5.366  -0.642
  279   1HB   ALA  37          1HB       ALA  37   0.313   5.644  -0.652
  280   2HB   ALA  37          2HB       ALA  37   0.392   5.697  -2.430
  281   3HB   ALA  37          3HB       ALA  37   0.853   4.232  -1.552
  282    H    ASN  38           H        ASN  38   3.839   3.740  -1.891
  283    HA   ASN  38           HA       ASN  38   4.530   4.426  -4.648
  284   1HB   ASN  38          2HB       ASN  38   7.085   4.317  -3.406
  285   2HB   ASN  38          3HB       ASN  38   6.347   5.607  -4.340
  286   1HD2  ASN  38          1HD2      ASN  38   5.860   4.409  -0.950
  287   2HD2  ASN  38          2HD2      ASN  38   6.234   5.975  -0.233
  288    H    VAL  39           H        VAL  39   4.320   2.450  -5.494
  289    HA   VAL  39           HA       VAL  39   5.034   0.115  -3.942
  290    HB   VAL  39           HB       VAL  39   3.035   0.399  -5.508
  291   1HG1  VAL  39          1HG1      VAL  39   3.203  -0.220  -7.779
  292   2HG1  VAL  39          2HG1      VAL  39   4.288   1.152  -7.538
  293   3HG1  VAL  39          3HG1      VAL  39   4.927  -0.504  -7.690
  294   1HG2  VAL  39          1HG2      VAL  39   3.103  -2.018  -5.990
  295   2HG2  VAL  39          2HG2      VAL  39   4.825  -2.039  -5.523
  296   3HG2  VAL  39          3HG2      VAL  39   3.566  -1.622  -4.341
  297    H    ASN  40           H        ASN  40   7.187  -0.370  -3.701
  298    HA   ASN  40           HA       ASN  40   9.093   0.314  -5.866
  299   1HB   ASN  40          2HB       ASN  40   9.579   0.802  -3.468
  300   2HB   ASN  40          3HB       ASN  40   9.622  -0.937  -3.153
  301   1HD2  ASN  40          1HD2      ASN  40  11.866   0.512  -2.573
  302   2HD2  ASN  40          2HD2      ASN  40  13.112   0.237  -3.780
  303    H    LEU  41           H        LEU  41   7.392  -1.271  -6.963
  304    HA   LEU  41           HA       LEU  41   7.699  -4.066  -6.489
  305   1HB   LEU  41          2HB       LEU  41   5.877  -2.533  -7.776
  306   2HB   LEU  41          3HB       LEU  41   6.795  -3.067  -9.175
  307    HG   LEU  41           HG       LEU  41   4.792  -4.371  -8.744
  308   1HD1  LEU  41          1HD1      LEU  41   7.213  -6.116  -8.116
  309   2HD1  LEU  41          2HD1      LEU  41   5.681  -6.647  -8.807
  310   3HD1  LEU  41          3HD1      LEU  41   6.743  -5.578  -9.742
  311   1HD2  LEU  41          1HD2      LEU  41   5.921  -5.273  -6.076
  312   2HD2  LEU  41          2HD2      LEU  41   4.584  -4.128  -6.331
  313   3HD2  LEU  41          3HD2      LEU  41   4.433  -5.806  -6.862
  314    H    ALA  42           H        ALA  42   9.607  -1.739  -8.202
  315    HA   ALA  42           HA       ALA  42  11.178  -3.277  -9.930
  316   1HB   ALA  42          1HB       ALA  42  12.980  -1.708  -9.388
  317   2HB   ALA  42          2HB       ALA  42  11.442  -0.835  -9.596
  318   3HB   ALA  42          3HB       ALA  42  12.092  -1.145  -7.963
  319    H    THR  43           H        THR  43  11.232  -3.150  -6.324
  320    HA   THR  43           HA       THR  43  12.957  -5.583  -6.439
  321    HB   THR  43           HB       THR  43  14.305  -3.826  -5.505
  322    HG1  THR  43           1HG      THR  43  13.333  -5.701  -3.639
  323   1HG2  THR  43          1HG2      THR  43  13.237  -2.164  -4.428
  324   2HG2  THR  43          2HG2      THR  43  11.871  -3.175  -3.915
  325   3HG2  THR  43          3HG2      THR  43  13.387  -3.198  -3.001
  326    H    GLU  44           H        GLU  44  10.122  -5.497  -6.748
  327    HA   GLU  44           HA       GLU  44   8.259  -6.466  -5.999
  328   1HB   GLU  44          2HB       GLU  44  10.523  -8.190  -5.721
  329   2HB   GLU  44          3HB       GLU  44   9.492  -8.545  -4.346
  330   1HG   GLU  44          2HG       GLU  44   8.557  -8.471  -7.253
  331   2HG   GLU  44          3HG       GLU  44   9.030  -9.928  -6.368
  332    H    THR  45           H        THR  45   9.077  -4.217  -4.212
  333    HA   THR  45           HA       THR  45   7.927  -5.112  -1.608
  334    HB   THR  45           HB       THR  45  10.069  -3.034  -2.258
  335    HG1  THR  45           1HG      THR  45  10.692  -5.319  -2.438
  336   1HG2  THR  45          1HG2      THR  45   9.081  -4.137   0.388
  337   2HG2  THR  45          2HG2      THR  45  10.492  -3.079   0.176
  338   3HG2  THR  45          3HG2      THR  45   8.877  -2.456  -0.194
  339    H    VAL  46           H        VAL  46   6.740  -3.296  -0.490
  340    HA   VAL  46           HA       VAL  46   5.917  -1.058  -2.276
  341    HB   VAL  46           HB       VAL  46   4.078  -2.614  -2.255
  342   1HG1  VAL  46          1HG1      VAL  46   4.440  -3.904  -0.225
  343   2HG1  VAL  46          2HG1      VAL  46   4.223  -2.459   0.791
  344   3HG1  VAL  46          3HG1      VAL  46   2.859  -3.119  -0.120
  345   1HG2  VAL  46          1HG2      VAL  46   3.386  -0.340  -0.358
  346   2HG2  VAL  46          2HG2      VAL  46   3.649  -0.144  -2.103
  347   3HG2  VAL  46          3HG2      VAL  46   2.330  -1.175  -1.512
  348    H    ASN  47           H        ASN  47   5.647   0.998  -1.241
  349    HA   ASN  47           HA       ASN  47   6.386   1.104   1.621
  350   1HB   ASN  47          2HB       ASN  47   7.582   2.653  -0.730
  351   2HB   ASN  47          3HB       ASN  47   7.595   3.293   0.915
  352   1HD2  ASN  47          1HD2      ASN  47   8.390   1.597   2.649
  353   2HD2  ASN  47          2HD2      ASN  47   9.948   0.914   2.192
  354    H    VAL  48           H        VAL  48   5.063   2.590   2.749
  355    HA   VAL  48           HA       VAL  48   3.229   4.238   1.143
  356    HB   VAL  48           HB       VAL  48   2.003   2.201   1.412
  357   1HG1  VAL  48          1HG1      VAL  48   3.131   1.088   3.230
  358   2HG1  VAL  48          2HG1      VAL  48   2.638   2.346   4.379
  359   3HG1  VAL  48          3HG1      VAL  48   1.426   1.281   3.646
  360   1HG2  VAL  48          1HG2      VAL  48   0.718   4.217   1.587
  361   2HG2  VAL  48          2HG2      VAL  48   0.087   3.041   2.757
  362   3HG2  VAL  48          3HG2      VAL  48   1.075   4.391   3.316
  363    H    ILE  49           H        ILE  49   2.942   6.175   2.068
  364    HA   ILE  49           HA       ILE  49   4.577   6.693   4.452
  365    HB   ILE  49           HB       ILE  49   3.756   8.666   2.288
  366   1HG1  ILE  49          2HG1      ILE  49   5.029   7.029   1.113
  367   2HG1  ILE  49          3HG1      ILE  49   5.982   8.494   1.326
  368   1HG2  ILE  49          1HG2      ILE  49   5.847   8.792   4.487
  369   2HG2  ILE  49          2HG2      ILE  49   5.669   9.981   3.179
  370   3HG2  ILE  49          3HG2      ILE  49   4.364   9.748   4.349
  371   1HD1  ILE  49          1HD1      ILE  49   7.400   6.569   1.719
  372   2HD1  ILE  49          2HD1      ILE  49   7.158   7.416   3.260
  373   3HD1  ILE  49          3HD1      ILE  49   6.266   5.916   2.912
  374    H    TYR  50           H        TYR  50   3.186   6.926   6.236
  375    HA   TYR  50           HA       TYR  50   0.712   8.524   5.928
  376   1HB   TYR  50          2HB       TYR  50  -0.734   6.803   6.713
  377   2HB   TYR  50          3HB       TYR  50   0.089   6.228   5.294
  378    HD1  TYR  50           HD1      TYR  50   1.744   4.340   5.481
  379    HD2  TYR  50           HD2      TYR  50  -0.311   5.868   8.928
  380    HE1  TYR  50           HE1      TYR  50   1.897   2.128   6.561
  381    HE2  TYR  50           HE2      TYR  50   0.078   3.734  10.098
  382    HH   TYR  50           HH       TYR  50   1.229   0.836   8.390
  383    H    ASP  51           H        ASP  51  -0.443   8.698   7.931
  384    HA   ASP  51           HA       ASP  51   1.389   9.286  10.158
  385   1HB   ASP  51          2HB       ASP  51  -0.192  11.003   9.601
  386   2HB   ASP  51          3HB       ASP  51  -1.544   9.874   9.715
  387    HA   PRO  52           HA       PRO  52   0.111   5.221  11.752
  388   1HB   PRO  52          2HB       PRO  52   1.964   4.851  13.678
  389   2HB   PRO  52          3HB       PRO  52   2.361   4.762  11.936
  390   1HG   PRO  52          2HG       PRO  52   2.651   7.174  13.760
  391   2HG   PRO  52          3HG       PRO  52   3.909   6.435  12.730
  392   1HD   PRO  52          2HD       PRO  52   2.453   8.558  11.895
  393   2HD   PRO  52          3HD       PRO  52   2.866   7.244  10.749
  394    H    ALA  53           H        ALA  53  -0.404   8.319  13.115
  395    HA   ALA  53           HA       ALA  53  -1.563   7.283  15.623
  396   1HB   ALA  53          1HB       ALA  53  -1.709  10.024  14.314
  397   2HB   ALA  53          2HB       ALA  53  -2.179   9.596  15.967
  398   3HB   ALA  53          3HB       ALA  53  -0.465   9.544  15.494
  399    H    GLU  54           H        GLU  54  -2.300   7.988  12.234
  400    HA   GLU  54           HA       GLU  54  -5.164   8.127  12.847
  401   1HB   GLU  54          2HB       GLU  54  -4.083  10.093  11.853
  402   2HB   GLU  54          3HB       GLU  54  -3.760   9.203  10.369
  403   1HG   GLU  54          2HG       GLU  54  -6.089   9.017   9.869
  404   2HG   GLU  54          3HG       GLU  54  -6.580   9.330  11.539
  405    H    THR  55           H        THR  55  -2.940   6.844  10.423
  406    HA   THR  55           HA       THR  55  -4.673   4.455  10.192
  407    HB   THR  55           HB       THR  55  -3.108   3.806   8.183
  408    HG1  THR  55           1HG      THR  55  -3.134   6.609   8.166
  409   1HG2  THR  55          1HG2      THR  55  -4.773   4.869   6.699
  410   2HG2  THR  55          2HG2      THR  55  -5.486   4.001   8.084
  411   3HG2  THR  55          3HG2      THR  55  -5.416   5.785   8.091
  412    H    GLY  56           H        GLY  56  -3.033   2.567   9.728
  413   1HA   GLY  56          2HA       GLY  56  -0.806   2.006  11.297
  414   2HA   GLY  56          3HA       GLY  56  -2.177   2.116  12.421
  415    H    THR  57           H        THR  57  -1.056   0.664   9.658
  416    HA   THR  57           HA       THR  57  -1.631  -0.213   7.902
  417    HB   THR  57           HB       THR  57  -1.469  -2.702   7.942
  418    HG1  THR  57           1HG      THR  57  -1.635  -2.246  10.737
  419   1HG2  THR  57          1HG2      THR  57   0.538  -1.374   9.827
  420   2HG2  THR  57          2HG2      THR  57   0.721  -2.928   9.004
  421   3HG2  THR  57          3HG2      THR  57   0.647  -1.436   8.048
  422    H    ALA  58           H        ALA  58  -4.053  -0.982  10.330
  423    HA   ALA  58           HA       ALA  58  -6.136  -2.180   9.443
  424   1HB   ALA  58          1HB       ALA  58  -5.991   0.742  10.239
  425   2HB   ALA  58          2HB       ALA  58  -7.496  -0.218  10.255
  426   3HB   ALA  58          3HB       ALA  58  -6.136  -0.646  11.321
  427    H    ALA  59           H        ALA  59  -5.378   1.001   7.927
  428    HA   ALA  59           HA       ALA  59  -7.962   0.670   6.409
  429   1HB   ALA  59          1HB       ALA  59  -5.923   2.902   6.163
  430   2HB   ALA  59          2HB       ALA  59  -7.564   2.869   5.498
  431   3HB   ALA  59          3HB       ALA  59  -7.344   2.919   7.259
  432    H    ILE  60           H        ILE  60  -4.539   0.837   5.889
  433    HA   ILE  60           HA       ILE  60  -4.320   0.388   3.123
  434    HB   ILE  60           HB       ILE  60  -2.688   0.037   5.638
  435   1HG1  ILE  60          2HG1      ILE  60  -1.449   1.202   3.323
  436   2HG1  ILE  60          3HG1      ILE  60  -3.024   1.926   3.567
  437   1HG2  ILE  60          1HG2      ILE  60  -1.781  -1.305   3.088
  438   2HG2  ILE  60          2HG2      ILE  60  -0.736  -0.823   4.445
  439   3HG2  ILE  60          3HG2      ILE  60  -2.009  -2.016   4.699
  440   1HD1  ILE  60          1HD1      ILE  60  -1.348   3.205   4.820
  441   2HD1  ILE  60          2HD1      ILE  60  -2.532   2.457   5.903
  442   3HD1  ILE  60          3HD1      ILE  60  -0.905   1.748   5.742
  443    H    GLN  61           H        GLN  61  -4.467  -2.078   5.741
  444    HA   GLN  61           HA       GLN  61  -4.333  -4.172   3.823
  445   1HB   GLN  61          2HB       GLN  61  -4.049  -3.957   6.501
  446   2HB   GLN  61          3HB       GLN  61  -5.570  -4.858   6.416
  447   1HG   GLN  61          2HG       GLN  61  -4.508  -6.694   5.332
  448   2HG   GLN  61          3HG       GLN  61  -3.143  -5.713   4.783
  449   1HE2  GLN  61          1HE2      GLN  61  -1.816  -4.628   6.573
  450   2HE2  GLN  61          2HE2      GLN  61  -1.458  -5.642   7.963
  451    H    GLU  62           H        GLU  62  -7.122  -2.690   5.561
  452    HA   GLU  62           HA       GLU  62  -9.282  -4.121   4.514
  453   1HB   GLU  62          2HB       GLU  62  -8.765  -1.262   5.335
  454   2HB   GLU  62          3HB       GLU  62 -10.217  -1.559   4.421
  455   1HG   GLU  62          2HG       GLU  62 -10.935  -3.250   6.094
  456   2HG   GLU  62          3HG       GLU  62  -9.457  -2.927   7.027
  457    H    LYS  63           H        LYS  63  -7.724  -1.221   3.017
  458    HA   LYS  63           HA       LYS  63  -9.322  -1.451   0.697
  459   1HB   LYS  63          2HB       LYS  63  -6.932   0.168   1.598
  460   2HB   LYS  63          3HB       LYS  63  -7.543   0.304  -0.022
  461   1HG   LYS  63          2HG       LYS  63  -9.488   0.483   2.320
  462   2HG   LYS  63          3HG       LYS  63  -8.438   1.824   1.938
  463   1HD   LYS  63          2HD       LYS  63 -10.573   2.196   0.940
  464   2HD   LYS  63          3HD       LYS  63  -9.338   2.030  -0.321
  465   1HE   LYS  63          2HE       LYS  63 -10.178  -0.193  -0.893
  466   2HE   LYS  63          3HE       LYS  63 -11.238  -0.204   0.545
  467   1HZ   LYS  63          1HZ       LYS  63 -12.437   0.309  -1.442
  468   2HZ   LYS  63          2HZ       LYS  63 -12.461   1.600  -0.424
  469   3HZ   LYS  63          3HZ       LYS  63 -11.485   1.614  -1.753
  470    H    ILE  64           H        ILE  64  -6.043  -2.528   1.469
  471    HA   ILE  64           HA       ILE  64  -5.005  -3.098  -0.964
  472    HB   ILE  64           HB       ILE  64  -4.656  -3.969   1.744
  473   1HG1  ILE  64          2HG1      ILE  64  -3.255  -2.384   0.454
  474   2HG1  ILE  64          3HG1      ILE  64  -2.395  -3.642   1.327
  475   1HG2  ILE  64          1HG2      ILE  64  -4.993  -6.195   1.250
  476   2HG2  ILE  64          2HG2      ILE  64  -4.070  -6.107  -0.273
  477   3HG2  ILE  64          3HG2      ILE  64  -3.255  -5.951   1.298
  478   1HD1  ILE  64          1HD1      ILE  64  -2.175  -4.952  -0.786
  479   2HD1  ILE  64          2HD1      ILE  64  -2.973  -3.637  -1.665
  480   3HD1  ILE  64          3HD1      ILE  64  -1.411  -3.354  -0.865
  481    H    GLU  65           H        GLU  65  -7.078  -5.150   1.180
  482    HA   GLU  65           HA       GLU  65  -7.674  -7.286  -0.591
  483   1HB   GLU  65          2HB       GLU  65  -9.118  -6.105   1.809
  484   2HB   GLU  65          3HB       GLU  65  -9.734  -7.514   0.941
  485   1HG   GLU  65          2HG       GLU  65  -6.862  -7.607   1.830
  486   2HG   GLU  65          3HG       GLU  65  -8.125  -7.741   3.057
  487    H    LYS  66           H        LYS  66  -9.693  -4.368   0.172
  488    HA   LYS  66           HA       LYS  66 -11.664  -5.094  -1.708
  489   1HB   LYS  66          2HB       LYS  66 -11.083  -2.709  -0.072
  490   2HB   LYS  66          3HB       LYS  66 -11.916  -2.304  -1.575
  491   1HG   LYS  66          2HG       LYS  66 -12.823  -4.493   0.321
  492   2HG   LYS  66          3HG       LYS  66 -13.420  -2.840   0.429
  493   1HD   LYS  66          2HD       LYS  66 -13.575  -4.155  -2.287
  494   2HD   LYS  66          3HD       LYS  66 -14.644  -4.788  -1.030
  495   1HE   LYS  66          2HE       LYS  66 -15.667  -2.611  -0.692
  496   2HE   LYS  66          3HE       LYS  66 -14.479  -1.825  -1.748
  497   1HZ   LYS  66          1HZ       LYS  66 -15.362  -3.095  -3.586
  498   2HZ   LYS  66          2HZ       LYS  66 -16.478  -3.810  -2.613
  499   3HZ   LYS  66          3HZ       LYS  66 -16.542  -2.192  -2.885
  500    H    LEU  67           H        LEU  67  -8.668  -3.462  -2.330
  501    HA   LEU  67           HA       LEU  67  -9.272  -2.554  -5.024
  502   1HB   LEU  67          2HB       LEU  67  -6.791  -2.869  -3.315
  503   2HB   LEU  67          3HB       LEU  67  -6.644  -2.508  -5.022
  504    HG   LEU  67           HG       LEU  67  -8.517  -0.843  -3.321
  505   1HD1  LEU  67          1HD1      LEU  67  -6.628   0.776  -2.949
  506   2HD1  LEU  67          2HD1      LEU  67  -6.515  -0.717  -2.015
  507   3HD1  LEU  67          3HD1      LEU  67  -5.511  -0.516  -3.434
  508   1HD2  LEU  67          1HD2      LEU  67  -8.736   0.307  -5.240
  509   2HD2  LEU  67          2HD2      LEU  67  -6.999   0.645  -5.274
  510   3HD2  LEU  67          3HD2      LEU  67  -7.635  -0.800  -6.069
  511    H    GLY  68           H        GLY  68  -8.597  -5.635  -3.588
  512   1HA   GLY  68          2HA       GLY  68  -8.806  -7.669  -4.641
  513   2HA   GLY  68          3HA       GLY  68  -8.605  -6.922  -6.233
  514    H    TYR  69           H        TYR  69  -6.566  -6.734  -3.234
  515    HA   TYR  69           HA       TYR  69  -4.329  -8.107  -4.636
  516   1HB   TYR  69          2HB       TYR  69  -4.611  -5.280  -4.213
  517   2HB   TYR  69          3HB       TYR  69  -3.421  -5.839  -3.060
  518    HD1  TYR  69           HD1      TYR  69  -1.235  -6.580  -3.789
  519    HD2  TYR  69           HD2      TYR  69  -4.369  -5.896  -6.669
  520    HE1  TYR  69           HE1      TYR  69   0.445  -6.377  -5.571
  521    HE2  TYR  69           HE2      TYR  69  -2.707  -5.756  -8.458
  522    HH   TYR  69           HH       TYR  69  -0.443  -5.648  -8.962
  523    H    HIS  70           H        HIS  70  -2.473  -8.437  -2.990
  524    HA   HIS  70           HA       HIS  70  -3.463  -8.525  -0.189
  525   1HB   HIS  70          2HB       HIS  70  -3.580 -10.792  -1.374
  526   2HB   HIS  70          3HB       HIS  70  -1.816 -10.741  -1.441
  527    HD1  HIS  70           1HD      HIS  70  -4.727 -11.182   0.993
  528    HD2  HIS  70           2HD      HIS  70  -0.532 -10.877   0.992
  529    HE1  HIS  70           1HE      HIS  70  -3.934 -11.963   3.296
  530    H    VAL  71           H        VAL  71  -1.925  -7.925   1.303
  531    HA   VAL  71           HA       VAL  71   0.767  -7.181   0.281
  532    HB   VAL  71           HB       VAL  71  -0.719  -5.259   0.859
  533   1HG1  VAL  71          1HG1      VAL  71  -1.742  -6.303   2.960
  534   2HG1  VAL  71          2HG1      VAL  71  -0.183  -6.012   3.750
  535   3HG1  VAL  71          3HG1      VAL  71  -1.124  -4.648   3.139
  536   1HG2  VAL  71          1HG2      VAL  71   1.627  -4.984   0.667
  537   2HG2  VAL  71          2HG2      VAL  71   1.108  -4.099   2.113
  538   3HG2  VAL  71          3HG2      VAL  71   1.889  -5.701   2.265
  539    H    VAL  72           H        VAL  72   2.434  -8.223   1.291
  540    HA   VAL  72           HA       VAL  72   1.714 -10.136   3.474
  541    HB   VAL  72           HB       VAL  72   4.011 -10.295   1.610
  542   1HG1  VAL  72          1HG1      VAL  72   2.853 -12.318   3.563
  543   2HG1  VAL  72          2HG1      VAL  72   4.183 -12.634   2.432
  544   3HG1  VAL  72          3HG1      VAL  72   4.403 -11.464   3.732
  545   1HG2  VAL  72          1HG2      VAL  72   1.920 -10.665   0.308
  546   2HG2  VAL  72          2HG2      VAL  72   2.842 -12.163   0.499
  547   3HG2  VAL  72          3HG2      VAL  72   1.417 -11.884   1.512
  548    H    ILE  73           H        ILE  73   2.886 -10.040   5.300
  549    HA   ILE  73           HA       ILE  73   4.852  -7.823   5.609
  550    HB   ILE  73           HB       ILE  73   2.935  -8.891   7.681
  551   1HG1  ILE  73          2HG1      ILE  73   2.483  -6.231   7.507
  552   2HG1  ILE  73          3HG1      ILE  73   3.105  -6.470   5.878
  553   1HG2  ILE  73          1HG2      ILE  73   5.132  -8.224   8.673
  554   2HG2  ILE  73          2HG2      ILE  73   5.015  -6.669   7.825
  555   3HG2  ILE  73          3HG2      ILE  73   3.829  -7.107   9.084
  556   1HD1  ILE  73          1HD1      ILE  73   0.844  -6.756   5.603
  557   2HD1  ILE  73          2HD1      ILE  73   1.320  -8.446   5.872
  558   3HD1  ILE  73          3HD1      ILE  73   0.631  -7.500   7.210
  559    H    GLU  74           H        GLU  74   6.355  -9.422   4.644
  560    HA   GLU  74           HA       GLU  74   7.290 -11.546   6.201
  561   1HB   GLU  74          2HB       GLU  74   8.255 -10.041   3.779
  562   2HB   GLU  74          3HB       GLU  74   9.296 -11.203   4.582
  563   1HG   GLU  74          2HG       GLU  74   6.626 -12.354   4.117
  564   2HG   GLU  74          3HG       GLU  74   7.409 -11.826   2.620
  565    H    GLY  75           H        GLY  75   7.394  -8.435   6.897
  566   1HA   GLY  75          2HA       GLY  75  10.131  -8.265   8.058
  567   2HA   GLY  75          3HA       GLY  75   8.916  -6.979   8.030
  568    H    ARG  76           H        ARG  76   6.967  -7.305   9.351
  569    HA   ARG  76           HA       ARG  76   6.037  -7.378  11.377
  570   1HB   ARG  76          2HB       ARG  76   5.581  -9.613  10.450
  571   2HB   ARG  76          3HB       ARG  76   7.053 -10.210  11.194
  572   1HG   ARG  76          2HG       ARG  76   5.479  -8.972  13.280
  573   2HG   ARG  76          3HG       ARG  76   4.366  -9.944  12.302
  574   1HD   ARG  76          2HD       ARG  76   5.863 -11.893  12.513
  575   2HD   ARG  76          3HD       ARG  76   7.009 -10.907  13.466
  576    HE   ARG  76           HE       ARG  76   4.580 -10.703  14.801
  577   1HH1  ARG  76          2HH2      ARG  76   6.914 -13.179  13.969
  578   2HH1  ARG  76          1HH2      ARG  76   6.538 -14.260  15.275
  579   1HH2  ARG  76          2HH1      ARG  76   4.027 -12.085  16.599
  580   2HH2  ARG  76          1HH1      ARG  76   4.854 -13.591  16.835
  Start of MODEL   23
    1   1H    MET   1          H1        MET   1   0.101  14.184  18.297
    2   2H    MET   1          H2        MET   1  -1.545  13.958  18.376
    3   3H    MET   1          H3        MET   1  -0.795  14.494  16.977
    4    HA   MET   1           HA       MET   1  -1.931  16.281  18.234
    5   1HB   MET   1          2HB       MET   1  -1.267  15.469  20.482
    6   2HB   MET   1          3HB       MET   1   0.433  15.780  20.114
    7   1HG   MET   1          2HG       MET   1  -1.753  17.905  20.194
    8   2HG   MET   1          3HG       MET   1  -0.666  17.507  21.527
    9   1HE   MET   1          1HE       MET   1  -1.102  20.471  20.542
   10   2HE   MET   1          2HE       MET   1   0.012  20.025  21.862
   11   3HE   MET   1          3HE       MET   1   0.576  21.062  20.532
   12    H    LEU   2           H        LEU   2  -1.487  17.407  16.428
   13    HA   LEU   2           HA       LEU   2  -0.453  17.916  14.497
   14   1HB   LEU   2          2HB       LEU   2   1.552  18.666  15.918
   15   2HB   LEU   2          3HB       LEU   2   2.281  17.096  15.579
   16    HG   LEU   2           HG       LEU   2   1.310  18.652  13.206
   17   1HD1  LEU   2          1HD1      LEU   2   3.356  20.056  13.218
   18   2HD1  LEU   2          2HD1      LEU   2   2.295  20.443  14.584
   19   3HD1  LEU   2          3HD1      LEU   2   3.753  19.461  14.844
   20   1HD2  LEU   2          1HD2      LEU   2   3.957  17.238  13.809
   21   2HD2  LEU   2          2HD2      LEU   2   2.564  16.433  13.093
   22   3HD2  LEU   2          3HD2      LEU   2   3.355  17.755  12.220
   23    H    SER   3           H        SER   3   0.257  16.466  12.672
   24    HA   SER   3           HA       SER   3  -0.311  13.609  13.244
   25   1HB   SER   3          2HB       SER   3  -0.592  14.999  10.564
   26   2HB   SER   3          3HB       SER   3  -1.287  13.472  11.116
   27    HG   SER   3           HG       SER   3  -2.939  14.872  11.372
   28    H    GLU   4           H        GLU   4   1.404  12.288  12.832
   29    HA   GLU   4           HA       GLU   4   3.955  13.449  11.876
   30   1HB   GLU   4          2HB       GLU   4   3.155  11.178  13.607
   31   2HB   GLU   4          3HB       GLU   4   4.572  10.939  12.618
   32   1HG   GLU   4          2HG       GLU   4   5.379  13.148  13.532
   33   2HG   GLU   4          3HG       GLU   4   4.082  12.988  14.718
   34    H    GLN   5           H        GLN   5   5.209  11.583  10.555
   35    HA   GLN   5           HA       GLN   5   3.372  10.094   8.799
   36   1HB   GLN   5          2HB       GLN   5   5.767  11.753   7.983
   37   2HB   GLN   5          3HB       GLN   5   4.969  10.650   6.879
   38   1HG   GLN   5          2HG       GLN   5   3.462  12.974   8.221
   39   2HG   GLN   5          3HG       GLN   5   4.440  13.174   6.798
   40   1HE2  GLN   5          1HE2      GLN   5   2.938  10.036   6.848
   41   2HE2  GLN   5          2HE2      GLN   5   1.706  10.431   5.673
   42    H    LYS   6           H        LYS   6   4.171   8.071   8.346
   43    HA   LYS   6           HA       LYS   6   7.004   7.491   8.713
   44   1HB   LYS   6          2HB       LYS   6   4.809   6.097  10.281
   45   2HB   LYS   6          3HB       LYS   6   6.257   5.234   9.799
   46   1HG   LYS   6          2HG       LYS   6   7.104   7.756  10.960
   47   2HG   LYS   6          3HG       LYS   6   5.892   7.083  12.004
   48   1HD   LYS   6          2HD       LYS   6   7.373   5.655  12.867
   49   2HD   LYS   6          3HD       LYS   6   7.698   4.912  11.312
   50   1HE   LYS   6          2HE       LYS   6   9.100   7.344  12.509
   51   2HE   LYS   6          3HE       LYS   6   9.754   5.715  12.288
   52   1HZ   LYS   6          1HZ       LYS   6   9.445   6.111   9.811
   53   2HZ   LYS   6          2HZ       LYS   6   9.142   7.654  10.126
   54   3HZ   LYS   6          3HZ       LYS   6  10.583   7.031  10.520
   55    H    GLU   7           H        GLU   7   7.553   5.437   7.882
   56    HA   GLU   7           HA       GLU   7   6.344   5.073   5.223
   57   1HB   GLU   7          2HB       GLU   7   9.278   4.775   5.597
   58   2HB   GLU   7          3HB       GLU   7   8.320   5.565   4.362
   59   1HG   GLU   7          2HG       GLU   7   9.668   7.210   5.398
   60   2HG   GLU   7          3HG       GLU   7   8.038   7.511   5.996
   61    H    ILE   8           H        ILE   8   5.326   3.090   5.689
   62    HA   ILE   8           HA       ILE   8   6.755   1.004   7.144
   63    HB   ILE   8           HB       ILE   8   4.148   0.901   5.743
   64   1HG1  ILE   8          2HG1      ILE   8   3.762   2.836   6.977
   65   2HG1  ILE   8          3HG1      ILE   8   2.997   1.464   7.782
   66   1HG2  ILE   8          1HG2      ILE   8   5.285  -0.538   8.119
   67   2HG2  ILE   8          2HG2      ILE   8   3.593  -0.701   7.562
   68   3HG2  ILE   8          3HG2      ILE   8   4.928  -1.219   6.522
   69   1HD1  ILE   8          1HD1      ILE   8   4.816   1.273   9.337
   70   2HD1  ILE   8          2HD1      ILE   8   5.655   2.627   8.545
   71   3HD1  ILE   8          3HD1      ILE   8   4.105   2.911   9.384
   72    H    ALA   9           H        ALA   9   6.945  -1.206   6.050
   73    HA   ALA   9           HA       ALA   9   7.271  -1.124   3.116
   74   1HB   ALA   9          1HB       ALA   9   9.497  -2.128   3.281
   75   2HB   ALA   9          2HB       ALA   9   9.495  -0.548   4.093
   76   3HB   ALA   9          3HB       ALA   9   9.438  -2.037   5.055
   77    H    MET  10           H        MET  10   6.528  -3.071   2.237
   78    HA   MET  10           HA       MET  10   6.720  -5.561   3.744
   79   1HB   MET  10          2HB       MET  10   4.200  -5.989   3.426
   80   2HB   MET  10          3HB       MET  10   4.705  -5.008   4.803
   81   1HG   MET  10          2HG       MET  10   3.936  -3.685   2.221
   82   2HG   MET  10          3HG       MET  10   2.679  -4.276   3.304
   83   1HE   MET  10          1HE       MET  10   1.782  -1.712   3.066
   84   2HE   MET  10          2HE       MET  10   2.697  -0.325   3.710
   85   3HE   MET  10          3HE       MET  10   3.273  -1.166   2.254
   86    H    GLN  11           H        GLN  11   5.550  -7.374   2.387
   87    HA   GLN  11           HA       GLN  11   6.493  -7.103  -0.404
   88   1HB   GLN  11          2HB       GLN  11   6.331  -9.253   1.576
   89   2HB   GLN  11          3HB       GLN  11   5.419  -9.694   0.127
   90   1HG   GLN  11          2HG       GLN  11   8.286  -8.735  -0.049
   91   2HG   GLN  11          3HG       GLN  11   7.834 -10.424   0.244
   92   1HE2  GLN  11          1HE2      GLN  11   7.640  -7.797  -2.088
   93   2HE2  GLN  11          2HE2      GLN  11   7.062  -8.728  -3.440
   94    H    VAL  12           H        VAL  12   5.000  -8.233  -2.072
   95    HA   VAL  12           HA       VAL  12   2.119  -7.580  -1.580
   96    HB   VAL  12           HB       VAL  12   2.109  -6.989  -4.031
   97   1HG1  VAL  12          1HG1      VAL  12   2.892  -4.690  -3.673
   98   2HG1  VAL  12          2HG1      VAL  12   1.968  -5.266  -2.274
   99   3HG1  VAL  12          3HG1      VAL  12   3.747  -5.205  -2.205
  100   1HG2  VAL  12          1HG2      VAL  12   4.135  -6.377  -5.119
  101   2HG2  VAL  12          2HG2      VAL  12   5.099  -6.608  -3.640
  102   3HG2  VAL  12          3HG2      VAL  12   4.413  -8.005  -4.500
  103    H    SER  13           H        SER  13   0.587  -8.883  -2.537
  104    HA   SER  13           HA       SER  13   1.421 -10.889  -4.532
  105   1HB   SER  13          2HB       SER  13  -0.591 -11.416  -2.329
  106   2HB   SER  13          3HB       SER  13  -0.055 -12.561  -3.565
  107    HG   SER  13           HG       SER  13   0.995 -12.820  -1.473
  108    H    GLY  14           H        GLY  14  -0.205 -11.210  -6.049
  109   1HA   GLY  14          2HA       GLY  14  -2.576 -10.865  -6.735
  110   2HA   GLY  14          3HA       GLY  14  -2.456  -9.209  -6.126
  111    H    MET  15           H        MET  15   0.365  -8.926  -7.132
  112    HA   MET  15           HA       MET  15  -0.197  -7.653  -9.527
  113   1HB   MET  15          2HB       MET  15   2.242  -7.623  -9.920
  114   2HB   MET  15          3HB       MET  15   1.788  -7.078  -8.310
  115   1HG   MET  15          2HG       MET  15   2.881  -8.794  -7.275
  116   2HG   MET  15          3HG       MET  15   2.390  -9.988  -8.472
  117   1HE   MET  15          1HE       MET  15   4.518 -11.292  -8.379
  118   2HE   MET  15          2HE       MET  15   6.139 -10.593  -8.572
  119   3HE   MET  15          3HE       MET  15   5.172 -10.199  -7.131
  120    H    THR  16           H        THR  16  -0.221  -8.090 -11.605
  121    HA   THR  16           HA       THR  16   0.725 -10.671 -12.734
  122    HB   THR  16           HB       THR  16  -1.562 -10.478 -14.086
  123    HG1  THR  16           1HG      THR  16  -2.349  -9.448 -11.564
  124   1HG2  THR  16          1HG2      THR  16  -2.665 -12.012 -12.520
  125   2HG2  THR  16          2HG2      THR  16  -0.954 -12.428 -12.722
  126   3HG2  THR  16          3HG2      THR  16  -1.496 -11.598 -11.250
  127    H    CYS  17           H        CYS  17  -1.095  -7.726 -13.544
  128    HA   CYS  17           HA       CYS  17   0.329  -7.268 -16.047
  129   1HB   CYS  17          2HB       CYS  17  -1.093  -5.216 -16.092
  130   2HB   CYS  17          3HB       CYS  17  -2.048  -6.683 -15.770
  131    H    ALA  18           H        ALA  18   1.264  -6.702 -12.879
  132    HA   ALA  18           HA       ALA  18   2.781  -5.465 -11.822
  133   1HB   ALA  18          1HB       ALA  18   3.660  -4.241 -14.467
  134   2HB   ALA  18          2HB       ALA  18   4.522  -4.248 -12.923
  135   3HB   ALA  18          3HB       ALA  18   4.260  -5.774 -13.792
  136    H    ALA  19           H        ALA  19   1.285  -3.436 -14.376
  137    HA   ALA  19           HA       ALA  19   1.486  -0.957 -13.246
  138   1HB   ALA  19          1HB       ALA  19  -0.491  -0.318 -14.566
  139   2HB   ALA  19          2HB       ALA  19   0.583  -1.391 -15.485
  140   3HB   ALA  19          3HB       ALA  19  -0.918  -2.031 -14.777
  141    H    CYS  20           H        CYS  20  -1.165  -3.271 -12.471
  142    HA   CYS  20           HA       CYS  20  -2.625  -1.527 -10.903
  143   1HB   CYS  20          2HB       CYS  20  -2.439  -4.553 -10.904
  144   2HB   CYS  20          3HB       CYS  20  -3.440  -3.700  -9.723
  145    H    ALA  21           H        ALA  21   0.412  -3.055 -10.087
  146    HA   ALA  21           HA       ALA  21   0.296  -2.866  -7.249
  147   1HB   ALA  21          1HB       ALA  21   2.036  -4.037  -8.698
  148   2HB   ALA  21          2HB       ALA  21   2.748  -2.435  -8.991
  149   3HB   ALA  21          3HB       ALA  21   2.658  -3.105  -7.350
  150    H    ALA  22           H        ALA  22   0.750  -0.397  -9.807
  151    HA   ALA  22           HA       ALA  22   1.460   1.729  -7.908
  152   1HB   ALA  22          1HB       ALA  22   2.150   1.827 -10.294
  153   2HB   ALA  22          2HB       ALA  22   0.440   1.887 -10.776
  154   3HB   ALA  22          3HB       ALA  22   1.136   3.204  -9.816
  155    H    ARG  23           H        ARG  23  -1.407   0.518  -9.664
  156    HA   ARG  23           HA       ARG  23  -3.198   2.536  -8.924
  157   1HB   ARG  23          2HB       ARG  23  -3.649  -0.400  -9.504
  158   2HB   ARG  23          3HB       ARG  23  -4.976   0.590  -9.070
  159   1HG   ARG  23          2HG       ARG  23  -3.106   1.335 -11.357
  160   2HG   ARG  23          3HG       ARG  23  -4.544   0.336 -11.575
  161   1HD   ARG  23          2HD       ARG  23  -4.580   3.221 -10.509
  162   2HD   ARG  23          3HD       ARG  23  -4.947   2.698 -12.135
  163    HE   ARG  23           HE       ARG  23  -6.939   1.758 -11.534
  164   1HH1  ARG  23          2HH2      ARG  23  -5.326   2.821  -8.543
  165   2HH1  ARG  23          1HH2      ARG  23  -6.744   2.730  -7.579
  166   1HH2  ARG  23          2HH1      ARG  23  -8.814   1.607 -10.247
  167   2HH2  ARG  23          1HH1      ARG  23  -8.780   2.026  -8.569
  168    H    ILE  24           H        ILE  24  -2.393  -0.465  -7.064
  169    HA   ILE  24           HA       ILE  24  -4.341   0.136  -5.113
  170    HB   ILE  24           HB       ILE  24  -3.489  -1.443  -3.649
  171   1HG1  ILE  24          2HG1      ILE  24  -0.990  -1.142  -5.257
  172   2HG1  ILE  24          3HG1      ILE  24  -1.248  -1.057  -3.494
  173   1HG2  ILE  24          1HG2      ILE  24  -4.641  -2.085  -5.841
  174   2HG2  ILE  24          2HG2      ILE  24  -3.040  -2.570  -6.427
  175   3HG2  ILE  24          3HG2      ILE  24  -3.740  -3.339  -4.988
  176   1HD1  ILE  24          1HD1      ILE  24  -1.635  -3.533  -3.499
  177   2HD1  ILE  24          2HD1      ILE  24  -1.200  -3.529  -5.234
  178   3HD1  ILE  24          3HD1      ILE  24  -0.002  -3.058  -4.024
  179    H    GLU  25           H        GLU  25  -0.759   0.797  -4.680
  180    HA   GLU  25           HA       GLU  25  -0.820   2.529  -2.563
  181   1HB   GLU  25          2HB       GLU  25   0.776   2.366  -5.090
  182   2HB   GLU  25          3HB       GLU  25   0.986   3.798  -4.087
  183   1HG   GLU  25          2HG       GLU  25   2.577   1.877  -3.568
  184   2HG   GLU  25          3HG       GLU  25   1.683   2.438  -2.164
  185    H    LYS  26           H        LYS  26  -1.771   3.396  -5.840
  186    HA   LYS  26           HA       LYS  26  -2.220   6.208  -5.052
  187   1HB   LYS  26          2HB       LYS  26  -2.630   4.823  -7.710
  188   2HB   LYS  26          3HB       LYS  26  -2.803   6.554  -7.405
  189   1HG   LYS  26          2HG       LYS  26  -0.246   4.896  -7.062
  190   2HG   LYS  26          3HG       LYS  26  -0.582   6.002  -8.386
  191   1HD   LYS  26          2HD       LYS  26  -0.546   7.912  -6.824
  192   2HD   LYS  26          3HD       LYS  26  -0.284   6.826  -5.444
  193   1HE   LYS  26          2HE       LYS  26   1.827   6.017  -6.382
  194   2HE   LYS  26          3HE       LYS  26   1.681   7.174  -7.717
  195   1HZ   LYS  26          1HZ       LYS  26   1.891   7.914  -4.816
  196   2HZ   LYS  26          2HZ       LYS  26   3.085   7.958  -5.904
  197   3HZ   LYS  26          3HZ       LYS  26   1.791   8.953  -6.055
  198    H    GLY  27           H        GLY  27  -4.121   3.398  -5.082
  199   1HA   GLY  27          2HA       GLY  27  -6.652   4.849  -4.608
  200   2HA   GLY  27          3HA       GLY  27  -6.319   3.138  -4.318
  201    H    LEU  28           H        LEU  28  -3.997   3.306  -2.734
  202    HA   LEU  28           HA       LEU  28  -5.241   3.581  -0.168
  203   1HB   LEU  28          2HB       LEU  28  -2.333   3.288  -0.967
  204   2HB   LEU  28          3HB       LEU  28  -2.886   3.245   0.702
  205    HG   LEU  28           HG       LEU  28  -4.100   1.303  -1.320
  206   1HD1  LEU  28          1HD1      LEU  28  -1.780   0.896  -1.590
  207   2HD1  LEU  28          2HD1      LEU  28  -1.433   1.121   0.132
  208   3HD1  LEU  28          3HD1      LEU  28  -2.328  -0.306  -0.439
  209   1HD2  LEU  28          1HD2      LEU  28  -4.646   0.016   0.545
  210   2HD2  LEU  28          2HD2      LEU  28  -3.516   0.891   1.582
  211   3HD2  LEU  28          3HD2      LEU  28  -5.030   1.670   1.067
  212    H    LYS  29           H        LYS  29  -2.999   5.656  -1.970
  213    HA   LYS  29           HA       LYS  29  -2.577   7.743  -0.213
  214   1HB   LYS  29          2HB       LYS  29  -1.658   7.360  -2.501
  215   2HB   LYS  29          3HB       LYS  29  -3.144   8.000  -3.207
  216   1HG   LYS  29          2HG       LYS  29  -1.542   9.591  -1.180
  217   2HG   LYS  29          3HG       LYS  29  -0.971   9.451  -2.854
  218   1HD   LYS  29          2HD       LYS  29  -3.405  10.357  -3.419
  219   2HD   LYS  29          3HD       LYS  29  -3.343  10.909  -1.726
  220   1HE   LYS  29          2HE       LYS  29  -1.026  11.914  -2.288
  221   2HE   LYS  29          3HE       LYS  29  -1.395  11.599  -3.977
  222   1HZ   LYS  29          1HZ       LYS  29  -2.937  13.298  -2.127
  223   2HZ   LYS  29          2HZ       LYS  29  -1.944  13.820  -3.328
  224   3HZ   LYS  29          3HZ       LYS  29  -3.339  13.029  -3.706
  225    H    ARG  30           H        ARG  30  -5.648   6.900  -1.728
  226    HA   ARG  30           HA       ARG  30  -6.799   9.574  -1.324
  227   1HB   ARG  30          2HB       ARG  30  -7.341   7.237  -2.921
  228   2HB   ARG  30          3HB       ARG  30  -8.769   7.553  -1.968
  229   1HG   ARG  30          2HG       ARG  30  -8.977   9.772  -2.865
  230   2HG   ARG  30          3HG       ARG  30  -7.332   9.753  -3.529
  231   1HD   ARG  30          2HD       ARG  30  -9.570   7.916  -4.459
  232   2HD   ARG  30          3HD       ARG  30  -9.069   9.427  -5.259
  233    HE   ARG  30           HE       ARG  30  -6.785   7.729  -4.869
  234   1HH1  ARG  30          2HH2      ARG  30  -9.661   7.976  -6.882
  235   2HH1  ARG  30          1HH2      ARG  30  -8.956   7.208  -8.271
  236   1HH2  ARG  30          2HH1      ARG  30  -5.833   6.693  -6.582
  237   2HH2  ARG  30          1HH1      ARG  30  -6.655   6.473  -8.114
  238    H    MET  31           H        MET  31  -6.048   7.161   0.864
  239    HA   MET  31           HA       MET  31  -8.648   7.236   2.253
  240   1HB   MET  31          2HB       MET  31  -6.144   5.610   2.807
  241   2HB   MET  31          3HB       MET  31  -7.741   5.329   3.490
  242   1HG   MET  31          2HG       MET  31  -6.941   5.063   0.555
  243   2HG   MET  31          3HG       MET  31  -7.260   3.789   1.692
  244   1HE   MET  31          1HE       MET  31  -9.837   3.663   2.836
  245   2HE   MET  31          2HE       MET  31 -10.123   5.412   2.946
  246   3HE   MET  31          3HE       MET  31 -11.255   4.401   2.047
  247    HA   PRO  32           HA       PRO  32  -7.328  10.198   5.222
  248   1HB   PRO  32          2HB       PRO  32  -8.508   9.337   7.567
  249   2HB   PRO  32          3HB       PRO  32  -9.408  10.090   6.218
  250   1HG   PRO  32          2HG       PRO  32  -9.055   7.139   6.782
  251   2HG   PRO  32          3HG       PRO  32 -10.578   8.009   6.423
  252   1HD   PRO  32          2HD       PRO  32  -9.227   6.668   4.524
  253   2HD   PRO  32          3HD       PRO  32  -9.980   8.240   4.116
  254    H    GLY  33           H        GLY  33  -5.502  10.462   6.449
  255   1HA   GLY  33          2HA       GLY  33  -3.801   9.834   7.941
  256   2HA   GLY  33          3HA       GLY  33  -4.184   8.123   7.733
  257    H    VAL  34           H        VAL  34  -4.281   8.371   4.672
  258    HA   VAL  34           HA       VAL  34  -1.378   7.937   4.427
  259    HB   VAL  34           HB       VAL  34  -3.500   7.515   2.314
  260   1HG1  VAL  34          1HG1      VAL  34  -1.811   5.891   1.458
  261   2HG1  VAL  34          2HG1      VAL  34  -1.112   7.517   1.554
  262   3HG1  VAL  34          3HG1      VAL  34  -0.726   6.316   2.793
  263   1HG2  VAL  34          1HG2      VAL  34  -2.549   5.674   4.541
  264   2HG2  VAL  34          2HG2      VAL  34  -4.213   6.184   4.222
  265   3HG2  VAL  34          3HG2      VAL  34  -3.402   5.093   3.095
  266    H    THR  35           H        THR  35   0.043   9.304   3.360
  267    HA   THR  35           HA       THR  35  -1.192  11.755   2.165
  268    HB   THR  35           HB       THR  35   0.518  11.738   4.171
  269    HG1  THR  35           1HG      THR  35   0.451  13.596   2.033
  270   1HG2  THR  35          1HG2      THR  35   2.438  10.760   2.951
  271   2HG2  THR  35          2HG2      THR  35   2.373  12.095   1.772
  272   3HG2  THR  35          3HG2      THR  35   2.752  12.425   3.464
  273    H    ASP  36           H        ASP  36   1.349   9.286   1.617
  274    HA   ASP  36           HA       ASP  36   0.496   9.066  -1.048
  275   1HB   ASP  36          2HB       ASP  36   2.420  10.992  -1.033
  276   2HB   ASP  36          3HB       ASP  36   3.410   9.547  -1.265
  277    H    ALA  37           H        ALA  37   2.066   7.514  -2.257
  278    HA   ALA  37           HA       ALA  37   3.076   5.419  -0.559
  279   1HB   ALA  37          1HB       ALA  37   0.451   5.365  -0.450
  280   2HB   ALA  37          2HB       ALA  37   0.541   4.761  -2.100
  281   3HB   ALA  37          3HB       ALA  37   1.303   3.868  -0.753
  282    H    ASN  38           H        ASN  38   4.052   3.663  -1.792
  283    HA   ASN  38           HA       ASN  38   4.770   4.384  -4.569
  284   1HB   ASN  38          2HB       ASN  38   7.256   4.272  -3.216
  285   2HB   ASN  38          3HB       ASN  38   6.507   5.646  -4.005
  286   1HD2  ASN  38          1HD2      ASN  38   5.852   3.992  -0.837
  287   2HD2  ASN  38          2HD2      ASN  38   6.118   5.458   0.104
  288    H    VAL  39           H        VAL  39   4.914   2.474  -5.546
  289    HA   VAL  39           HA       VAL  39   5.353   0.061  -3.978
  290    HB   VAL  39           HB       VAL  39   3.366   0.476  -5.340
  291   1HG1  VAL  39          1HG1      VAL  39   4.447   1.566  -7.342
  292   2HG1  VAL  39          2HG1      VAL  39   5.032  -0.037  -7.837
  293   3HG1  VAL  39          3HG1      VAL  39   3.313   0.266  -7.713
  294   1HG2  VAL  39          1HG2      VAL  39   4.612  -1.951  -6.514
  295   2HG2  VAL  39          2HG2      VAL  39   4.450  -1.842  -4.741
  296   3HG2  VAL  39          3HG2      VAL  39   3.021  -1.694  -5.753
  297    H    ASN  40           H        ASN  40   7.511  -0.336  -3.640
  298    HA   ASN  40           HA       ASN  40   9.459   0.245  -5.776
  299   1HB   ASN  40          2HB       ASN  40   9.820   0.870  -3.377
  300   2HB   ASN  40          3HB       ASN  40   9.893  -0.852  -2.973
  301   1HD2  ASN  40          1HD2      ASN  40  12.081   0.336  -2.219
  302   2HD2  ASN  40          2HD2      ASN  40  13.396   0.172  -3.372
  303    H    LEU  41           H        LEU  41   7.907  -1.481  -6.847
  304    HA   LEU  41           HA       LEU  41   8.358  -4.258  -6.224
  305   1HB   LEU  41          2HB       LEU  41   6.815  -2.669  -8.168
  306   2HB   LEU  41          3HB       LEU  41   7.470  -4.117  -8.908
  307    HG   LEU  41           HG       LEU  41   5.166  -4.229  -7.874
  308   1HD1  LEU  41          1HD1      LEU  41   7.247  -6.320  -7.121
  309   2HD1  LEU  41          2HD1      LEU  41   5.493  -6.581  -7.156
  310   3HD1  LEU  41          3HD1      LEU  41   6.360  -6.204  -8.652
  311   1HD2  LEU  41          1HD2      LEU  41   4.801  -4.326  -5.608
  312   2HD2  LEU  41          2HD2      LEU  41   6.417  -4.955  -5.238
  313   3HD2  LEU  41          3HD2      LEU  41   6.191  -3.236  -5.575
  314    H    ALA  42           H        ALA  42  10.186  -1.962  -8.030
  315    HA   ALA  42           HA       ALA  42  11.926  -3.516  -9.554
  316   1HB   ALA  42          1HB       ALA  42  13.632  -1.851  -8.962
  317   2HB   ALA  42          2HB       ALA  42  12.080  -1.048  -9.305
  318   3HB   ALA  42          3HB       ALA  42  12.630  -1.271  -7.622
  319    H    THR  43           H        THR  43  11.650  -3.314  -5.975
  320    HA   THR  43           HA       THR  43  13.531  -5.605  -5.855
  321    HB   THR  43           HB       THR  43  14.638  -3.536  -5.212
  322    HG1  THR  43           1HG      THR  43  15.518  -4.484  -3.294
  323   1HG2  THR  43          1HG2      THR  43  12.620  -2.558  -3.947
  324   2HG2  THR  43          2HG2      THR  43  13.069  -3.617  -2.602
  325   3HG2  THR  43          3HG2      THR  43  14.207  -2.388  -3.171
  326    H    GLU  44           H        GLU  44  10.726  -5.740  -6.186
  327    HA   GLU  44           HA       GLU  44   8.797  -6.522  -5.222
  328   1HB   GLU  44          2HB       GLU  44  11.109  -8.280  -4.481
  329   2HB   GLU  44          3HB       GLU  44   9.539  -8.700  -3.810
  330   1HG   GLU  44          2HG       GLU  44   9.811  -8.187  -6.783
  331   2HG   GLU  44          3HG       GLU  44  10.136  -9.767  -6.053
  332    H    THR  45           H        THR  45   9.167  -4.267  -3.836
  333    HA   THR  45           HA       THR  45   8.106  -5.047  -1.215
  334    HB   THR  45           HB       THR  45  10.298  -2.948  -1.682
  335    HG1  THR  45           1HG      THR  45  11.099  -5.156  -1.823
  336   1HG2  THR  45          1HG2      THR  45   8.803  -2.494   0.188
  337   2HG2  THR  45          2HG2      THR  45   8.967  -4.192   0.731
  338   3HG2  THR  45          3HG2      THR  45  10.362  -3.077   0.826
  339    H    VAL  46           H        VAL  46   6.627  -3.434  -0.409
  340    HA   VAL  46           HA       VAL  46   6.102  -1.111  -2.208
  341    HB   VAL  46           HB       VAL  46   4.352  -2.735  -2.562
  342   1HG1  VAL  46          1HG1      VAL  46   2.793  -3.403  -0.756
  343   2HG1  VAL  46          2HG1      VAL  46   4.420  -3.972  -0.368
  344   3HG1  VAL  46          3HG1      VAL  46   3.767  -2.515   0.417
  345   1HG2  VAL  46          1HG2      VAL  46   3.305  -0.464  -0.828
  346   2HG2  VAL  46          2HG2      VAL  46   3.719  -0.350  -2.553
  347   3HG2  VAL  46          3HG2      VAL  46   2.434  -1.449  -2.019
  348    H    ASN  47           H        ASN  47   5.723   0.856  -1.170
  349    HA   ASN  47           HA       ASN  47   6.117   0.885   1.765
  350   1HB   ASN  47          2HB       ASN  47   7.439   2.545  -0.433
  351   2HB   ASN  47          3HB       ASN  47   7.292   3.152   1.217
  352   1HD2  ASN  47          1HD2      ASN  47   8.165   1.632   2.987
  353   2HD2  ASN  47          2HD2      ASN  47   9.791   1.085   2.624
  354    H    VAL  48           H        VAL  48   4.858   2.556   2.839
  355    HA   VAL  48           HA       VAL  48   3.027   4.109   1.130
  356    HB   VAL  48           HB       VAL  48   2.069   2.375   3.413
  357   1HG1  VAL  48          1HG1      VAL  48   0.437   3.929   1.364
  358   2HG1  VAL  48          2HG1      VAL  48  -0.135   3.158   2.841
  359   3HG1  VAL  48          3HG1      VAL  48   0.879   4.610   2.930
  360   1HG2  VAL  48          1HG2      VAL  48   1.621   1.969   0.430
  361   2HG2  VAL  48          2HG2      VAL  48   2.556   0.917   1.495
  362   3HG2  VAL  48          3HG2      VAL  48   0.813   1.083   1.734
  363    H    ILE  49           H        ILE  49   2.982   6.154   1.885
  364    HA   ILE  49           HA       ILE  49   4.472   6.739   4.331
  365    HB   ILE  49           HB       ILE  49   3.653   8.605   2.056
  366   1HG1  ILE  49          2HG1      ILE  49   5.009   6.958   1.000
  367   2HG1  ILE  49          3HG1      ILE  49   5.935   8.438   1.198
  368   1HG2  ILE  49          1HG2      ILE  49   4.187   9.760   4.119
  369   2HG2  ILE  49          2HG2      ILE  49   5.728   8.901   4.248
  370   3HG2  ILE  49          3HG2      ILE  49   5.438  10.029   2.897
  371   1HD1  ILE  49          1HD1      ILE  49   6.192   5.933   2.918
  372   2HD1  ILE  49          2HD1      ILE  49   7.346   6.526   1.711
  373   3HD1  ILE  49          3HD1      ILE  49   7.075   7.451   3.197
  374    H    TYR  50           H        TYR  50   2.989   6.799   6.043
  375    HA   TYR  50           HA       TYR  50   0.512   8.417   5.693
  376   1HB   TYR  50          2HB       TYR  50  -0.867   6.682   6.695
  377   2HB   TYR  50          3HB       TYR  50  -0.178   6.178   5.173
  378    HD1  TYR  50           HD1      TYR  50   0.702   3.997   5.043
  379    HD2  TYR  50           HD2      TYR  50   0.501   5.911   8.887
  380    HE1  TYR  50           HE1      TYR  50   0.827   1.801   6.145
  381    HE2  TYR  50           HE2      TYR  50   0.813   3.738   9.988
  382    HH   TYR  50           HH       TYR  50   0.912   0.699   8.156
  383    H    ASP  51           H        ASP  51  -0.626   8.766   7.691
  384    HA   ASP  51           HA       ASP  51   1.224   9.422   9.868
  385   1HB   ASP  51          2HB       ASP  51  -0.290  11.162   9.386
  386   2HB   ASP  51          3HB       ASP  51  -1.678  10.066   9.443
  387    HA   PRO  52           HA       PRO  52   0.006   5.472  11.671
  388   1HB   PRO  52          2HB       PRO  52   1.908   5.239  13.562
  389   2HB   PRO  52          3HB       PRO  52   2.344   5.316  11.831
  390   1HG   PRO  52          2HG       PRO  52   2.294   7.628  13.808
  391   2HG   PRO  52          3HG       PRO  52   3.658   7.120  12.769
  392   1HD   PRO  52          2HD       PRO  52   1.907   9.082  12.018
  393   2HD   PRO  52          3HD       PRO  52   2.608   7.934  10.835
  394    H    ALA  53           H        ALA  53  -1.036   8.381  12.855
  395    HA   ALA  53           HA       ALA  53  -2.019   7.248  15.430
  396   1HB   ALA  53          1HB       ALA  53  -2.755   9.502  15.904
  397   2HB   ALA  53          2HB       ALA  53  -1.025   9.530  15.504
  398   3HB   ALA  53          3HB       ALA  53  -2.226  10.080  14.320
  399    H    GLU  54           H        GLU  54  -2.920   8.722  12.296
  400    HA   GLU  54           HA       GLU  54  -5.747   8.165  12.666
  401   1HB   GLU  54          2HB       GLU  54  -4.127   9.805  10.891
  402   2HB   GLU  54          3HB       GLU  54  -5.129   8.723   9.914
  403   1HG   GLU  54          2HG       GLU  54  -6.390  10.702  10.239
  404   2HG   GLU  54          3HG       GLU  54  -7.139   9.471  11.265
  405    H    THR  55           H        THR  55  -3.052   6.817  10.759
  406    HA   THR  55           HA       THR  55  -4.585   4.268  10.690
  407    HB   THR  55           HB       THR  55  -3.357   3.567   8.618
  408    HG1  THR  55           1HG      THR  55  -2.390   6.104   8.949
  409   1HG2  THR  55          1HG2      THR  55  -5.579   3.925   8.639
  410   2HG2  THR  55          2HG2      THR  55  -5.432   5.710   8.515
  411   3HG2  THR  55          3HG2      THR  55  -4.886   4.674   7.168
  412    H    GLY  56           H        GLY  56  -1.678   3.454   9.616
  413   1HA   GLY  56          2HA       GLY  56  -0.558   1.810  11.171
  414   2HA   GLY  56          3HA       GLY  56  -2.062   1.905  12.100
  415    H    THR  57           H        THR  57  -0.689   0.197   9.985
  416    HA   THR  57           HA       THR  57  -1.486  -0.543   7.714
  417    HB   THR  57           HB       THR  57  -1.198  -2.974   8.463
  418    HG1  THR  57           1HG      THR  57  -1.947  -2.889  10.546
  419   1HG2  THR  57          1HG2      THR  57   0.910  -1.068   9.562
  420   2HG2  THR  57          2HG2      THR  57   1.127  -2.728   9.002
  421   3HG2  THR  57          3HG2      THR  57   0.727  -1.463   7.830
  422    H    ALA  58           H        ALA  58  -3.568  -0.895  10.474
  423    HA   ALA  58           HA       ALA  58  -5.721  -2.384   9.848
  424   1HB   ALA  58          1HB       ALA  58  -7.039  -0.623  10.968
  425   2HB   ALA  58          2HB       ALA  58  -5.491  -0.887  11.800
  426   3HB   ALA  58          3HB       ALA  58  -5.693   0.523  10.746
  427    H    ALA  59           H        ALA  59  -5.139   0.825   8.489
  428    HA   ALA  59           HA       ALA  59  -7.777   0.515   7.033
  429   1HB   ALA  59          1HB       ALA  59  -5.820   2.773   6.716
  430   2HB   ALA  59          2HB       ALA  59  -7.470   2.704   6.084
  431   3HB   ALA  59          3HB       ALA  59  -7.230   2.753   7.839
  432    H    ILE  60           H        ILE  60  -4.384   0.748   6.355
  433    HA   ILE  60           HA       ILE  60  -4.370   0.632   3.596
  434    HB   ILE  60           HB       ILE  60  -2.476   0.108   5.852
  435   1HG1  ILE  60          2HG1      ILE  60  -1.040   1.531   4.198
  436   2HG1  ILE  60          3HG1      ILE  60  -2.540   1.733   3.300
  437   1HG2  ILE  60          1HG2      ILE  60  -1.896  -1.857   4.507
  438   2HG2  ILE  60          2HG2      ILE  60  -1.589  -0.778   3.117
  439   3HG2  ILE  60          3HG2      ILE  60  -0.642  -0.627   4.630
  440   1HD1  ILE  60          1HD1      ILE  60  -3.544   2.795   5.358
  441   2HD1  ILE  60          2HD1      ILE  60  -2.085   2.372   6.291
  442   3HD1  ILE  60          3HD1      ILE  60  -1.983   3.565   4.996
  443    H    GLN  61           H        GLN  61  -4.398  -2.091   5.902
  444    HA   GLN  61           HA       GLN  61  -4.149  -4.129   3.887
  445   1HB   GLN  61          2HB       GLN  61  -4.552  -4.075   6.784
  446   2HB   GLN  61          3HB       GLN  61  -5.591  -5.237   5.962
  447   1HG   GLN  61          2HG       GLN  61  -3.749  -6.494   6.494
  448   2HG   GLN  61          3HG       GLN  61  -3.611  -6.190   4.766
  449   1HE2  GLN  61          1HE2      GLN  61  -2.747  -3.246   6.167
  450   2HE2  GLN  61          2HE2      GLN  61  -1.023  -3.563   6.282
  451    H    GLU  62           H        GLU  62  -6.923  -2.753   5.730
  452    HA   GLU  62           HA       GLU  62  -9.035  -4.131   4.663
  453   1HB   GLU  62          2HB       GLU  62  -8.653  -1.670   6.124
  454   2HB   GLU  62          3HB       GLU  62  -9.719  -1.279   4.783
  455   1HG   GLU  62          2HG       GLU  62 -10.161  -3.540   6.770
  456   2HG   GLU  62          3HG       GLU  62 -10.974  -1.968   6.782
  457    H    LYS  63           H        LYS  63  -7.612  -1.128   3.241
  458    HA   LYS  63           HA       LYS  63  -9.225  -1.346   0.898
  459   1HB   LYS  63          2HB       LYS  63  -6.927   0.331   1.876
  460   2HB   LYS  63          3HB       LYS  63  -7.413   0.416   0.205
  461   1HG   LYS  63          2HG       LYS  63  -9.348   0.802   2.540
  462   2HG   LYS  63          3HG       LYS  63  -8.405   2.076   1.789
  463   1HD   LYS  63          2HD       LYS  63 -10.534   2.289   0.896
  464   2HD   LYS  63          3HD       LYS  63  -9.505   1.689  -0.402
  465   1HE   LYS  63          2HE       LYS  63 -10.616  -0.391  -0.440
  466   2HE   LYS  63          3HE       LYS  63 -11.181  -0.244   1.250
  467   1HZ   LYS  63          1HZ       LYS  63 -12.718   1.420   0.523
  468   2HZ   LYS  63          2HZ       LYS  63 -12.194   1.302  -1.036
  469   3HZ   LYS  63          3HZ       LYS  63 -12.942   0.029  -0.317
  470    H    ILE  64           H        ILE  64  -5.894  -2.395   1.661
  471    HA   ILE  64           HA       ILE  64  -4.898  -2.884  -0.826
  472    HB   ILE  64           HB       ILE  64  -4.504  -3.816   1.862
  473   1HG1  ILE  64          2HG1      ILE  64  -3.244  -1.990   0.828
  474   2HG1  ILE  64          3HG1      ILE  64  -2.271  -3.283   1.512
  475   1HG2  ILE  64          1HG2      ILE  64  -4.636  -6.009   1.186
  476   2HG2  ILE  64          2HG2      ILE  64  -3.694  -5.717  -0.298
  477   3HG2  ILE  64          3HG2      ILE  64  -2.925  -5.620   1.306
  478   1HD1  ILE  64          1HD1      ILE  64  -2.089  -4.250  -0.827
  479   2HD1  ILE  64          2HD1      ILE  64  -2.790  -2.728  -1.411
  480   3HD1  ILE  64          3HD1      ILE  64  -1.255  -2.713  -0.514
  481    H    GLU  65           H        GLU  65  -6.867  -4.970   1.365
  482    HA   GLU  65           HA       GLU  65  -7.396  -7.196  -0.279
  483   1HB   GLU  65          2HB       GLU  65  -9.055  -5.952   1.957
  484   2HB   GLU  65          3HB       GLU  65  -9.353  -7.535   1.240
  485   1HG   GLU  65          2HG       GLU  65  -6.760  -6.794   2.616
  486   2HG   GLU  65          3HG       GLU  65  -8.117  -7.598   3.406
  487    H    LYS  66           H        LYS  66  -9.606  -4.396   0.368
  488    HA   LYS  66           HA       LYS  66 -11.544  -5.232  -1.521
  489   1HB   LYS  66          2HB       LYS  66 -10.921  -2.635  -0.144
  490   2HB   LYS  66          3HB       LYS  66 -11.921  -2.560  -1.595
  491   1HG   LYS  66          2HG       LYS  66 -13.524  -2.741   0.006
  492   2HG   LYS  66          3HG       LYS  66 -13.374  -4.414  -0.526
  493   1HD   LYS  66          2HD       LYS  66 -11.862  -4.833   1.482
  494   2HD   LYS  66          3HD       LYS  66 -12.120  -3.150   1.962
  495   1HE   LYS  66          2HE       LYS  66 -14.682  -3.721   1.834
  496   2HE   LYS  66          3HE       LYS  66 -14.159  -5.415   1.832
  497   1HZ   LYS  66          1HZ       LYS  66 -13.525  -3.386   3.898
  498   2HZ   LYS  66          2HZ       LYS  66 -14.615  -4.620   4.081
  499   3HZ   LYS  66          3HZ       LYS  66 -12.978  -4.851   3.974
  500    H    LEU  67           H        LEU  67  -8.603  -3.363  -2.091
  501    HA   LEU  67           HA       LEU  67  -9.247  -2.612  -4.807
  502   1HB   LEU  67          2HB       LEU  67  -6.670  -2.685  -3.231
  503   2HB   LEU  67          3HB       LEU  67  -6.775  -2.102  -4.892
  504    HG   LEU  67           HG       LEU  67  -8.580  -0.927  -2.745
  505   1HD1  LEU  67          1HD1      LEU  67  -6.942   0.837  -2.377
  506   2HD1  LEU  67          2HD1      LEU  67  -6.218  -0.731  -1.972
  507   3HD1  LEU  67          3HD1      LEU  67  -5.811   0.059  -3.499
  508   1HD2  LEU  67          1HD2      LEU  67  -9.149  -0.390  -5.097
  509   2HD2  LEU  67          2HD2      LEU  67  -8.539   1.036  -4.248
  510   3HD2  LEU  67          3HD2      LEU  67  -7.484   0.163  -5.377
  511    H    GLY  68           H        GLY  68  -8.235  -5.588  -3.338
  512   1HA   GLY  68          2HA       GLY  68  -8.360  -7.608  -4.439
  513   2HA   GLY  68          3HA       GLY  68  -8.090  -6.842  -6.007
  514    H    TYR  69           H        TYR  69  -6.129  -6.386  -3.025
  515    HA   TYR  69           HA       TYR  69  -3.904  -8.016  -4.188
  516   1HB   TYR  69          2HB       TYR  69  -3.950  -5.153  -3.389
  517   2HB   TYR  69          3HB       TYR  69  -2.669  -6.089  -2.647
  518    HD1  TYR  69           HD1      TYR  69  -0.661  -6.455  -3.793
  519    HD2  TYR  69           HD2      TYR  69  -4.257  -5.608  -6.018
  520    HE1  TYR  69           HE1      TYR  69   0.664  -6.207  -5.854
  521    HE2  TYR  69           HE2      TYR  69  -2.955  -5.406  -8.064
  522    HH   TYR  69           HH       TYR  69  -0.786  -5.047  -8.896
  523    H    HIS  70           H        HIS  70  -2.370  -8.636  -2.415
  524    HA   HIS  70           HA       HIS  70  -3.376  -8.262   0.341
  525   1HB   HIS  70          2HB       HIS  70  -4.109 -10.548  -0.311
  526   2HB   HIS  70          3HB       HIS  70  -2.446 -10.954  -0.758
  527    HD1  HIS  70           1HD      HIS  70  -4.439  -9.862   2.385
  528    HD2  HIS  70           2HD      HIS  70  -0.989 -11.973   1.199
  529    HE1  HIS  70           1HE      HIS  70  -3.446 -10.902   4.499
  530    H    VAL  71           H        VAL  71  -1.548  -7.569   1.622
  531    HA   VAL  71           HA       VAL  71   1.055  -7.653   0.271
  532    HB   VAL  71           HB       VAL  71   1.746  -6.191   2.028
  533   1HG1  VAL  71          1HG1      VAL  71   0.607  -4.158   1.231
  534   2HG1  VAL  71          2HG1      VAL  71   0.998  -5.271  -0.095
  535   3HG1  VAL  71          3HG1      VAL  71  -0.661  -5.182   0.525
  536   1HG2  VAL  71          1HG2      VAL  71  -1.179  -5.982   2.894
  537   2HG2  VAL  71          2HG2      VAL  71   0.099  -6.788   3.821
  538   3HG2  VAL  71          3HG2      VAL  71   0.179  -5.044   3.532
  539    H    VAL  72           H        VAL  72   2.818  -8.637   1.281
  540    HA   VAL  72           HA       VAL  72   2.066 -10.769   3.238
  541    HB   VAL  72           HB       VAL  72   4.544 -10.867   1.636
  542   1HG1  VAL  72          1HG1      VAL  72   2.772 -13.020   2.838
  543   2HG1  VAL  72          2HG1      VAL  72   4.336 -13.266   2.035
  544   3HG1  VAL  72          3HG1      VAL  72   4.263 -12.386   3.567
  545   1HG2  VAL  72          1HG2      VAL  72   2.818 -10.670  -0.105
  546   2HG2  VAL  72          2HG2      VAL  72   3.333 -12.355   0.003
  547   3HG2  VAL  72          3HG2      VAL  72   1.798 -11.854   0.745
  548    H    ILE  73           H        ILE  73   3.009 -10.721   5.158
  549    HA   ILE  73           HA       ILE  73   4.810  -8.421   5.810
  550    HB   ILE  73           HB       ILE  73   2.916  -9.828   7.679
  551   1HG1  ILE  73          2HG1      ILE  73   1.507  -8.786   6.024
  552   2HG1  ILE  73          3HG1      ILE  73   1.526  -7.855   7.515
  553   1HG2  ILE  73          1HG2      ILE  73   3.352  -7.848   9.086
  554   2HG2  ILE  73          2HG2      ILE  73   4.866  -8.675   8.694
  555   3HG2  ILE  73          3HG2      ILE  73   4.459  -7.191   7.859
  556   1HD1  ILE  73          1HD1      ILE  73   2.990  -7.119   4.968
  557   2HD1  ILE  73          2HD1      ILE  73   1.537  -6.355   5.621
  558   3HD1  ILE  73          3HD1      ILE  73   3.064  -6.188   6.483
  559    H    GLU  74           H        GLU  74   6.555 -10.018   5.009
  560    HA   GLU  74           HA       GLU  74   7.064 -12.270   6.524
  561   1HB   GLU  74          2HB       GLU  74   8.750 -10.676   4.579
  562   2HB   GLU  74          3HB       GLU  74   9.199 -12.254   5.217
  563   1HG   GLU  74          2HG       GLU  74   7.112 -13.245   4.301
  564   2HG   GLU  74          3HG       GLU  74   6.675 -11.682   3.587
  565    H    GLY  75           H        GLY  75   7.532  -9.179   7.278
  566   1HA   GLY  75          2HA       GLY  75   9.479  -9.705   9.519
  567   2HA   GLY  75          3HA       GLY  75   9.144  -8.104   8.835
  568    H    ARG  76           H        ARG  76   7.319 -10.930  10.085
  569    HA   ARG  76           HA       ARG  76   5.067  -9.300  10.776
  570   1HB   ARG  76          2HB       ARG  76   4.821 -11.651  10.031
  571   2HB   ARG  76          3HB       ARG  76   5.717 -12.196  11.454
  572   1HG   ARG  76          2HG       ARG  76   3.309 -12.544  11.715
  573   2HG   ARG  76          3HG       ARG  76   3.936 -11.437  12.933
  574   1HD   ARG  76          2HD       ARG  76   3.085  -9.500  11.415
  575   2HD   ARG  76          3HD       ARG  76   2.362 -10.744  10.405
  576    HE   ARG  76           HE       ARG  76   0.690 -10.997  11.967
  577   1HH1  ARG  76          2HH2      ARG  76   3.417  -9.276  13.537
  578   2HH1  ARG  76          1HH2      ARG  76   2.463  -8.685  14.842
  579   1HH2  ARG  76          2HH1      ARG  76  -0.561 -10.236  13.749
  580   2HH2  ARG  76          1HH1      ARG  76   0.173  -9.279  14.996
  Start of MODEL   24
    1   1H    MET   1          H1        MET   1  -4.473  17.718  15.258
    2   2H    MET   1          H2        MET   1  -5.290  18.763  16.249
    3   3H    MET   1          H3        MET   1  -4.146  19.328  15.195
    4    HA   MET   1           HA       MET   1  -3.272  19.340  17.382
    5   1HB   MET   1          2HB       MET   1  -4.085  16.420  17.278
    6   2HB   MET   1          3HB       MET   1  -2.702  16.935  18.259
    7   1HG   MET   1          2HG       MET   1  -4.039  18.516  19.493
    8   2HG   MET   1          3HG       MET   1  -5.490  18.082  18.570
    9   1HE   MET   1          1HE       MET   1  -6.011  16.680  22.239
   10   2HE   MET   1          2HE       MET   1  -5.030  18.105  21.827
   11   3HE   MET   1          3HE       MET   1  -6.600  17.838  21.022
   12    H    LEU   2           H        LEU   2  -2.107  16.191  16.157
   13    HA   LEU   2           HA       LEU   2   0.002  17.483  14.598
   14   1HB   LEU   2          2HB       LEU   2   0.478  17.367  17.190
   15   2HB   LEU   2          3HB       LEU   2   0.725  15.646  16.928
   16    HG   LEU   2           HG       LEU   2   2.188  17.721  15.237
   17   1HD1  LEU   2          1HD1      LEU   2   3.997  17.751  16.915
   18   2HD1  LEU   2          2HD1      LEU   2   2.496  18.426  17.569
   19   3HD1  LEU   2          3HD1      LEU   2   2.996  16.780  18.019
   20   1HD2  LEU   2          1HD2      LEU   2   2.432  15.305  14.617
   21   2HD2  LEU   2          2HD2      LEU   2   3.953  15.992  15.193
   22   3HD2  LEU   2          3HD2      LEU   2   2.991  14.955  16.264
   23    H    SER   3           H        SER   3   0.667  16.062  13.015
   24    HA   SER   3           HA       SER   3  -0.324  13.248  13.041
   25   1HB   SER   3          2HB       SER   3  -0.543  15.351  10.838
   26   2HB   SER   3          3HB       SER   3  -0.636  13.610  10.535
   27    HG   SER   3           HG       SER   3  -2.359  13.407  11.796
   28    H    GLU   4           H        GLU   4   1.646  12.331  13.497
   29    HA   GLU   4           HA       GLU   4   4.151  13.127  12.323
   30   1HB   GLU   4          2HB       GLU   4   3.095  10.809  13.871
   31   2HB   GLU   4          3HB       GLU   4   4.738  10.814  13.268
   32   1HG   GLU   4          2HG       GLU   4   5.374  12.587  14.558
   33   2HG   GLU   4          3HG       GLU   4   3.715  13.103  14.863
   34    H    GLN   5           H        GLN   5   5.333  11.203  11.063
   35    HA   GLN   5           HA       GLN   5   3.512   9.839   9.179
   36   1HB   GLN   5          2HB       GLN   5   5.973  11.487   8.567
   37   2HB   GLN   5          3HB       GLN   5   5.302  10.365   7.394
   38   1HG   GLN   5          2HG       GLN   5   3.571  12.580   8.620
   39   2HG   GLN   5          3HG       GLN   5   4.708  12.907   7.342
   40   1HE2  GLN   5          1HE2      GLN   5   3.292   9.695   7.099
   41   2HE2  GLN   5          2HE2      GLN   5   2.185  10.135   5.815
   42    H    LYS   6           H        LYS   6   4.341   7.835   8.475
   43    HA   LYS   6           HA       LYS   6   7.110   7.144   9.078
   44   1HB   LYS   6          2HB       LYS   6   4.686   5.538   9.973
   45   2HB   LYS   6          3HB       LYS   6   6.213   4.742   9.651
   46   1HG   LYS   6          2HG       LYS   6   5.899   6.964  11.706
   47   2HG   LYS   6          3HG       LYS   6   5.843   5.226  12.031
   48   1HD   LYS   6          2HD       LYS   6   8.192   5.147  10.820
   49   2HD   LYS   6          3HD       LYS   6   8.176   6.902  10.985
   50   1HE   LYS   6          2HE       LYS   6   9.450   5.977  12.793
   51   2HE   LYS   6          3HE       LYS   6   7.973   6.705  13.445
   52   1HZ   LYS   6          1HZ       LYS   6   8.484   4.541  14.401
   53   2HZ   LYS   6          2HZ       LYS   6   7.040   4.507  13.623
   54   3HZ   LYS   6          3HZ       LYS   6   8.365   3.822  12.925
   55    H    GLU   7           H        GLU   7   7.763   5.321   7.871
   56    HA   GLU   7           HA       GLU   7   6.409   5.012   5.250
   57   1HB   GLU   7          2HB       GLU   7   9.415   4.890   5.641
   58   2HB   GLU   7          3HB       GLU   7   8.455   5.101   4.178
   59   1HG   GLU   7          2HG       GLU   7   9.548   7.175   4.688
   60   2HG   GLU   7          3HG       GLU   7   7.832   7.406   5.058
   61    H    ILE   8           H        ILE   8   5.461   2.960   5.680
   62    HA   ILE   8           HA       ILE   8   7.061   0.913   7.042
   63    HB   ILE   8           HB       ILE   8   4.365   0.862   5.818
   64   1HG1  ILE   8          2HG1      ILE   8   4.128   2.570   7.416
   65   2HG1  ILE   8          3HG1      ILE   8   3.388   1.098   8.061
   66   1HG2  ILE   8          1HG2      ILE   8   5.083  -1.316   6.086
   67   2HG2  ILE   8          2HG2      ILE   8   5.804  -0.961   7.682
   68   3HG2  ILE   8          3HG2      ILE   8   4.027  -1.015   7.475
   69   1HD1  ILE   8          1HD1      ILE   8   4.726   2.163   9.779
   70   2HD1  ILE   8          2HD1      ILE   8   5.465   0.612   9.284
   71   3HD1  ILE   8          3HD1      ILE   8   6.139   2.151   8.694
   72    H    ALA   9           H        ALA   9   7.228  -1.212   5.873
   73    HA   ALA   9           HA       ALA   9   7.530  -1.013   2.938
   74   1HB   ALA   9          1HB       ALA   9   9.763  -0.493   3.952
   75   2HB   ALA   9          2HB       ALA   9   9.707  -2.039   4.815
   76   3HB   ALA   9          3HB       ALA   9   9.751  -2.016   3.038
   77    H    MET  10           H        MET  10   6.453  -2.818   2.118
   78    HA   MET  10           HA       MET  10   6.468  -5.349   3.732
   79   1HB   MET  10          2HB       MET  10   4.058  -4.063   2.405
   80   2HB   MET  10          3HB       MET  10   4.089  -5.699   3.039
   81   1HG   MET  10          2HG       MET  10   3.790  -5.045   5.144
   82   2HG   MET  10          3HG       MET  10   4.866  -3.664   5.054
   83   1HE   MET  10          1HE       MET  10   1.354  -4.588   5.760
   84   2HE   MET  10          2HE       MET  10   2.345  -3.542   6.812
   85   3HE   MET  10          3HE       MET  10   0.862  -2.910   6.051
   86    H    GLN  11           H        GLN  11   5.758  -7.210   2.364
   87    HA   GLN  11           HA       GLN  11   6.914  -7.104  -0.368
   88   1HB   GLN  11          2HB       GLN  11   6.636  -9.111   1.735
   89   2HB   GLN  11          3HB       GLN  11   5.815  -9.663   0.279
   90   1HG   GLN  11          2HG       GLN  11   8.620  -8.597  -0.034
   91   2HG   GLN  11          3HG       GLN  11   8.377 -10.152   0.768
   92   1HE2  GLN  11          1HE2      GLN  11   7.874  -8.431  -2.323
   93   2HE2  GLN  11          2HE2      GLN  11   7.456  -9.876  -3.220
   94    H    VAL  12           H        VAL  12   5.558  -8.340  -2.034
   95    HA   VAL  12           HA       VAL  12   2.689  -7.499  -1.857
   96    HB   VAL  12           HB       VAL  12   4.571  -7.341  -4.250
   97   1HG1  VAL  12          1HG1      VAL  12   1.723  -6.349  -3.790
   98   2HG1  VAL  12          2HG1      VAL  12   2.714  -5.982  -5.215
   99   3HG1  VAL  12          3HG1      VAL  12   2.217  -7.648  -4.903
  100   1HG2  VAL  12          1HG2      VAL  12   3.546  -5.163  -2.387
  101   2HG2  VAL  12          2HG2      VAL  12   5.249  -5.634  -2.616
  102   3HG2  VAL  12          3HG2      VAL  12   4.366  -4.856  -3.927
  103    H    SER  13           H        SER  13   1.153  -8.985  -2.775
  104    HA   SER  13           HA       SER  13   2.093 -11.131  -4.509
  105   1HB   SER  13          2HB       SER  13   1.054 -11.602  -1.690
  106   2HB   SER  13          3HB       SER  13   0.859 -12.828  -2.950
  107    HG   SER  13           HG       SER  13   3.397 -11.686  -2.566
  108    H    GLY  14           H        GLY  14   0.166 -12.497  -5.166
  109   1HA   GLY  14          2HA       GLY  14  -1.915 -12.688  -6.102
  110   2HA   GLY  14          3HA       GLY  14  -2.513 -11.591  -4.845
  111    H    MET  15           H        MET  15  -0.663 -11.591  -7.970
  112    HA   MET  15           HA       MET  15  -1.978  -9.093  -8.777
  113   1HB   MET  15          2HB       MET  15   0.065  -7.877  -8.945
  114   2HB   MET  15          3HB       MET  15  -0.043  -8.493  -7.283
  115   1HG   MET  15          2HG       MET  15   2.124  -9.085  -7.667
  116   2HG   MET  15          3HG       MET  15   1.413 -10.485  -8.463
  117   1HE   MET  15          1HE       MET  15   3.813 -10.748  -9.674
  118   2HE   MET  15          2HE       MET  15   2.399 -11.195 -10.669
  119   3HE   MET  15          3HE       MET  15   3.726 -10.258 -11.386
  120    H    THR  16           H        THR  16  -1.614  -8.551 -10.987
  121    HA   THR  16           HA       THR  16  -0.710 -10.713 -12.785
  122    HB   THR  16           HB       THR  16  -1.483  -8.707 -14.398
  123    HG1  THR  16           1HG      THR  16  -3.358  -8.176 -12.465
  124   1HG2  THR  16          1HG2      THR  16  -3.430 -10.469 -12.840
  125   2HG2  THR  16          2HG2      THR  16  -3.785  -9.609 -14.362
  126   3HG2  THR  16          3HG2      THR  16  -2.569 -10.896 -14.335
  127    H    CYS  17           H        CYS  17  -0.234  -7.146 -12.385
  128    HA   CYS  17           HA       CYS  17   2.585  -7.472 -13.270
  129   1HB   CYS  17          2HB       CYS  17   2.221  -5.854 -15.031
  130   2HB   CYS  17          3HB       CYS  17   1.052  -7.166 -15.227
  131    H    ALA  18           H        ALA  18   3.864  -5.599 -13.131
  132    HA   ALA  18           HA       ALA  18   3.590  -4.101 -10.671
  133   1HB   ALA  18          1HB       ALA  18   5.754  -4.964 -11.545
  134   2HB   ALA  18          2HB       ALA  18   5.610  -3.883 -12.943
  135   3HB   ALA  18          3HB       ALA  18   5.782  -3.205 -11.313
  136    H    ALA  19           H        ALA  19   1.374  -3.507 -12.205
  137    HA   ALA  19           HA       ALA  19   1.737  -0.596 -12.706
  138   1HB   ALA  19          1HB       ALA  19   0.429  -0.628 -14.726
  139   2HB   ALA  19          2HB       ALA  19   1.800  -1.736 -14.936
  140   3HB   ALA  19          3HB       ALA  19   0.173  -2.374 -14.619
  141    H    CYS  20           H        CYS  20  -0.681  -3.304 -12.500
  142    HA   CYS  20           HA       CYS  20  -2.675  -1.780 -11.186
  143   1HB   CYS  20          2HB       CYS  20  -1.823  -4.710 -10.802
  144   2HB   CYS  20          3HB       CYS  20  -3.339  -4.019 -10.205
  145    H    ALA  21           H        ALA  21   0.229  -3.349  -9.986
  146    HA   ALA  21           HA       ALA  21   0.182  -2.918  -7.272
  147   1HB   ALA  21          1HB       ALA  21   1.966  -4.011  -8.638
  148   2HB   ALA  21          2HB       ALA  21   2.499  -2.403  -9.184
  149   3HB   ALA  21          3HB       ALA  21   2.615  -2.859  -7.475
  150    H    ALA  22           H        ALA  22   0.476  -0.408  -9.811
  151    HA   ALA  22           HA       ALA  22   1.237   1.717  -7.956
  152   1HB   ALA  22          1HB       ALA  22   1.837   1.728 -10.397
  153   2HB   ALA  22          2HB       ALA  22   0.109   1.900 -10.779
  154   3HB   ALA  22          3HB       ALA  22   0.939   3.167  -9.862
  155    H    ARG  23           H        ARG  23  -1.659   0.673  -9.770
  156    HA   ARG  23           HA       ARG  23  -3.424   2.721  -9.025
  157   1HB   ARG  23          2HB       ARG  23  -4.085  -0.225  -9.458
  158   2HB   ARG  23          3HB       ARG  23  -5.247   1.110  -9.397
  159   1HG   ARG  23          2HG       ARG  23  -4.111   2.167 -11.348
  160   2HG   ARG  23          3HG       ARG  23  -3.054   0.753 -11.487
  161   1HD   ARG  23          2HD       ARG  23  -6.115   0.760 -11.723
  162   2HD   ARG  23          3HD       ARG  23  -4.969   0.668 -13.042
  163    HE   ARG  23           HE       ARG  23  -4.387  -1.520 -12.559
  164   1HH1  ARG  23          2HH2      ARG  23  -6.699  -0.400 -10.125
  165   2HH1  ARG  23          1HH2      ARG  23  -7.148  -2.001  -9.616
  166   1HH2  ARG  23          2HH1      ARG  23  -4.888  -3.610 -11.837
  167   2HH2  ARG  23          1HH1      ARG  23  -6.170  -3.869 -10.686
  168    H    ILE  24           H        ILE  24  -2.841  -0.433  -7.382
  169    HA   ILE  24           HA       ILE  24  -4.730   0.014  -5.357
  170    HB   ILE  24           HB       ILE  24  -3.767  -1.694  -4.048
  171   1HG1  ILE  24          2HG1      ILE  24  -1.354  -1.213  -5.732
  172   2HG1  ILE  24          3HG1      ILE  24  -1.507  -1.122  -3.958
  173   1HG2  ILE  24          1HG2      ILE  24  -3.250  -2.603  -6.889
  174   2HG2  ILE  24          2HG2      ILE  24  -4.038  -3.442  -5.540
  175   3HG2  ILE  24          3HG2      ILE  24  -4.878  -2.136  -6.378
  176   1HD1  ILE  24          1HD1      ILE  24  -0.212  -3.071  -4.557
  177   2HD1  ILE  24          2HD1      ILE  24  -1.781  -3.584  -3.888
  178   3HD1  ILE  24          3HD1      ILE  24  -1.487  -3.610  -5.653
  179    H    GLU  25           H        GLU  25  -1.233   0.732  -5.262
  180    HA   GLU  25           HA       GLU  25  -1.184   1.986  -2.795
  181   1HB   GLU  25          2HB       GLU  25   0.616   1.577  -5.000
  182   2HB   GLU  25          3HB       GLU  25   0.684   3.293  -4.581
  183   1HG   GLU  25          2HG       GLU  25   2.334   1.892  -3.312
  184   2HG   GLU  25          3HG       GLU  25   1.187   2.729  -2.263
  185    H    LYS  26           H        LYS  26  -2.174   3.371  -5.918
  186    HA   LYS  26           HA       LYS  26  -2.133   6.087  -4.787
  187   1HB   LYS  26          2HB       LYS  26  -3.378   5.264  -7.412
  188   2HB   LYS  26          3HB       LYS  26  -2.967   6.883  -6.825
  189   1HG   LYS  26          2HG       LYS  26  -1.141   4.737  -7.829
  190   2HG   LYS  26          3HG       LYS  26  -1.237   6.423  -8.297
  191   1HD   LYS  26          2HD       LYS  26  -0.248   7.090  -6.103
  192   2HD   LYS  26          3HD       LYS  26  -0.151   5.386  -5.636
  193   1HE   LYS  26          2HE       LYS  26   1.211   5.098  -7.874
  194   2HE   LYS  26          3HE       LYS  26   1.499   6.835  -7.685
  195   1HZ   LYS  26          1HZ       LYS  26   2.173   4.665  -5.804
  196   2HZ   LYS  26          2HZ       LYS  26   3.222   5.618  -6.626
  197   3HZ   LYS  26          3HZ       LYS  26   2.348   6.218  -5.371
  198    H    GLY  27           H        GLY  27  -4.726   3.707  -5.502
  199   1HA   GLY  27          2HA       GLY  27  -6.870   5.357  -4.496
  200   2HA   GLY  27          3HA       GLY  27  -6.853   3.588  -4.530
  201    H    LEU  28           H        LEU  28  -4.560   3.111  -3.008
  202    HA   LEU  28           HA       LEU  28  -5.456   3.166  -0.284
  203   1HB   LEU  28          2HB       LEU  28  -4.137   1.505  -1.278
  204   2HB   LEU  28          3HB       LEU  28  -2.797   2.622  -1.536
  205    HG   LEU  28           HG       LEU  28  -3.885   1.990   1.230
  206   1HD1  LEU  28          1HD1      LEU  28  -1.870   0.541  -0.522
  207   2HD1  LEU  28          2HD1      LEU  28  -1.988   0.299   1.226
  208   3HD1  LEU  28          3HD1      LEU  28  -3.382  -0.065   0.187
  209   1HD2  LEU  28          1HD2      LEU  28  -2.234   3.434   1.865
  210   2HD2  LEU  28          2HD2      LEU  28  -1.028   2.476   0.959
  211   3HD2  LEU  28          3HD2      LEU  28  -1.879   3.799   0.174
  212    H    LYS  29           H        LYS  29  -3.164   5.272  -2.117
  213    HA   LYS  29           HA       LYS  29  -2.509   6.916   0.054
  214   1HB   LYS  29          2HB       LYS  29  -1.491   6.870  -2.322
  215   2HB   LYS  29          3HB       LYS  29  -2.786   7.990  -2.758
  216   1HG   LYS  29          2HG       LYS  29  -1.570   8.942  -0.286
  217   2HG   LYS  29          3HG       LYS  29  -0.296   8.388  -1.339
  218   1HD   LYS  29          2HD       LYS  29  -0.311  10.365  -2.319
  219   2HD   LYS  29          3HD       LYS  29  -1.834   9.964  -3.091
  220   1HE   LYS  29          2HE       LYS  29  -1.474  11.304  -0.361
  221   2HE   LYS  29          3HE       LYS  29  -1.779  12.169  -1.868
  222   1HZ   LYS  29          1HZ       LYS  29  -3.758  11.923  -0.597
  223   2HZ   LYS  29          2HZ       LYS  29  -3.921  10.933  -1.909
  224   3HZ   LYS  29          3HZ       LYS  29  -3.564  10.315  -0.423
  225    H    ARG  30           H        ARG  30  -5.474   6.833  -1.876
  226    HA   ARG  30           HA       ARG  30  -6.285   9.520  -1.092
  227   1HB   ARG  30          2HB       ARG  30  -7.350   7.376  -2.832
  228   2HB   ARG  30          3HB       ARG  30  -8.594   8.172  -1.886
  229   1HG   ARG  30          2HG       ARG  30  -7.598  10.405  -2.662
  230   2HG   ARG  30          3HG       ARG  30  -6.592   9.454  -3.784
  231   1HD   ARG  30          2HD       ARG  30  -8.673   8.522  -4.794
  232   2HD   ARG  30          3HD       ARG  30  -9.634   9.443  -3.605
  233    HE   ARG  30           HE       ARG  30  -7.847  11.144  -5.114
  234   1HH1  ARG  30          2HH2      ARG  30 -10.940   9.475  -5.321
  235   2HH1  ARG  30          1HH2      ARG  30 -11.677  10.611  -6.407
  236   1HH2  ARG  30          2HH1      ARG  30  -8.778  12.682  -6.572
  237   2HH2  ARG  30          1HH1      ARG  30 -10.395  12.471  -7.152
  238    H    MET  31           H        MET  31  -6.060   6.694   0.782
  239    HA   MET  31           HA       MET  31  -8.552   7.084   2.213
  240   1HB   MET  31          2HB       MET  31  -6.032   5.571   3.027
  241   2HB   MET  31          3HB       MET  31  -7.627   5.384   3.750
  242   1HG   MET  31          2HG       MET  31  -6.728   4.590   0.981
  243   2HG   MET  31          3HG       MET  31  -7.316   3.585   2.274
  244   1HE   MET  31          1HE       MET  31 -10.080   5.386   3.003
  245   2HE   MET  31          2HE       MET  31 -11.210   4.463   2.009
  246   3HE   MET  31          3HE       MET  31  -9.960   3.615   2.956
  247    HA   PRO  32           HA       PRO  32  -7.262  10.291   5.023
  248   1HB   PRO  32          2HB       PRO  32  -8.411   9.525   7.404
  249   2HB   PRO  32          3HB       PRO  32  -9.337  10.216   6.041
  250   1HG   PRO  32          2HG       PRO  32  -8.969   7.290   6.712
  251   2HG   PRO  32          3HG       PRO  32 -10.499   8.142   6.349
  252   1HD   PRO  32          2HD       PRO  32  -9.185   6.736   4.482
  253   2HD   PRO  32          3HD       PRO  32  -9.949   8.284   4.024
  254    H    GLY  33           H        GLY  33  -5.672  10.541   6.734
  255   1HA   GLY  33          2HA       GLY  33  -3.859  10.035   7.903
  256   2HA   GLY  33          3HA       GLY  33  -4.297   8.321   7.844
  257    H    VAL  34           H        VAL  34  -4.194   8.668   4.664
  258    HA   VAL  34           HA       VAL  34  -1.283   8.077   4.589
  259    HB   VAL  34           HB       VAL  34  -3.400   7.526   2.525
  260   1HG1  VAL  34          1HG1      VAL  34  -0.540   6.486   3.042
  261   2HG1  VAL  34          2HG1      VAL  34  -1.604   5.845   1.791
  262   3HG1  VAL  34          3HG1      VAL  34  -1.019   7.520   1.696
  263   1HG2  VAL  34          1HG2      VAL  34  -2.352   5.746   4.767
  264   2HG2  VAL  34          2HG2      VAL  34  -4.027   6.278   4.512
  265   3HG2  VAL  34          3HG2      VAL  34  -3.279   5.161   3.370
  266    H    THR  35           H        THR  35   0.155   9.411   3.616
  267    HA   THR  35           HA       THR  35  -0.945  11.802   2.181
  268    HB   THR  35           HB       THR  35   0.904  11.528   4.430
  269    HG1  THR  35           1HG      THR  35  -1.107  12.561   4.505
  270   1HG2  THR  35          1HG2      THR  35   2.100  13.632   3.850
  271   2HG2  THR  35          2HG2      THR  35   2.594  12.247   2.866
  272   3HG2  THR  35          3HG2      THR  35   1.511  13.497   2.186
  273    H    ASP  36           H        ASP  36   1.562   9.219   2.034
  274    HA   ASP  36           HA       ASP  36   1.445   9.711  -0.814
  275   1HB   ASP  36          2HB       ASP  36   3.867  10.505   0.684
  276   2HB   ASP  36          3HB       ASP  36   4.203   9.282  -0.545
  277    H    ALA  37           H        ALA  37   2.384   7.927  -2.006
  278    HA   ALA  37           HA       ALA  37   3.031   5.531  -0.521
  279   1HB   ALA  37          1HB       ALA  37   0.398   5.790  -0.473
  280   2HB   ALA  37          2HB       ALA  37   0.505   5.208  -2.145
  281   3HB   ALA  37          3HB       ALA  37   1.129   4.228  -0.789
  282    H    ASN  38           H        ASN  38   4.068   3.900  -1.762
  283    HA   ASN  38           HA       ASN  38   4.626   4.535  -4.597
  284   1HB   ASN  38          2HB       ASN  38   7.183   4.452  -3.407
  285   2HB   ASN  38          3HB       ASN  38   6.385   5.818  -4.163
  286   1HD2  ASN  38          1HD2      ASN  38   5.953   4.200  -0.935
  287   2HD2  ASN  38          2HD2      ASN  38   6.233   5.698  -0.050
  288    H    VAL  39           H        VAL  39   4.630   2.557  -5.478
  289    HA   VAL  39           HA       VAL  39   5.198   0.235  -3.802
  290    HB   VAL  39           HB       VAL  39   3.133   0.264  -4.897
  291   1HG1  VAL  39          1HG1      VAL  39   4.608   0.797  -7.514
  292   2HG1  VAL  39          2HG1      VAL  39   3.017   0.089  -7.438
  293   3HG1  VAL  39          3HG1      VAL  39   3.285   1.701  -6.762
  294   1HG2  VAL  39          1HG2      VAL  39   3.136  -1.873  -5.645
  295   2HG2  VAL  39          2HG2      VAL  39   4.679  -1.698  -6.529
  296   3HG2  VAL  39          3HG2      VAL  39   4.655  -1.836  -4.751
  297    H    ASN  40           H        ASN  40   7.368  -0.213  -3.644
  298    HA   ASN  40           HA       ASN  40   9.161   0.388  -5.895
  299   1HB   ASN  40          2HB       ASN  40   9.725   0.927  -3.531
  300   2HB   ASN  40          3HB       ASN  40   9.773  -0.806  -3.175
  301   1HD2  ASN  40          1HD2      ASN  40  12.055   0.255  -2.554
  302   2HD2  ASN  40          2HD2      ASN  40  13.271   0.093  -3.812
  303    H    LEU  41           H        LEU  41   7.555  -1.244  -6.963
  304    HA   LEU  41           HA       LEU  41   7.948  -4.039  -6.514
  305   1HB   LEU  41          2HB       LEU  41   6.243  -2.403  -8.091
  306   2HB   LEU  41          3HB       LEU  41   7.107  -3.384  -9.254
  307    HG   LEU  41           HG       LEU  41   4.896  -4.256  -8.449
  308   1HD1  LEU  41          1HD1      LEU  41   7.268  -6.112  -7.938
  309   2HD1  LEU  41          2HD1      LEU  41   5.601  -6.604  -8.292
  310   3HD1  LEU  41          3HD1      LEU  41   6.559  -5.759  -9.520
  311   1HD2  LEU  41          1HD2      LEU  41   5.530  -3.680  -5.934
  312   2HD2  LEU  41          2HD2      LEU  41   4.463  -5.030  -6.358
  313   3HD2  LEU  41          3HD2      LEU  41   6.156  -5.330  -5.941
  314    H    ALA  42           H        ALA  42   9.849  -1.697  -8.180
  315    HA   ALA  42           HA       ALA  42  11.398  -3.181  -9.964
  316   1HB   ALA  42          1HB       ALA  42  11.672  -0.736  -9.482
  317   2HB   ALA  42          2HB       ALA  42  12.393  -1.179  -7.906
  318   3HB   ALA  42          3HB       ALA  42  13.206  -1.643  -9.406
  319    H    THR  43           H        THR  43  11.330  -3.362  -6.403
  320    HA   THR  43           HA       THR  43  13.112  -5.709  -6.635
  321    HB   THR  43           HB       THR  43  14.592  -4.044  -5.817
  322    HG1  THR  43           1HG      THR  43  13.598  -5.720  -3.797
  323   1HG2  THR  43          1HG2      THR  43  14.088  -2.786  -3.671
  324   2HG2  THR  43          2HG2      THR  43  13.193  -2.268  -5.110
  325   3HG2  THR  43          3HG2      THR  43  12.388  -3.266  -3.882
  326    H    GLU  44           H        GLU  44  10.284  -5.561  -6.730
  327    HA   GLU  44           HA       GLU  44   8.369  -6.335  -5.784
  328   1HB   GLU  44          2HB       GLU  44  10.489  -8.288  -4.836
  329   2HB   GLU  44          3HB       GLU  44   8.757  -8.575  -4.676
  330   1HG   GLU  44          2HG       GLU  44   9.442  -9.713  -6.627
  331   2HG   GLU  44          3HG       GLU  44   8.451  -8.341  -7.125
  332    H    THR  45           H        THR  45   9.299  -4.131  -4.159
  333    HA   THR  45           HA       THR  45   8.095  -4.973  -1.575
  334    HB   THR  45           HB       THR  45   9.800  -2.519  -1.688
  335    HG1  THR  45           1HG      THR  45  11.710  -3.759  -1.579
  336   1HG2  THR  45          1HG2      THR  45   8.852  -3.387   0.404
  337   2HG2  THR  45          2HG2      THR  45   9.629  -4.966   0.096
  338   3HG2  THR  45          3HG2      THR  45  10.623  -3.525   0.443
  339    H    VAL  46           H        VAL  46   6.848  -3.243  -0.491
  340    HA   VAL  46           HA       VAL  46   5.989  -1.032  -2.277
  341    HB   VAL  46           HB       VAL  46   4.253  -2.661  -2.496
  342   1HG1  VAL  46          1HG1      VAL  46   4.634  -4.090  -0.520
  343   2HG1  VAL  46          2HG1      VAL  46   4.125  -2.762   0.550
  344   3HG1  VAL  46          3HG1      VAL  46   2.968  -3.522  -0.553
  345   1HG2  VAL  46          1HG2      VAL  46   3.344  -0.545  -0.504
  346   2HG2  VAL  46          2HG2      VAL  46   3.503  -0.349  -2.268
  347   3HG2  VAL  46          3HG2      VAL  46   2.337  -1.510  -1.591
  348    H    ASN  47           H        ASN  47   5.645   0.985  -1.224
  349    HA   ASN  47           HA       ASN  47   6.236   1.003   1.674
  350   1HB   ASN  47          2HB       ASN  47   7.502   2.634  -0.580
  351   2HB   ASN  47          3HB       ASN  47   7.481   3.194   1.094
  352   1HD2  ASN  47          1HD2      ASN  47   8.324   1.528   2.766
  353   2HD2  ASN  47          2HD2      ASN  47   9.883   0.868   2.299
  354    H    VAL  48           H        VAL  48   5.030   2.614   2.807
  355    HA   VAL  48           HA       VAL  48   3.178   4.250   1.218
  356    HB   VAL  48           HB       VAL  48   1.919   2.245   1.509
  357   1HG1  VAL  48          1HG1      VAL  48   2.620   2.351   4.464
  358   2HG1  VAL  48          2HG1      VAL  48   1.358   1.330   3.751
  359   3HG1  VAL  48          3HG1      VAL  48   3.048   1.098   3.291
  360   1HG2  VAL  48          1HG2      VAL  48   0.038   3.134   2.884
  361   2HG2  VAL  48          2HG2      VAL  48   1.064   4.479   3.394
  362   3HG2  VAL  48          3HG2      VAL  48   0.675   4.276   1.686
  363    H    ILE  49           H        ILE  49   3.035   6.204   2.067
  364    HA   ILE  49           HA       ILE  49   4.622   6.731   4.472
  365    HB   ILE  49           HB       ILE  49   3.878   8.699   2.282
  366   1HG1  ILE  49          2HG1      ILE  49   4.996   6.934   1.107
  367   2HG1  ILE  49          3HG1      ILE  49   6.022   8.350   1.203
  368   1HG2  ILE  49          1HG2      ILE  49   5.816   9.950   3.075
  369   2HG2  ILE  49          2HG2      ILE  49   4.661   9.673   4.390
  370   3HG2  ILE  49          3HG2      ILE  49   6.145   8.708   4.302
  371   1HD1  ILE  49          1HD1      ILE  49   6.886   5.812   1.771
  372   2HD1  ILE  49          2HD1      ILE  49   7.636   7.285   2.410
  373   3HD1  ILE  49          3HD1      ILE  49   6.478   6.369   3.385
  374    H    TYR  50           H        TYR  50   3.150   6.761   6.160
  375    HA   TYR  50           HA       TYR  50   0.674   8.394   5.852
  376   1HB   TYR  50          2HB       TYR  50  -0.749   6.687   6.644
  377   2HB   TYR  50          3HB       TYR  50   0.086   6.095   5.245
  378    HD1  TYR  50           HD1      TYR  50   1.593   4.120   5.460
  379    HD2  TYR  50           HD2      TYR  50  -0.302   5.838   8.904
  380    HE1  TYR  50           HE1      TYR  50   1.636   1.912   6.603
  381    HE2  TYR  50           HE2      TYR  50   0.123   3.769  10.170
  382    HH   TYR  50           HH       TYR  50   1.029   1.590  10.050
  383    H    ASP  51           H        ASP  51  -0.458   8.671   7.790
  384    HA   ASP  51           HA       ASP  51   1.325   9.341  10.021
  385   1HB   ASP  51          2HB       ASP  51  -0.219  11.043   9.349
  386   2HB   ASP  51          3HB       ASP  51  -1.589   9.938   9.479
  387    HA   PRO  52           HA       PRO  52   0.038   5.345  11.735
  388   1HB   PRO  52          2HB       PRO  52   1.841   5.071  13.727
  389   2HB   PRO  52          3HB       PRO  52   2.294   4.942  12.003
  390   1HG   PRO  52          2HG       PRO  52   2.484   7.407  13.769
  391   2HG   PRO  52          3HG       PRO  52   3.787   6.677  12.786
  392   1HD   PRO  52          2HD       PRO  52   2.289   8.741  11.876
  393   2HD   PRO  52          3HD       PRO  52   2.783   7.422  10.767
  394    H    ALA  53           H        ALA  53  -0.602   8.461  12.976
  395    HA   ALA  53           HA       ALA  53  -1.849   7.432  15.455
  396   1HB   ALA  53          1HB       ALA  53  -0.649   9.632  15.450
  397   2HB   ALA  53          2HB       ALA  53  -1.808  10.221  14.238
  398   3HB   ALA  53          3HB       ALA  53  -2.377   9.755  15.849
  399    H    GLU  54           H        GLU  54  -2.458   8.229  12.055
  400    HA   GLU  54           HA       GLU  54  -5.349   8.438  12.597
  401   1HB   GLU  54          2HB       GLU  54  -4.129  10.343  11.495
  402   2HB   GLU  54          3HB       GLU  54  -3.920   9.324  10.074
  403   1HG   GLU  54          2HG       GLU  54  -6.399   9.128   9.866
  404   2HG   GLU  54          3HG       GLU  54  -6.601  10.016  11.385
  405    H    THR  55           H        THR  55  -3.022   6.983  10.376
  406    HA   THR  55           HA       THR  55  -4.738   4.588  10.183
  407    HB   THR  55           HB       THR  55  -3.191   3.971   8.118
  408    HG1  THR  55           1HG      THR  55  -3.093   6.769   8.296
  409   1HG2  THR  55          1HG2      THR  55  -4.890   5.003   6.680
  410   2HG2  THR  55          2HG2      THR  55  -5.561   4.123   8.076
  411   3HG2  THR  55          3HG2      THR  55  -5.528   5.910   8.081
  412    H    GLY  56           H        GLY  56  -2.951   2.735   9.630
  413   1HA   GLY  56          2HA       GLY  56  -0.890   2.059  11.296
  414   2HA   GLY  56          3HA       GLY  56  -2.257   2.331  12.396
  415    H    THR  57           H        THR  57  -1.211   0.684   9.742
  416    HA   THR  57           HA       THR  57  -1.785  -0.241   7.997
  417    HB   THR  57           HB       THR  57  -1.786  -2.767   8.269
  418    HG1  THR  57           1HG      THR  57  -1.714  -2.057  11.006
  419   1HG2  THR  57          1HG2      THR  57   0.363  -1.530   8.139
  420   2HG2  THR  57          2HG2      THR  57   0.344  -1.317   9.903
  421   3HG2  THR  57          3HG2      THR  57   0.453  -2.944   9.208
  422    H    ALA  58           H        ALA  58  -4.241  -0.824  10.405
  423    HA   ALA  58           HA       ALA  58  -6.299  -2.042   9.488
  424   1HB   ALA  58          1HB       ALA  58  -6.157   0.874  10.352
  425   2HB   ALA  58          2HB       ALA  58  -7.677  -0.068  10.357
  426   3HB   ALA  58          3HB       ALA  58  -6.318  -0.531  11.414
  427    H    ALA  59           H        ALA  59  -5.504   1.131   7.981
  428    HA   ALA  59           HA       ALA  59  -8.079   0.867   6.471
  429   1HB   ALA  59          1HB       ALA  59  -7.380   3.112   7.170
  430   2HB   ALA  59          2HB       ALA  59  -5.922   2.962   6.128
  431   3HB   ALA  59          3HB       ALA  59  -7.543   2.961   5.407
  432    H    ILE  60           H        ILE  60  -4.651   0.852   5.950
  433    HA   ILE  60           HA       ILE  60  -4.495   0.434   3.177
  434    HB   ILE  60           HB       ILE  60  -2.754   0.114   5.620
  435   1HG1  ILE  60          2HG1      ILE  60  -1.878   1.428   3.146
  436   2HG1  ILE  60          3HG1      ILE  60  -3.355   2.119   3.774
  437   1HG2  ILE  60          1HG2      ILE  60  -1.950  -1.039   2.937
  438   2HG2  ILE  60          2HG2      ILE  60  -0.816  -0.533   4.217
  439   3HG2  ILE  60          3HG2      ILE  60  -1.975  -1.829   4.517
  440   1HD1  ILE  60          1HD1      ILE  60  -1.459   3.331   4.716
  441   2HD1  ILE  60          2HD1      ILE  60  -2.348   2.478   5.987
  442   3HD1  ILE  60          3HD1      ILE  60  -0.801   1.820   5.396
  443    H    GLN  61           H        GLN  61  -4.621  -2.063   5.811
  444    HA   GLN  61           HA       GLN  61  -4.365  -4.174   3.856
  445   1HB   GLN  61          2HB       GLN  61  -4.787  -4.046   6.741
  446   2HB   GLN  61          3HB       GLN  61  -5.825  -5.238   5.946
  447   1HG   GLN  61          2HG       GLN  61  -4.026  -6.522   6.472
  448   2HG   GLN  61          3HG       GLN  61  -3.752  -6.162   4.769
  449   1HE2  GLN  61          1HE2      GLN  61  -2.942  -3.288   5.678
  450   2HE2  GLN  61          2HE2      GLN  61  -1.341  -3.492   6.348
  451    H    GLU  62           H        GLU  62  -7.181  -2.597   5.450
  452    HA   GLU  62           HA       GLU  62  -9.310  -4.104   4.415
  453   1HB   GLU  62          2HB       GLU  62  -8.862  -1.418   5.560
  454   2HB   GLU  62          3HB       GLU  62 -10.061  -1.335   4.293
  455   1HG   GLU  62          2HG       GLU  62 -10.236  -3.419   6.499
  456   2HG   GLU  62          3HG       GLU  62 -10.873  -1.780   6.673
  457    H    LYS  63           H        LYS  63  -7.798  -1.165   3.002
  458    HA   LYS  63           HA       LYS  63  -9.294  -1.374   0.618
  459   1HB   LYS  63          2HB       LYS  63  -6.980   0.255   1.660
  460   2HB   LYS  63          3HB       LYS  63  -7.518   0.414   0.021
  461   1HG   LYS  63          2HG       LYS  63  -9.487   0.540   2.377
  462   2HG   LYS  63          3HG       LYS  63  -8.532   1.919   1.915
  463   1HD   LYS  63          2HD       LYS  63 -10.638   2.240   0.975
  464   2HD   LYS  63          3HD       LYS  63  -9.534   1.911  -0.366
  465   1HE   LYS  63          2HE       LYS  63 -10.523  -0.235  -0.741
  466   2HE   LYS  63          3HE       LYS  63 -11.280  -0.266   0.878
  467   1HZ   LYS  63          1HZ       LYS  63 -12.049   1.507  -1.337
  468   2HZ   LYS  63          2HZ       LYS  63 -12.861   0.168  -0.831
  469   3HZ   LYS  63          3HZ       LYS  63 -12.741   1.469   0.161
  470    H    ILE  64           H        ILE  64  -6.089  -2.514   1.486
  471    HA   ILE  64           HA       ILE  64  -4.961  -3.037  -0.989
  472    HB   ILE  64           HB       ILE  64  -4.701  -3.959   1.760
  473   1HG1  ILE  64          2HG1      ILE  64  -3.337  -2.190   0.652
  474   2HG1  ILE  64          3HG1      ILE  64  -2.440  -3.464   1.461
  475   1HG2  ILE  64          1HG2      ILE  64  -3.151  -5.802   1.264
  476   2HG2  ILE  64          2HG2      ILE  64  -4.873  -6.144   1.109
  477   3HG2  ILE  64          3HG2      ILE  64  -3.891  -5.888  -0.357
  478   1HD1  ILE  64          1HD1      ILE  64  -1.368  -2.998  -0.609
  479   2HD1  ILE  64          2HD1      ILE  64  -2.127  -4.601  -0.735
  480   3HD1  ILE  64          3HD1      ILE  64  -2.874  -3.205  -1.531
  481    H    GLU  65           H        GLU  65  -7.027  -5.068   1.154
  482    HA   GLU  65           HA       GLU  65  -7.590  -7.189  -0.652
  483   1HB   GLU  65          2HB       GLU  65  -8.848  -6.082   1.875
  484   2HB   GLU  65          3HB       GLU  65  -9.698  -7.326   0.966
  485   1HG   GLU  65          2HG       GLU  65  -6.785  -7.667   1.696
  486   2HG   GLU  65          3HG       GLU  65  -8.071  -8.063   2.825
  487    H    LYS  66           H        LYS  66  -9.643  -4.343   0.191
  488    HA   LYS  66           HA       LYS  66 -11.652  -5.005  -1.641
  489   1HB   LYS  66          2HB       LYS  66 -10.949  -2.674  -0.015
  490   2HB   LYS  66          3HB       LYS  66 -11.737  -2.190  -1.514
  491   1HG   LYS  66          2HG       LYS  66 -12.820  -4.294   0.419
  492   2HG   LYS  66          3HG       LYS  66 -13.261  -2.595   0.460
  493   1HD   LYS  66          2HD       LYS  66 -14.854  -2.946  -1.088
  494   2HD   LYS  66          3HD       LYS  66 -13.590  -3.325  -2.265
  495   1HE   LYS  66          2HE       LYS  66 -13.681  -5.758  -1.315
  496   2HE   LYS  66          3HE       LYS  66 -15.153  -5.248  -0.488
  497   1HZ   LYS  66          1HZ       LYS  66 -15.592  -6.284  -2.601
  498   2HZ   LYS  66          2HZ       LYS  66 -16.070  -4.712  -2.665
  499   3HZ   LYS  66          3HZ       LYS  66 -14.670  -5.183  -3.399
  500    H    LEU  67           H        LEU  67  -8.674  -3.301  -2.335
  501    HA   LEU  67           HA       LEU  67  -9.338  -2.551  -5.059
  502   1HB   LEU  67          2HB       LEU  67  -6.800  -2.674  -3.408
  503   2HB   LEU  67          3HB       LEU  67  -6.762  -2.299  -5.123
  504    HG   LEU  67           HG       LEU  67  -8.652  -0.716  -3.374
  505   1HD1  LEU  67          1HD1      LEU  67  -6.724  -0.370  -2.076
  506   2HD1  LEU  67          2HD1      LEU  67  -5.645  -0.441  -3.454
  507   3HD1  LEU  67          3HD1      LEU  67  -6.684   0.980  -3.211
  508   1HD2  LEU  67          1HD2      LEU  67  -7.002  -0.046  -5.859
  509   2HD2  LEU  67          2HD2      LEU  67  -8.723  -0.468  -5.851
  510   3HD2  LEU  67          3HD2      LEU  67  -8.176   1.020  -5.065
  511    H    GLY  68           H        GLY  68  -8.402  -5.514  -3.509
  512   1HA   GLY  68          2HA       GLY  68  -8.573  -7.585  -4.500
  513   2HA   GLY  68          3HA       GLY  68  -8.357  -6.892  -6.110
  514    H    TYR  69           H        TYR  69  -6.338  -6.578  -3.098
  515    HA   TYR  69           HA       TYR  69  -4.090  -8.013  -4.438
  516   1HB   TYR  69          2HB       TYR  69  -4.369  -5.152  -3.950
  517   2HB   TYR  69          3HB       TYR  69  -3.064  -5.792  -2.977
  518    HD1  TYR  69           HD1      TYR  69  -4.411  -5.727  -6.469
  519    HD2  TYR  69           HD2      TYR  69  -0.990  -6.474  -3.958
  520    HE1  TYR  69           HE1      TYR  69  -2.959  -5.584  -8.425
  521    HE2  TYR  69           HE2      TYR  69   0.483  -6.191  -5.912
  522    HH   TYR  69           HH       TYR  69  -0.698  -5.523  -9.192
  523    H    HIS  70           H        HIS  70  -2.257  -8.329  -2.748
  524    HA   HIS  70           HA       HIS  70  -3.092  -8.098   0.035
  525   1HB   HIS  70          2HB       HIS  70  -3.805 -10.432  -1.124
  526   2HB   HIS  70          3HB       HIS  70  -2.152 -10.846  -0.688
  527    HD1  HIS  70           1HD      HIS  70  -5.510 -11.156   0.710
  528    HD2  HIS  70           2HD      HIS  70  -1.890  -9.675   2.210
  529    HE1  HIS  70           1HE      HIS  70  -5.585 -11.468   3.197
  530    H    VAL  71           H        VAL  71  -1.316  -7.417   1.204
  531    HA   VAL  71           HA       VAL  71   1.348  -7.534  -0.005
  532    HB   VAL  71           HB       VAL  71   1.938  -6.217   2.009
  533   1HG1  VAL  71          1HG1      VAL  71   0.936  -4.136   1.245
  534   2HG1  VAL  71          2HG1      VAL  71   1.320  -5.162  -0.154
  535   3HG1  VAL  71          3HG1      VAL  71  -0.348  -5.042   0.429
  536   1HG2  VAL  71          1HG2      VAL  71  -1.038  -6.063   2.623
  537   2HG2  VAL  71          2HG2      VAL  71   0.162  -6.964   3.575
  538   3HG2  VAL  71          3HG2      VAL  71   0.273  -5.203   3.433
  539    H    VAL  72           H        VAL  72   3.181  -8.266   1.490
  540    HA   VAL  72           HA       VAL  72   2.299 -10.503   3.272
  541    HB   VAL  72           HB       VAL  72   4.800 -10.838   1.748
  542   1HG1  VAL  72          1HG1      VAL  72   2.750 -12.783   2.846
  543   2HG1  VAL  72          2HG1      VAL  72   4.307 -13.200   2.104
  544   3HG1  VAL  72          3HG1      VAL  72   4.275 -12.316   3.635
  545   1HG2  VAL  72          1HG2      VAL  72   3.575 -12.184   0.039
  546   2HG2  VAL  72          2HG2      VAL  72   2.038 -11.564   0.677
  547   3HG2  VAL  72          3HG2      VAL  72   3.204 -10.463  -0.094
  548    H    ILE  73           H        ILE  73   3.300 -10.622   5.184
  549    HA   ILE  73           HA       ILE  73   4.943  -8.268   5.890
  550    HB   ILE  73           HB       ILE  73   3.482 -10.051   7.809
  551   1HG1  ILE  73          2HG1      ILE  73   1.754  -9.325   6.295
  552   2HG1  ILE  73          3HG1      ILE  73   1.708  -8.431   7.806
  553   1HG2  ILE  73          1HG2      ILE  73   5.221  -8.552   8.713
  554   2HG2  ILE  73          2HG2      ILE  73   4.526  -7.174   7.851
  555   3HG2  ILE  73          3HG2      ILE  73   3.616  -7.956   9.166
  556   1HD1  ILE  73          1HD1      ILE  73   2.822  -7.307   5.213
  557   2HD1  ILE  73          2HD1      ILE  73   1.225  -6.990   5.905
  558   3HD1  ILE  73          3HD1      ILE  73   2.670  -6.452   6.770
  559    H    GLU  74           H        GLU  74   6.797  -9.577   4.823
  560    HA   GLU  74           HA       GLU  74   7.696 -11.915   6.028
  561   1HB   GLU  74          2HB       GLU  74   8.741  -9.986   3.988
  562   2HB   GLU  74          3HB       GLU  74   9.809 -11.219   4.647
  563   1HG   GLU  74          2HG       GLU  74   7.104 -12.004   3.517
  564   2HG   GLU  74          3HG       GLU  74   8.552 -11.857   2.505
  565    H    GLY  75           H        GLY  75   7.713  -9.124   7.506
  566   1HA   GLY  75          2HA       GLY  75   8.813  -8.311   9.411
  567   2HA   GLY  75          3HA       GLY  75   9.821  -9.769   9.409
  568    H    ARG  76           H        ARG  76   9.438  -6.467   8.073
  569    HA   ARG  76           HA       ARG  76  12.237  -6.357   7.269
  570   1HB   ARG  76          2HB       ARG  76  10.231  -6.923   5.397
  571   2HB   ARG  76          3HB       ARG  76  10.285  -5.164   5.343
  572   1HG   ARG  76          2HG       ARG  76  12.705  -7.011   5.051
  573   2HG   ARG  76          3HG       ARG  76  11.735  -6.419   3.692
  574   1HD   ARG  76          2HD       ARG  76  12.239  -4.096   4.310
  575   2HD   ARG  76          3HD       ARG  76  13.286  -4.651   5.632
  576    HE   ARG  76           HE       ARG  76  14.355  -6.014   3.584
  577   1HH1  ARG  76          2HH2      ARG  76  13.630  -2.592   3.960
  578   2HH1  ARG  76          1HH2      ARG  76  14.749  -2.041   2.748
  579   1HH2  ARG  76          2HH1      ARG  76  15.897  -5.343   2.015
  580   2HH2  ARG  76          1HH1      ARG  76  16.117  -3.663   1.651
  Start of MODEL   25
    1   1H    MET   1          H1        MET   1   2.587  17.606  12.615
    2   2H    MET   1          H2        MET   1   4.171  17.374  13.030
    3   3H    MET   1          H3        MET   1   3.064  16.147  13.155
    4    HA   MET   1           HA       MET   1   3.698  17.177  15.290
    5   1HB   MET   1          2HB       MET   1   2.209  19.499  13.993
    6   2HB   MET   1          3HB       MET   1   2.256  19.273  15.748
    7   1HG   MET   1          2HG       MET   1   4.711  19.296  15.724
    8   2HG   MET   1          3HG       MET   1   4.698  19.630  13.982
    9   1HE   MET   1          1HE       MET   1   5.870  22.971  15.771
   10   2HE   MET   1          2HE       MET   1   6.158  21.321  16.366
   11   3HE   MET   1          3HE       MET   1   6.341  21.687  14.630
   12    H    LEU   2           H        LEU   2   0.418  18.304  14.413
   13    HA   LEU   2           HA       LEU   2  -0.892  16.679  16.242
   14   1HB   LEU   2          2HB       LEU   2  -2.936  17.218  15.035
   15   2HB   LEU   2          3HB       LEU   2  -1.878  18.608  15.227
   16    HG   LEU   2           HG       LEU   2  -1.083  17.750  12.727
   17   1HD1  LEU   2          1HD1      LEU   2  -3.077  17.190  11.430
   18   2HD1  LEU   2          2HD1      LEU   2  -2.870  15.971  12.695
   19   3HD1  LEU   2          3HD1      LEU   2  -4.088  17.244  12.886
   20   1HD2  LEU   2          1HD2      LEU   2  -1.663  20.047  13.346
   21   2HD2  LEU   2          2HD2      LEU   2  -2.484  19.569  11.850
   22   3HD2  LEU   2          3HD2      LEU   2  -3.389  19.620  13.378
   23    H    SER   3           H        SER   3   0.077  15.916  12.947
   24    HA   SER   3           HA       SER   3  -0.354  13.029  13.460
   25   1HB   SER   3          2HB       SER   3  -0.408  14.656  10.861
   26   2HB   SER   3          3HB       SER   3  -0.137  12.909  10.900
   27    HG   SER   3           HG       SER   3  -2.070  12.584  11.819
   28    H    GLU   4           H        GLU   4   1.506  11.823  13.112
   29    HA   GLU   4           HA       GLU   4   4.050  13.160  12.388
   30   1HB   GLU   4          2HB       GLU   4   3.314  10.725  13.914
   31   2HB   GLU   4          3HB       GLU   4   4.725  10.608  12.896
   32   1HG   GLU   4          2HG       GLU   4   5.393  12.835  14.055
   33   2HG   GLU   4          3HG       GLU   4   4.237  12.302  15.273
   34    H    GLN   5           H        GLN   5   5.289  11.372  10.902
   35    HA   GLN   5           HA       GLN   5   3.451   9.964   9.076
   36   1HB   GLN   5          2HB       GLN   5   5.882  11.649   8.412
   37   2HB   GLN   5          3HB       GLN   5   5.172  10.556   7.245
   38   1HG   GLN   5          2HG       GLN   5   3.578  12.826   8.576
   39   2HG   GLN   5          3HG       GLN   5   4.578  13.055   7.169
   40   1HE2  GLN   5          1HE2      GLN   5   3.330   9.908   6.821
   41   2HE2  GLN   5          2HE2      GLN   5   1.966  10.349   5.821
   42    H    LYS   6           H        LYS   6   4.365   7.924   8.537
   43    HA   LYS   6           HA       LYS   6   7.194   7.563   8.797
   44   1HB   LYS   6          2HB       LYS   6   5.373   5.676  10.337
   45   2HB   LYS   6          3HB       LYS   6   7.047   5.329   9.881
   46   1HG   LYS   6          2HG       LYS   6   7.668   7.569  10.984
   47   2HG   LYS   6          3HG       LYS   6   6.084   7.492  11.778
   48   1HD   LYS   6          2HD       LYS   6   6.757   5.309  12.790
   49   2HD   LYS   6          3HD       LYS   6   8.299   5.397  11.898
   50   1HE   LYS   6          2HE       LYS   6   8.735   7.648  13.035
   51   2HE   LYS   6          3HE       LYS   6   7.313   7.356  14.045
   52   1HZ   LYS   6          1HZ       LYS   6   8.428   5.374  14.868
   53   2HZ   LYS   6          2HZ       LYS   6   9.741   5.687  13.917
   54   3HZ   LYS   6          3HZ       LYS   6   9.333   6.726  15.125
   55    H    GLU   7           H        GLU   7   8.022   5.839   7.735
   56    HA   GLU   7           HA       GLU   7   6.617   5.357   5.201
   57   1HB   GLU   7          2HB       GLU   7   9.605   5.124   5.655
   58   2HB   GLU   7          3HB       GLU   7   8.669   5.509   4.215
   59   1HG   GLU   7          2HG       GLU   7   9.658   7.529   4.772
   60   2HG   GLU   7          3HG       GLU   7   8.097   7.737   5.580
   61    H    ILE   8           H        ILE   8   5.591   3.353   5.637
   62    HA   ILE   8           HA       ILE   8   7.081   1.275   7.041
   63    HB   ILE   8           HB       ILE   8   4.434   1.127   5.726
   64   1HG1  ILE   8          2HG1      ILE   8   4.050   3.067   6.961
   65   2HG1  ILE   8          3HG1      ILE   8   3.346   1.693   7.826
   66   1HG2  ILE   8          1HG2      ILE   8   5.723  -0.246   8.050
   67   2HG2  ILE   8          2HG2      ILE   8   4.000  -0.454   7.617
   68   3HG2  ILE   8          3HG2      ILE   8   5.266  -0.964   6.485
   69   1HD1  ILE   8          1HD1      ILE   8   5.988   2.950   8.455
   70   2HD1  ILE   8          2HD1      ILE   8   4.462   3.158   9.361
   71   3HD1  ILE   8          3HD1      ILE   8   5.249   1.555   9.278
   72    H    ALA   9           H        ALA   9   7.300  -0.910   5.941
   73    HA   ALA   9           HA       ALA   9   7.736  -0.754   2.995
   74   1HB   ALA   9          1HB       ALA   9   9.987  -1.744   3.381
   75   2HB   ALA   9          2HB       ALA   9   9.851  -0.126   4.105
   76   3HB   ALA   9          3HB       ALA   9   9.750  -1.551   5.136
   77    H    MET  10           H        MET  10   6.610  -2.494   2.165
   78    HA   MET  10           HA       MET  10   6.615  -5.083   3.674
   79   1HB   MET  10          2HB       MET  10   4.190  -3.519   2.717
   80   2HB   MET  10          3HB       MET  10   4.136  -5.226   3.162
   81   1HG   MET  10          2HG       MET  10   4.795  -4.775   5.418
   82   2HG   MET  10          3HG       MET  10   5.075  -3.067   5.088
   83   1HE   MET  10          1HE       MET  10   1.561  -1.533   4.798
   84   2HE   MET  10          2HE       MET  10   3.312  -1.234   4.844
   85   3HE   MET  10          3HE       MET  10   2.582  -2.053   3.441
   86    H    GLN  11           H        GLN  11   5.436  -6.775   2.252
   87    HA   GLN  11           HA       GLN  11   6.452  -6.641  -0.562
   88   1HB   GLN  11          2HB       GLN  11   6.540  -8.686   1.534
   89   2HB   GLN  11          3HB       GLN  11   5.602  -9.279   0.173
   90   1HG   GLN  11          2HG       GLN  11   8.267  -8.043  -0.472
   91   2HG   GLN  11          3HG       GLN  11   8.227  -9.600   0.355
   92   1HE2  GLN  11          1HE2      GLN  11   7.460  -7.997  -2.668
   93   2HE2  GLN  11          2HE2      GLN  11   7.022  -9.449  -3.569
   94    H    VAL  12           H        VAL  12   4.900  -7.905  -2.120
   95    HA   VAL  12           HA       VAL  12   2.084  -7.806  -1.230
   96    HB   VAL  12           HB       VAL  12   1.503  -6.999  -3.477
   97   1HG1  VAL  12          1HG1      VAL  12   1.593  -5.418  -1.556
   98   2HG1  VAL  12          2HG1      VAL  12   3.275  -5.034  -1.982
   99   3HG1  VAL  12          3HG1      VAL  12   1.963  -4.631  -3.103
  100   1HG2  VAL  12          1HG2      VAL  12   4.420  -6.250  -3.809
  101   2HG2  VAL  12          2HG2      VAL  12   3.622  -7.605  -4.648
  102   3HG2  VAL  12          3HG2      VAL  12   3.073  -5.943  -4.929
  103    H    SER  13           H        SER  13   0.708  -9.019  -2.907
  104    HA   SER  13           HA       SER  13   2.118 -11.096  -4.419
  105   1HB   SER  13          2HB       SER  13   0.285 -11.700  -2.051
  106   2HB   SER  13          3HB       SER  13   0.720 -12.899  -3.284
  107    HG   SER  13           HG       SER  13   2.901 -11.579  -2.270
  108    H    GLY  14           H        GLY  14   0.281 -12.477  -5.545
  109   1HA   GLY  14          2HA       GLY  14  -1.770 -12.598  -6.615
  110   2HA   GLY  14          3HA       GLY  14  -2.264 -11.049  -5.927
  111    H    MET  15           H        MET  15   0.089  -9.573  -6.814
  112    HA   MET  15           HA       MET  15  -0.696  -8.543  -9.205
  113   1HB   MET  15          2HB       MET  15   1.439  -7.433  -9.318
  114   2HB   MET  15          3HB       MET  15   0.991  -7.620  -7.619
  115   1HG   MET  15          2HG       MET  15   3.168  -8.172  -7.489
  116   2HG   MET  15          3HG       MET  15   2.491  -9.784  -7.723
  117   1HE   MET  15          1HE       MET  15   5.567  -8.974  -8.004
  118   2HE   MET  15          2HE       MET  15   4.941 -10.622  -8.240
  119   3HE   MET  15          3HE       MET  15   6.005  -9.891  -9.462
  120    H    THR  16           H        THR  16  -0.356  -8.802 -11.371
  121    HA   THR  16           HA       THR  16   1.091 -11.227 -12.335
  122    HB   THR  16           HB       THR  16  -0.220 -10.400 -14.495
  123    HG1  THR  16           1HG      THR  16  -2.062  -9.632 -12.511
  124   1HG2  THR  16          1HG2      THR  16  -2.110 -11.870 -13.859
  125   2HG2  THR  16          2HG2      THR  16  -0.544 -12.585 -13.440
  126   3HG2  THR  16          3HG2      THR  16  -1.549 -11.861 -12.168
  127    H    CYS  17           H        CYS  17   0.691  -7.664 -12.885
  128    HA   CYS  17           HA       CYS  17   3.378  -7.658 -14.156
  129   1HB   CYS  17          2HB       CYS  17   2.559  -6.245 -15.910
  130   2HB   CYS  17          3HB       CYS  17   1.510  -7.668 -15.848
  131    H    ALA  18           H        ALA  18   4.349  -5.544 -14.232
  132    HA   ALA  18           HA       ALA  18   4.146  -4.156 -11.678
  133   1HB   ALA  18          1HB       ALA  18   6.320  -4.650 -12.727
  134   2HB   ALA  18          2HB       ALA  18   5.885  -3.641 -14.126
  135   3HB   ALA  18          3HB       ALA  18   6.087  -2.902 -12.522
  136    H    ALA  19           H        ALA  19   1.731  -3.818 -12.615
  137    HA   ALA  19           HA       ALA  19   1.624  -0.905 -13.205
  138   1HB   ALA  19          1HB       ALA  19  -0.039  -2.920 -14.774
  139   2HB   ALA  19          2HB       ALA  19  -0.107  -1.155 -14.889
  140   3HB   ALA  19          3HB       ALA  19   1.352  -2.018 -15.411
  141    H    CYS  20           H        CYS  20  -0.519  -3.775 -12.691
  142    HA   CYS  20           HA       CYS  20  -2.588  -2.389 -11.531
  143   1HB   CYS  20          2HB       CYS  20  -1.677  -5.217 -10.760
  144   2HB   CYS  20          3HB       CYS  20  -3.305  -4.546 -10.574
  145    H    ALA  21           H        ALA  21   0.214  -3.739  -9.851
  146    HA   ALA  21           HA       ALA  21  -0.456  -3.187  -7.204
  147   1HB   ALA  21          1HB       ALA  21   2.305  -3.020  -8.463
  148   2HB   ALA  21          2HB       ALA  21   1.928  -3.319  -6.749
  149   3HB   ALA  21          3HB       ALA  21   1.496  -4.524  -7.971
  150    H    ALA  22           H        ALA  22   0.310  -0.838  -9.707
  151    HA   ALA  22           HA       ALA  22   1.016   1.334  -7.893
  152   1HB   ALA  22          1HB       ALA  22  -0.072   1.419 -10.738
  153   2HB   ALA  22          2HB       ALA  22   0.754   2.723  -9.867
  154   3HB   ALA  22          3HB       ALA  22   1.653   1.260 -10.331
  155    H    ARG  23           H        ARG  23  -1.938   0.063  -9.489
  156    HA   ARG  23           HA       ARG  23  -3.515   2.414  -9.020
  157   1HB   ARG  23          2HB       ARG  23  -4.452  -0.469  -9.412
  158   2HB   ARG  23          3HB       ARG  23  -5.432   0.999  -9.506
  159   1HG   ARG  23          2HG       ARG  23  -3.738   1.770 -11.342
  160   2HG   ARG  23          3HG       ARG  23  -3.194   0.088 -11.359
  161   1HD   ARG  23          2HD       ARG  23  -4.880   0.315 -13.105
  162   2HD   ARG  23          3HD       ARG  23  -5.534  -0.657 -11.800
  163    HE   ARG  23           HE       ARG  23  -7.142   0.904 -11.387
  164   1HH1  ARG  23          2HH2      ARG  23  -4.621   2.423 -13.309
  165   2HH1  ARG  23          1HH2      ARG  23  -5.444   3.938 -13.524
  166   1HH2  ARG  23          2HH1      ARG  23  -8.268   2.920 -11.591
  167   2HH2  ARG  23          1HH1      ARG  23  -7.575   4.220 -12.503
  168    H    ILE  24           H        ILE  24  -3.196  -0.699  -7.296
  169    HA   ILE  24           HA       ILE  24  -5.032  -0.095  -5.268
  170    HB   ILE  24           HB       ILE  24  -4.157  -1.841  -3.964
  171   1HG1  ILE  24          2HG1      ILE  24  -1.721  -1.550  -5.654
  172   2HG1  ILE  24          3HG1      ILE  24  -1.858  -1.372  -3.883
  173   1HG2  ILE  24          1HG2      ILE  24  -4.467  -3.605  -5.477
  174   2HG2  ILE  24          2HG2      ILE  24  -5.281  -2.267  -6.288
  175   3HG2  ILE  24          3HG2      ILE  24  -3.668  -2.761  -6.821
  176   1HD1  ILE  24          1HD1      ILE  24  -2.006  -3.920  -5.476
  177   2HD1  ILE  24          2HD1      ILE  24  -0.728  -3.440  -4.354
  178   3HD1  ILE  24          3HD1      ILE  24  -2.352  -3.809  -3.726
  179    H    GLU  25           H        GLU  25  -1.519   0.431  -5.307
  180    HA   GLU  25           HA       GLU  25  -1.290   1.637  -2.834
  181   1HB   GLU  25          2HB       GLU  25   0.504   0.996  -4.754
  182   2HB   GLU  25          3HB       GLU  25   0.423   2.736  -5.015
  183   1HG   GLU  25          2HG       GLU  25   0.634   2.754  -2.316
  184   2HG   GLU  25          3HG       GLU  25   1.238   1.120  -2.555
  185    H    LYS  26           H        LYS  26  -2.130   3.173  -5.939
  186    HA   LYS  26           HA       LYS  26  -1.962   5.863  -4.781
  187   1HB   LYS  26          2HB       LYS  26  -2.711   4.764  -7.475
  188   2HB   LYS  26          3HB       LYS  26  -3.161   6.416  -7.033
  189   1HG   LYS  26          2HG       LYS  26  -0.983   6.359  -8.200
  190   2HG   LYS  26          3HG       LYS  26  -0.880   7.046  -6.576
  191   1HD   LYS  26          2HD       LYS  26   0.019   4.864  -5.740
  192   2HD   LYS  26          3HD       LYS  26  -0.007   4.261  -7.414
  193   1HE   LYS  26          2HE       LYS  26   1.646   5.996  -8.029
  194   2HE   LYS  26          3HE       LYS  26   1.593   6.638  -6.374
  195   1HZ   LYS  26          1HZ       LYS  26   3.461   5.215  -6.589
  196   2HZ   LYS  26          2HZ       LYS  26   2.411   4.433  -5.605
  197   3HZ   LYS  26          3HZ       LYS  26   2.551   3.974  -7.161
  198    H    GLY  27           H        GLY  27  -4.625   3.573  -5.484
  199   1HA   GLY  27          2HA       GLY  27  -6.763   5.178  -4.455
  200   2HA   GLY  27          3HA       GLY  27  -6.673   3.408  -4.444
  201    H    LEU  28           H        LEU  28  -4.330   3.086  -2.906
  202    HA   LEU  28           HA       LEU  28  -5.350   3.224  -0.233
  203   1HB   LEU  28          2HB       LEU  28  -3.934   1.495  -1.179
  204   2HB   LEU  28          3HB       LEU  28  -2.574   2.611  -1.273
  205    HG   LEU  28           HG       LEU  28  -3.909   1.693   1.300
  206   1HD1  LEU  28          1HD1      LEU  28  -1.875   0.262   1.482
  207   2HD1  LEU  28          2HD1      LEU  28  -2.886  -0.171   0.098
  208   3HD1  LEU  28          3HD1      LEU  28  -1.393   0.759  -0.148
  209   1HD2  LEU  28          1HD2      LEU  28  -2.729   3.775   1.720
  210   2HD2  LEU  28          2HD2      LEU  28  -1.593   2.507   2.161
  211   3HD2  LEU  28          3HD2      LEU  28  -1.408   3.333   0.611
  212    H    LYS  29           H        LYS  29  -2.853   5.168  -1.976
  213    HA   LYS  29           HA       LYS  29  -2.161   6.889   0.105
  214   1HB   LYS  29          2HB       LYS  29  -1.111   6.787  -2.204
  215   2HB   LYS  29          3HB       LYS  29  -2.473   7.776  -2.772
  216   1HG   LYS  29          2HG       LYS  29  -1.790   9.367  -0.739
  217   2HG   LYS  29          3HG       LYS  29  -0.295   8.461  -0.779
  218   1HD   LYS  29          2HD       LYS  29  -1.569  10.013  -3.102
  219   2HD   LYS  29          3HD       LYS  29  -0.296  10.624  -2.039
  220   1HE   LYS  29          2HE       LYS  29   1.108   8.598  -2.778
  221   2HE   LYS  29          3HE       LYS  29  -0.081   8.323  -4.048
  222   1HZ   LYS  29          1HZ       LYS  29   0.482  10.646  -4.793
  223   2HZ   LYS  29          2HZ       LYS  29   1.624  10.667  -3.548
  224   3HZ   LYS  29          3HZ       LYS  29   1.814   9.649  -4.750
  225    H    ARG  30           H        ARG  30  -4.967   7.003  -2.060
  226    HA   ARG  30           HA       ARG  30  -5.908   9.561  -1.214
  227   1HB   ARG  30          2HB       ARG  30  -6.932   7.251  -2.806
  228   2HB   ARG  30          3HB       ARG  30  -8.185   8.188  -2.045
  229   1HG   ARG  30          2HG       ARG  30  -6.190   9.960  -3.295
  230   2HG   ARG  30          3HG       ARG  30  -6.730   8.749  -4.438
  231   1HD   ARG  30          2HD       ARG  30  -8.938   9.442  -4.424
  232   2HD   ARG  30          3HD       ARG  30  -8.882  10.134  -2.814
  233    HE   ARG  30           HE       ARG  30  -8.234  11.441  -5.323
  234   1HH1  ARG  30          2HH2      ARG  30  -7.585  11.442  -1.857
  235   2HH1  ARG  30          1HH2      ARG  30  -7.275  13.144  -1.733
  236   1HH2  ARG  30          2HH1      ARG  30  -7.809  13.724  -5.218
  237   2HH2  ARG  30          1HH1      ARG  30  -7.385  14.467  -3.712
  238    H    MET  31           H        MET  31  -5.747   6.839   0.815
  239    HA   MET  31           HA       MET  31  -8.306   7.341   2.131
  240   1HB   MET  31          2HB       MET  31  -5.942   5.600   2.937
  241   2HB   MET  31          3HB       MET  31  -7.556   5.517   3.632
  242   1HG   MET  31          2HG       MET  31  -6.747   4.835   0.787
  243   2HG   MET  31          3HG       MET  31  -7.282   3.759   2.054
  244   1HE   MET  31          1HE       MET  31  -9.883   3.684   2.815
  245   2HE   MET  31          2HE       MET  31  -9.972   5.440   3.073
  246   3HE   MET  31          3HE       MET  31 -11.166   4.646   2.037
  247    HA   PRO  32           HA       PRO  32  -6.984  10.397   5.001
  248   1HB   PRO  32          2HB       PRO  32  -8.240   9.703   7.365
  249   2HB   PRO  32          3HB       PRO  32  -9.073  10.421   5.957
  250   1HG   PRO  32          2HG       PRO  32  -8.856   7.489   6.668
  251   2HG   PRO  32          3HG       PRO  32 -10.333   8.399   6.228
  252   1HD   PRO  32          2HD       PRO  32  -9.019   6.924   4.420
  253   2HD   PRO  32          3HD       PRO  32  -9.654   8.520   3.931
  254    H    GLY  33           H        GLY  33  -5.522  10.759   6.793
  255   1HA   GLY  33          2HA       GLY  33  -3.738  10.314   8.093
  256   2HA   GLY  33          3HA       GLY  33  -4.188   8.610   8.125
  257    H    VAL  34           H        VAL  34  -4.045   8.628   4.977
  258    HA   VAL  34           HA       VAL  34  -1.133   8.204   4.842
  259    HB   VAL  34           HB       VAL  34  -3.209   7.695   2.701
  260   1HG1  VAL  34          1HG1      VAL  34  -0.309   6.824   3.147
  261   2HG1  VAL  34          2HG1      VAL  34  -1.374   6.050   1.979
  262   3HG1  VAL  34          3HG1      VAL  34  -0.954   7.771   1.812
  263   1HG2  VAL  34          1HG2      VAL  34  -3.859   6.354   4.632
  264   2HG2  VAL  34          2HG2      VAL  34  -3.122   5.317   3.418
  265   3HG2  VAL  34          3HG2      VAL  34  -2.192   5.788   4.852
  266    H    THR  35           H        THR  35   0.257   9.439   3.570
  267    HA   THR  35           HA       THR  35  -0.999  11.830   2.274
  268    HB   THR  35           HB       THR  35   0.632  11.878   4.521
  269    HG1  THR  35           1HG      THR  35  -0.013  13.884   2.632
  270   1HG2  THR  35          1HG2      THR  35   2.565  13.232   3.854
  271   2HG2  THR  35          2HG2      THR  35   2.700  11.589   3.211
  272   3HG2  THR  35          3HG2      THR  35   2.228  12.941   2.145
  273    H    ASP  36           H        ASP  36   1.726   9.429   2.085
  274    HA   ASP  36           HA       ASP  36   1.490   9.795  -0.764
  275   1HB   ASP  36          2HB       ASP  36   3.569  11.237   0.471
  276   2HB   ASP  36          3HB       ASP  36   4.359   9.783  -0.144
  277    H    ALA  37           H        ALA  37   3.070   8.268  -1.880
  278    HA   ALA  37           HA       ALA  37   3.612   5.808  -0.506
  279   1HB   ALA  37          1HB       ALA  37   1.229   5.645  -2.401
  280   2HB   ALA  37          2HB       ALA  37   1.883   4.387  -1.321
  281   3HB   ALA  37          3HB       ALA  37   1.050   5.778  -0.637
  282    H    ASN  38           H        ASN  38   4.378   4.043  -1.965
  283    HA   ASN  38           HA       ASN  38   5.430   4.873  -4.506
  284   1HB   ASN  38          2HB       ASN  38   7.851   4.433  -3.046
  285   2HB   ASN  38          3HB       ASN  38   7.342   5.813  -3.995
  286   1HD2  ASN  38          1HD2      ASN  38   6.231   4.621  -0.737
  287   2HD2  ASN  38          2HD2      ASN  38   6.708   6.110   0.074
  288    H    VAL  39           H        VAL  39   4.380   2.893  -4.963
  289    HA   VAL  39           HA       VAL  39   5.151   0.471  -3.863
  290    HB   VAL  39           HB       VAL  39   3.092   0.672  -4.960
  291   1HG1  VAL  39          1HG1      VAL  39   3.042   2.102  -6.705
  292   2HG1  VAL  39          2HG1      VAL  39   4.613   1.635  -7.364
  293   3HG1  VAL  39          3HG1      VAL  39   3.200   0.609  -7.633
  294   1HG2  VAL  39          1HG2      VAL  39   2.988  -1.313  -6.226
  295   2HG2  VAL  39          2HG2      VAL  39   4.714  -1.250  -6.611
  296   3HG2  VAL  39          3HG2      VAL  39   4.171  -1.528  -4.929
  297    H    ASN  40           H        ASN  40   7.346   0.136  -3.699
  298    HA   ASN  40           HA       ASN  40   9.142   0.472  -5.976
  299   1HB   ASN  40          2HB       ASN  40   9.782   1.069  -3.673
  300   2HB   ASN  40          3HB       ASN  40   9.584  -0.614  -3.171
  301   1HD2  ASN  40          1HD2      ASN  40  11.883  -0.405  -2.477
  302   2HD2  ASN  40          2HD2      ASN  40  13.143  -0.600  -3.681
  303    H    LEU  41           H        LEU  41   7.451  -1.138  -6.988
  304    HA   LEU  41           HA       LEU  41   7.813  -3.953  -6.498
  305   1HB   LEU  41          2HB       LEU  41   6.185  -2.232  -8.210
  306   2HB   LEU  41          3HB       LEU  41   6.809  -3.569  -9.148
  307    HG   LEU  41           HG       LEU  41   4.562  -3.851  -8.041
  308   1HD1  LEU  41          1HD1      LEU  41   6.712  -5.950  -7.603
  309   2HD1  LEU  41          2HD1      LEU  41   4.962  -6.256  -7.542
  310   3HD1  LEU  41          3HD1      LEU  41   5.718  -5.723  -9.054
  311   1HD2  LEU  41          1HD2      LEU  41   4.277  -4.200  -5.792
  312   2HD2  LEU  41          2HD2      LEU  41   5.916  -4.822  -5.540
  313   3HD2  LEU  41          3HD2      LEU  41   5.648  -3.086  -5.695
  314    H    ALA  42           H        ALA  42   9.639  -1.642  -8.274
  315    HA   ALA  42           HA       ALA  42  11.117  -3.071 -10.115
  316   1HB   ALA  42          1HB       ALA  42  11.500  -0.679  -9.506
  317   2HB   ALA  42          2HB       ALA  42  12.220  -1.222  -7.964
  318   3HB   ALA  42          3HB       ALA  42  13.002  -1.638  -9.497
  319    H    THR  43           H        THR  43  11.353  -3.239  -6.539
  320    HA   THR  43           HA       THR  43  12.773  -5.809  -6.894
  321    HB   THR  43           HB       THR  43  14.515  -4.274  -6.305
  322    HG1  THR  43           1HG      THR  43  13.655  -5.932  -4.190
  323   1HG2  THR  43          1HG2      THR  43  14.576  -3.042  -4.203
  324   2HG2  THR  43          2HG2      THR  43  13.202  -2.493  -5.178
  325   3HG2  THR  43          3HG2      THR  43  12.940  -3.577  -3.794
  326    H    GLU  44           H        GLU  44  10.046  -5.460  -6.748
  327    HA   GLU  44           HA       GLU  44   8.180  -6.104  -5.617
  328   1HB   GLU  44          2HB       GLU  44  10.336  -8.158  -5.198
  329   2HB   GLU  44          3HB       GLU  44   8.844  -8.364  -4.342
  330   1HG   GLU  44          2HG       GLU  44   7.765  -7.871  -6.784
  331   2HG   GLU  44          3HG       GLU  44   9.315  -8.563  -7.275
  332    H    THR  45           H        THR  45   8.900  -3.956  -4.264
  333    HA   THR  45           HA       THR  45   8.092  -4.669  -1.501
  334    HB   THR  45           HB       THR  45   9.428  -2.236  -1.403
  335    HG1  THR  45           1HG      THR  45  10.320  -2.850  -3.531
  336   1HG2  THR  45          1HG2      THR  45  10.558  -5.011  -0.825
  337   2HG2  THR  45          2HG2      THR  45  11.194  -3.488  -0.165
  338   3HG2  THR  45          3HG2      THR  45   9.572  -4.043   0.297
  339    H    VAL  46           H        VAL  46   6.822  -2.974  -0.475
  340    HA   VAL  46           HA       VAL  46   5.888  -0.796  -2.249
  341    HB   VAL  46           HB       VAL  46   4.111  -2.431  -2.324
  342   1HG1  VAL  46          1HG1      VAL  46   2.865  -3.139  -0.308
  343   2HG1  VAL  46          2HG1      VAL  46   4.520  -3.751  -0.305
  344   3HG1  VAL  46          3HG1      VAL  46   4.079  -2.366   0.721
  345   1HG2  VAL  46          1HG2      VAL  46   3.508  -0.039  -2.191
  346   2HG2  VAL  46          2HG2      VAL  46   2.260  -1.086  -1.498
  347   3HG2  VAL  46          3HG2      VAL  46   3.343  -0.177  -0.429
  348    H    ASN  47           H        ASN  47   5.926   1.203  -1.256
  349    HA   ASN  47           HA       ASN  47   6.454   1.232   1.665
  350   1HB   ASN  47          2HB       ASN  47   7.778   2.790  -0.595
  351   2HB   ASN  47          3HB       ASN  47   7.699   3.441   1.040
  352   1HD2  ASN  47          1HD2      ASN  47   8.441   1.850   2.844
  353   2HD2  ASN  47          2HD2      ASN  47  10.039   1.220   2.491
  354    H    VAL  48           H        VAL  48   5.055   2.660   2.806
  355    HA   VAL  48           HA       VAL  48   3.310   4.406   1.173
  356    HB   VAL  48           HB       VAL  48   2.322   2.547   3.352
  357   1HG1  VAL  48          1HG1      VAL  48   1.232   4.898   3.034
  358   2HG1  VAL  48          2HG1      VAL  48   0.693   4.288   1.468
  359   3HG1  VAL  48          3HG1      VAL  48   0.187   3.486   2.977
  360   1HG2  VAL  48          1HG2      VAL  48   0.968   1.505   1.539
  361   2HG2  VAL  48          2HG2      VAL  48   1.909   2.421   0.343
  362   3HG2  VAL  48          3HG2      VAL  48   2.704   1.212   1.373
  363    H    ILE  49           H        ILE  49   3.215   6.366   2.082
  364    HA   ILE  49           HA       ILE  49   4.710   6.765   4.565
  365    HB   ILE  49           HB       ILE  49   4.030   8.865   2.463
  366   1HG1  ILE  49          2HG1      ILE  49   5.243   7.224   1.215
  367   2HG1  ILE  49          3HG1      ILE  49   6.250   8.632   1.518
  368   1HG2  ILE  49          1HG2      ILE  49   4.663   9.782   4.600
  369   2HG2  ILE  49          2HG2      ILE  49   6.096   8.749   4.691
  370   3HG2  ILE  49          3HG2      ILE  49   5.992  10.025   3.458
  371   1HD1  ILE  49          1HD1      ILE  49   7.380   7.405   3.375
  372   2HD1  ILE  49          2HD1      ILE  49   6.442   5.953   2.952
  373   3HD1  ILE  49          3HD1      ILE  49   7.598   6.641   1.802
  374    H    TYR  50           H        TYR  50   3.163   6.768   6.226
  375    HA   TYR  50           HA       TYR  50   0.786   8.536   5.959
  376   1HB   TYR  50          2HB       TYR  50  -0.737   6.821   6.699
  377   2HB   TYR  50          3HB       TYR  50   0.049   6.315   5.223
  378    HD1  TYR  50           HD1      TYR  50  -0.222   5.724   8.853
  379    HD2  TYR  50           HD2      TYR  50   1.504   4.346   5.165
  380    HE1  TYR  50           HE1      TYR  50   0.435   3.577   9.910
  381    HE2  TYR  50           HE2      TYR  50   1.685   2.078   6.097
  382    HH   TYR  50           HH       TYR  50   1.162   0.704   7.914
  383    H    ASP  51           H        ASP  51  -0.436   8.573   8.039
  384    HA   ASP  51           HA       ASP  51   1.481   9.110  10.231
  385   1HB   ASP  51          2HB       ASP  51  -0.146  10.823   9.748
  386   2HB   ASP  51          3HB       ASP  51  -1.476   9.678   9.911
  387    HA   PRO  52           HA       PRO  52   0.091   4.975  11.586
  388   1HB   PRO  52          2HB       PRO  52   2.001   4.337  13.372
  389   2HB   PRO  52          3HB       PRO  52   2.307   4.361  11.617
  390   1HG   PRO  52          2HG       PRO  52   2.854   6.605  13.603
  391   2HG   PRO  52          3HG       PRO  52   4.007   5.896  12.434
  392   1HD   PRO  52          2HD       PRO  52   2.605   8.166  11.889
  393   2HD   PRO  52          3HD       PRO  52   2.928   6.949  10.615
  394    H    ALA  53           H        ALA  53  -0.278   7.987  13.104
  395    HA   ALA  53           HA       ALA  53  -1.390   6.841  15.591
  396   1HB   ALA  53          1HB       ALA  53  -1.452   9.666  14.472
  397   2HB   ALA  53          2HB       ALA  53  -1.911   9.142  16.100
  398   3HB   ALA  53          3HB       ALA  53  -0.209   9.056  15.591
  399    H    GLU  54           H        GLU  54  -2.213   7.876  12.277
  400    HA   GLU  54           HA       GLU  54  -5.053   7.948  13.042
  401   1HB   GLU  54          2HB       GLU  54  -3.840   9.998  11.986
  402   2HB   GLU  54          3HB       GLU  54  -4.055   9.134  10.459
  403   1HG   GLU  54          2HG       GLU  54  -6.533   8.946  11.036
  404   2HG   GLU  54          3HG       GLU  54  -6.209   9.935  12.471
  405    H    THR  55           H        THR  55  -2.938   6.926  10.353
  406    HA   THR  55           HA       THR  55  -4.607   4.558  10.016
  407    HB   THR  55           HB       THR  55  -2.862   4.173   7.939
  408    HG1  THR  55           1HG      THR  55  -3.737   6.701   7.588
  409   1HG2  THR  55          1HG2      THR  55  -5.558   5.643   8.038
  410   2HG2  THR  55          2HG2      THR  55  -4.821   4.860   6.607
  411   3HG2  THR  55          3HG2      THR  55  -5.304   3.873   8.007
  412    H    GLY  56           H        GLY  56  -3.017   2.736   9.257
  413   1HA   GLY  56          2HA       GLY  56  -0.835   1.985  10.854
  414   2HA   GLY  56          3HA       GLY  56  -2.371   1.483  11.611
  415    H    THR  57           H        THR  57  -2.454  -0.678  10.964
  416    HA   THR  57           HA       THR  57  -1.881  -1.608   8.248
  417    HB   THR  57           HB       THR  57  -2.691  -3.759   9.401
  418    HG1  THR  57           1HG      THR  57  -2.919  -3.582  11.651
  419   1HG2  THR  57          1HG2      THR  57  -0.608  -3.968  10.763
  420   2HG2  THR  57          2HG2      THR  57  -0.268  -3.150   9.227
  421   3HG2  THR  57          3HG2      THR  57  -0.384  -2.207  10.722
  422    H    ALA  58           H        ALA  58  -4.479  -0.991  10.527
  423    HA   ALA  58           HA       ALA  58  -6.640  -2.112   9.644
  424   1HB   ALA  58          1HB       ALA  58  -6.608  -0.593  11.553
  425   2HB   ALA  58          2HB       ALA  58  -6.557   0.811  10.467
  426   3HB   ALA  58          3HB       ALA  58  -7.991  -0.237  10.502
  427    H    ALA  59           H        ALA  59  -5.736   0.996   8.166
  428    HA   ALA  59           HA       ALA  59  -8.254   0.865   6.575
  429   1HB   ALA  59          1HB       ALA  59  -7.654   2.957   5.591
  430   2HB   ALA  59          2HB       ALA  59  -7.365   3.069   7.338
  431   3HB   ALA  59          3HB       ALA  59  -5.997   2.839   6.196
  432    H    ILE  60           H        ILE  60  -4.804   0.573   6.154
  433    HA   ILE  60           HA       ILE  60  -4.678   0.172   3.372
  434    HB   ILE  60           HB       ILE  60  -2.916  -0.417   5.785
  435   1HG1  ILE  60          2HG1      ILE  60  -1.506   0.882   3.822
  436   2HG1  ILE  60          3HG1      ILE  60  -3.113   1.479   3.495
  437   1HG2  ILE  60          1HG2      ILE  60  -2.498  -2.403   4.484
  438   2HG2  ILE  60          2HG2      ILE  60  -2.319  -1.440   2.998
  439   3HG2  ILE  60          3HG2      ILE  60  -1.143  -1.289   4.328
  440   1HD1  ILE  60          1HD1      ILE  60  -1.505   1.688   6.082
  441   2HD1  ILE  60          2HD1      ILE  60  -1.973   3.008   5.007
  442   3HD1  ILE  60          3HD1      ILE  60  -3.217   2.179   5.964
  443    H    GLN  61           H        GLN  61  -4.941  -2.343   5.956
  444    HA   GLN  61           HA       GLN  61  -4.997  -4.424   4.039
  445   1HB   GLN  61          2HB       GLN  61  -5.267  -4.215   6.895
  446   2HB   GLN  61          3HB       GLN  61  -6.594  -5.191   6.281
  447   1HG   GLN  61          2HG       GLN  61  -5.270  -6.956   6.203
  448   2HG   GLN  61          3HG       GLN  61  -4.312  -6.223   4.929
  449   1HE2  GLN  61          1HE2      GLN  61  -2.867  -4.231   6.125
  450   2HE2  GLN  61          2HE2      GLN  61  -1.855  -4.941   7.377
  451    H    GLU  62           H        GLU  62  -7.669  -2.590   5.593
  452    HA   GLU  62           HA       GLU  62  -9.883  -3.843   4.464
  453   1HB   GLU  62          2HB       GLU  62  -9.265  -1.274   5.708
  454   2HB   GLU  62          3HB       GLU  62 -10.323  -0.988   4.341
  455   1HG   GLU  62          2HG       GLU  62 -10.892  -3.026   6.526
  456   2HG   GLU  62          3HG       GLU  62 -11.508  -1.367   6.507
  457    H    LYS  63           H        LYS  63  -8.069  -1.068   3.029
  458    HA   LYS  63           HA       LYS  63  -9.552  -1.183   0.590
  459   1HB   LYS  63          2HB       LYS  63  -7.134   0.259   1.685
  460   2HB   LYS  63          3HB       LYS  63  -7.547   0.378   0.003
  461   1HG   LYS  63          2HG       LYS  63  -9.464   1.028   2.306
  462   2HG   LYS  63          3HG       LYS  63  -8.480   2.167   1.407
  463   1HD   LYS  63          2HD       LYS  63 -10.378   2.503   0.258
  464   2HD   LYS  63          3HD       LYS  63  -9.660   1.252  -0.734
  465   1HE   LYS  63          2HE       LYS  63 -11.447  -0.090  -0.415
  466   2HE   LYS  63          3HE       LYS  63 -11.306  -0.002   1.351
  467   1HZ   LYS  63          1HZ       LYS  63 -13.400   0.785   0.605
  468   2HZ   LYS  63          2HZ       LYS  63 -12.569   2.021   1.289
  469   3HZ   LYS  63          3HZ       LYS  63 -12.714   1.933  -0.353
  470    H    ILE  64           H        ILE  64  -6.417  -2.564   1.567
  471    HA   ILE  64           HA       ILE  64  -5.331  -3.273  -0.836
  472    HB   ILE  64           HB       ILE  64  -5.233  -4.153   1.940
  473   1HG1  ILE  64          2HG1      ILE  64  -3.766  -2.436   0.765
  474   2HG1  ILE  64          3HG1      ILE  64  -2.992  -3.645   1.785
  475   1HG2  ILE  64          1HG2      ILE  64  -3.765  -6.057   1.528
  476   2HG2  ILE  64          2HG2      ILE  64  -5.475  -6.326   1.220
  477   3HG2  ILE  64          3HG2      ILE  64  -4.362  -6.080  -0.155
  478   1HD1  ILE  64          1HD1      ILE  64  -2.332  -4.969  -0.140
  479   2HD1  ILE  64          2HD1      ILE  64  -3.179  -3.861  -1.242
  480   3HD1  ILE  64          3HD1      ILE  64  -1.764  -3.301  -0.318
  481    H    GLU  65           H        GLU  65  -7.605  -5.027   1.368
  482    HA   GLU  65           HA       GLU  65  -8.267  -7.240  -0.259
  483   1HB   GLU  65          2HB       GLU  65  -9.649  -5.823   2.051
  484   2HB   GLU  65          3HB       GLU  65 -10.379  -7.223   1.258
  485   1HG   GLU  65          2HG       GLU  65  -7.523  -7.489   2.165
  486   2HG   GLU  65          3HG       GLU  65  -8.804  -7.482   3.385
  487    H    LYS  66           H        LYS  66 -10.195  -4.207   0.266
  488    HA   LYS  66           HA       LYS  66 -12.226  -4.951  -1.575
  489   1HB   LYS  66          2HB       LYS  66 -11.320  -2.339  -0.395
  490   2HB   LYS  66          3HB       LYS  66 -12.390  -2.289  -1.800
  491   1HG   LYS  66          2HG       LYS  66 -13.849  -2.200   0.007
  492   2HG   LYS  66          3HG       LYS  66 -13.968  -3.851  -0.603
  493   1HD   LYS  66          2HD       LYS  66 -12.308  -4.511   1.283
  494   2HD   LYS  66          3HD       LYS  66 -12.399  -2.837   1.815
  495   1HE   LYS  66          2HE       LYS  66 -13.905  -3.987   3.201
  496   2HE   LYS  66          3HE       LYS  66 -14.918  -3.106   2.069
  497   1HZ   LYS  66          1HZ       LYS  66 -15.130  -5.227   0.860
  498   2HZ   LYS  66          2HZ       LYS  66 -14.160  -5.959   1.980
  499   3HZ   LYS  66          3HZ       LYS  66 -15.623  -5.365   2.429
  500    H    LEU  67           H        LEU  67  -9.144  -3.340  -2.228
  501    HA   LEU  67           HA       LEU  67  -9.683  -2.821  -5.025
  502   1HB   LEU  67          2HB       LEU  67  -7.196  -2.845  -3.293
  503   2HB   LEU  67          3HB       LEU  67  -7.119  -2.568  -5.027
  504    HG   LEU  67           HG       LEU  67  -9.060  -0.898  -3.421
  505   1HD1  LEU  67          1HD1      LEU  67  -7.163  -0.497  -2.089
  506   2HD1  LEU  67          2HD1      LEU  67  -6.055  -0.578  -3.443
  507   3HD1  LEU  67          3HD1      LEU  67  -7.136   0.821  -3.262
  508   1HD2  LEU  67          1HD2      LEU  67  -7.336  -0.343  -5.880
  509   2HD2  LEU  67          2HD2      LEU  67  -9.052  -0.786  -5.910
  510   3HD2  LEU  67          3HD2      LEU  67  -8.550   0.747  -5.184
  511    H    GLY  68           H        GLY  68  -8.909  -5.701  -3.260
  512   1HA   GLY  68          2HA       GLY  68  -9.051  -7.822  -4.104
  513   2HA   GLY  68          3HA       GLY  68  -8.893  -7.221  -5.760
  514    H    TYR  69           H        TYR  69  -6.781  -6.767  -2.850
  515    HA   TYR  69           HA       TYR  69  -4.576  -8.254  -4.208
  516   1HB   TYR  69          2HB       TYR  69  -4.821  -5.376  -3.742
  517   2HB   TYR  69          3HB       TYR  69  -3.469  -6.023  -2.843
  518    HD1  TYR  69           HD1      TYR  69  -1.463  -6.745  -3.943
  519    HD2  TYR  69           HD2      TYR  69  -5.018  -5.931  -6.243
  520    HE1  TYR  69           HE1      TYR  69  -0.109  -6.571  -5.960
  521    HE2  TYR  69           HE2      TYR  69  -3.677  -5.849  -8.294
  522    HH   TYR  69           HH       TYR  69  -0.099  -6.086  -8.252
  523    H    HIS  70           H        HIS  70  -2.676  -8.422  -2.591
  524    HA   HIS  70           HA       HIS  70  -3.504  -8.341   0.213
  525   1HB   HIS  70          2HB       HIS  70  -3.844 -10.721  -0.870
  526   2HB   HIS  70          3HB       HIS  70  -2.095 -10.855  -0.677
  527    HD1  HIS  70           1HD      HIS  70  -1.797  -9.570   2.270
  528    HD2  HIS  70           2HD      HIS  70  -4.868 -12.161   0.978
  529    HE1  HIS  70           1HE      HIS  70  -2.894 -10.507   4.355
  530    H    VAL  71           H        VAL  71  -1.951  -7.428   1.348
  531    HA   VAL  71           HA       VAL  71   0.796  -7.113   0.314
  532    HB   VAL  71           HB       VAL  71  -0.326  -5.139   1.064
  533   1HG1  VAL  71          1HG1      VAL  71  -0.907  -4.751   3.442
  534   2HG1  VAL  71          2HG1      VAL  71  -1.852  -6.110   2.835
  535   3HG1  VAL  71          3HG1      VAL  71  -0.434  -6.407   3.856
  536   1HG2  VAL  71          1HG2      VAL  71   1.940  -5.921   2.910
  537   2HG2  VAL  71          2HG2      VAL  71   2.033  -5.094   1.330
  538   3HG2  VAL  71          3HG2      VAL  71   1.302  -4.281   2.707
  539    H    VAL  72           H        VAL  72   2.593  -7.890   1.598
  540    HA   VAL  72           HA       VAL  72   1.956 -10.053   3.554
  541    HB   VAL  72           HB       VAL  72   4.208 -10.016   1.635
  542   1HG1  VAL  72          1HG1      VAL  72   4.773 -11.256   3.644
  543   2HG1  VAL  72          2HG1      VAL  72   3.261 -12.187   3.524
  544   3HG1  VAL  72          3HG1      VAL  72   4.537 -12.377   2.306
  545   1HG2  VAL  72          1HG2      VAL  72   1.649 -11.666   1.506
  546   2HG2  VAL  72          2HG2      VAL  72   2.143 -10.416   0.340
  547   3HG2  VAL  72          3HG2      VAL  72   3.071 -11.913   0.471
  548    H    ILE  73           H        ILE  73   3.195 -10.073   5.337
  549    HA   ILE  73           HA       ILE  73   4.541  -7.509   5.974
  550    HB   ILE  73           HB       ILE  73   3.354  -9.535   7.866
  551   1HG1  ILE  73          2HG1      ILE  73   1.535  -8.791   6.466
  552   2HG1  ILE  73          3HG1      ILE  73   1.457  -8.013   8.037
  553   1HG2  ILE  73          1HG2      ILE  73   4.969  -8.051   8.934
  554   2HG2  ILE  73          2HG2      ILE  73   4.253  -6.632   8.162
  555   3HG2  ILE  73          3HG2      ILE  73   3.341  -7.539   9.389
  556   1HD1  ILE  73          1HD1      ILE  73   2.442  -6.674   5.486
  557   2HD1  ILE  73          2HD1      ILE  73   0.878  -6.442   6.272
  558   3HD1  ILE  73          3HD1      ILE  73   2.352  -5.918   7.096
  559    H    GLU  74           H        GLU  74   6.474  -8.437   4.826
  560    HA   GLU  74           HA       GLU  74   7.871 -10.585   5.908
  561   1HB   GLU  74          2HB       GLU  74   8.172  -8.750   3.722
  562   2HB   GLU  74          3HB       GLU  74   9.723  -9.117   4.477
  563   1HG   GLU  74          2HG       GLU  74   7.788 -11.302   3.627
  564   2HG   GLU  74          3HG       GLU  74   9.085 -10.678   2.596
  565    H    GLY  75           H        GLY  75   7.451  -7.897   7.493
  566   1HA   GLY  75          2HA       GLY  75   8.465  -6.918   9.365
  567   2HA   GLY  75          3HA       GLY  75   9.537  -8.327   9.413
  568    H    ARG  76           H        ARG  76   8.997  -5.216   7.659
  569    HA   ARG  76           HA       ARG  76  11.831  -4.619   7.640
  570   1HB   ARG  76          2HB       ARG  76  10.065  -5.034   5.213
  571   2HB   ARG  76          3HB       ARG  76  10.872  -3.486   5.341
  572   1HG   ARG  76          2HG       ARG  76  12.385  -4.740   4.103
  573   2HG   ARG  76          3HG       ARG  76  13.055  -4.720   5.731
  574   1HD   ARG  76          2HD       ARG  76  11.695  -7.059   5.926
  575   2HD   ARG  76          3HD       ARG  76  11.729  -6.967   4.185
  576    HE   ARG  76           HE       ARG  76  13.997  -7.336   4.138
  577   1HH1  ARG  76          2HH2      ARG  76  12.940  -7.042   7.540
  578   2HH1  ARG  76          1HH2      ARG  76  14.522  -7.275   8.188
  579   1HH2  ARG  76          2HH1      ARG  76  16.097  -7.668   5.021
  580   2HH2  ARG  76          1HH1      ARG  76  16.338  -7.698   6.738
  Start of MODEL   26
    1   1H    MET   1          H1        MET   1  -2.276  21.085  16.352
    2   2H    MET   1          H2        MET   1  -2.348  20.858  18.005
    3   3H    MET   1          H3        MET   1  -0.892  20.971  17.208
    4    HA   MET   1           HA       MET   1  -1.172  18.682  17.532
    5   1HB   MET   1          2HB       MET   1  -3.981  19.276  16.503
    6   2HB   MET   1          3HB       MET   1  -3.308  17.640  16.522
    7   1HG   MET   1          2HG       MET   1  -3.082  17.625  18.897
    8   2HG   MET   1          3HG       MET   1  -3.436  19.354  19.033
    9   1HE   MET   1          1HE       MET   1  -4.777  17.071  20.821
   10   2HE   MET   1          2HE       MET   1  -5.054  18.822  21.007
   11   3HE   MET   1          3HE       MET   1  -6.436  17.709  20.876
   12    H    LEU   2           H        LEU   2  -0.523  17.214  15.738
   13    HA   LEU   2           HA       LEU   2  -0.705  18.130  13.016
   14   1HB   LEU   2          2HB       LEU   2   1.325  19.295  14.569
   15   2HB   LEU   2          3HB       LEU   2   2.156  17.929  13.841
   16    HG   LEU   2           HG       LEU   2   0.533  19.975  12.251
   17   1HD1  LEU   2          1HD1      LEU   2   2.325  21.129  13.470
   18   2HD1  LEU   2          2HD1      LEU   2   3.518  19.963  12.856
   19   3HD1  LEU   2          3HD1      LEU   2   2.685  21.066  11.739
   20   1HD2  LEU   2          1HD2      LEU   2   2.684  17.961  11.428
   21   2HD2  LEU   2          2HD2      LEU   2   0.963  17.908  10.986
   22   3HD2  LEU   2          3HD2      LEU   2   1.988  19.200  10.365
   23    H    SER   3           H        SER   3  -0.140  16.376  11.655
   24    HA   SER   3           HA       SER   3  -0.017  13.727  12.824
   25   1HB   SER   3          2HB       SER   3  -0.153  14.867   9.989
   26   2HB   SER   3          3HB       SER   3  -0.096  13.148  10.362
   27    HG   SER   3           HG       SER   3  -2.021  13.217  11.273
   28    H    GLU   4           H        GLU   4   1.839  12.745  13.122
   29    HA   GLU   4           HA       GLU   4   4.374  13.462  11.826
   30   1HB   GLU   4          2HB       GLU   4   3.511  11.467  13.815
   31   2HB   GLU   4          3HB       GLU   4   4.621  10.817  12.631
   32   1HG   GLU   4          2HG       GLU   4   5.954  13.024  13.207
   33   2HG   GLU   4          3HG       GLU   4   5.031  12.884  14.701
   34    H    GLN   5           H        GLN   5   5.341  11.488  10.557
   35    HA   GLN   5           HA       GLN   5   3.371  10.083   8.914
   36   1HB   GLN   5          2HB       GLN   5   5.680  11.743   7.892
   37   2HB   GLN   5          3HB       GLN   5   5.003  10.445   6.935
   38   1HG   GLN   5          2HG       GLN   5   2.902  12.307   7.901
   39   2HG   GLN   5          3HG       GLN   5   4.164  13.135   6.985
   40   1HE2  GLN   5          1HE2      GLN   5   2.650   9.869   6.748
   41   2HE2  GLN   5          2HE2      GLN   5   2.268   9.989   5.035
   42    H    LYS   6           H        LYS   6   4.241   8.014   8.331
   43    HA   LYS   6           HA       LYS   6   7.104   7.555   8.768
   44   1HB   LYS   6          2HB       LYS   6   4.940   5.836   9.999
   45   2HB   LYS   6          3HB       LYS   6   6.543   5.207   9.692
   46   1HG   LYS   6          2HG       LYS   6   6.075   7.639  11.459
   47   2HG   LYS   6          3HG       LYS   6   6.168   5.976  12.040
   48   1HD   LYS   6          2HD       LYS   6   8.374   6.078  12.140
   49   2HD   LYS   6          3HD       LYS   6   8.465   6.281  10.384
   50   1HE   LYS   6          2HE       LYS   6   8.364   8.701  10.585
   51   2HE   LYS   6          3HE       LYS   6   8.060   8.610  12.334
   52   1HZ   LYS   6          1HZ       LYS   6  10.288   9.146  11.821
   53   2HZ   LYS   6          2HZ       LYS   6  10.279   7.648  12.503
   54   3HZ   LYS   6          3HZ       LYS   6  10.479   7.814  10.863
   55    H    GLU   7           H        GLU   7   7.881   5.883   7.669
   56    HA   GLU   7           HA       GLU   7   6.467   5.053   5.201
   57   1HB   GLU   7          2HB       GLU   7   9.434   4.751   5.392
   58   2HB   GLU   7          3HB       GLU   7   8.414   5.369   4.113
   59   1HG   GLU   7          2HG       GLU   7   9.723   7.166   4.740
   60   2HG   GLU   7          3HG       GLU   7   8.240   7.530   5.619
   61    H    ILE   8           H        ILE   8   5.595   3.018   5.602
   62    HA   ILE   8           HA       ILE   8   7.316   0.979   6.980
   63    HB   ILE   8           HB       ILE   8   5.479  -0.507   6.882
   64   1HG1  ILE   8          2HG1      ILE   8   3.191   0.348   6.284
   65   2HG1  ILE   8          3HG1      ILE   8   3.974   1.680   5.403
   66   1HG2  ILE   8          1HG2      ILE   8   5.701   0.981   8.767
   67   2HG2  ILE   8          2HG2      ILE   8   4.616   2.151   7.970
   68   3HG2  ILE   8          3HG2      ILE   8   4.026   0.517   8.393
   69   1HD1  ILE   8          1HD1      ILE   8   4.907  -1.119   4.955
   70   2HD1  ILE   8          2HD1      ILE   8   3.318  -0.705   4.298
   71   3HD1  ILE   8          3HD1      ILE   8   4.772   0.196   3.776
   72    H    ALA   9           H        ALA   9   7.662  -1.108   5.822
   73    HA   ALA   9           HA       ALA   9   7.703  -0.887   2.869
   74   1HB   ALA   9          1HB       ALA   9   9.994  -0.322   3.757
   75   2HB   ALA   9          2HB       ALA   9  10.023  -1.879   4.593
   76   3HB   ALA   9          3HB       ALA   9   9.956  -1.830   2.817
   77    H    MET  10           H        MET  10   6.520  -2.720   2.181
   78    HA   MET  10           HA       MET  10   6.748  -5.234   3.787
   79   1HB   MET  10          2HB       MET  10   4.141  -3.801   3.136
   80   2HB   MET  10          3HB       MET  10   4.228  -5.495   3.634
   81   1HG   MET  10          2HG       MET  10   5.273  -3.184   5.282
   82   2HG   MET  10          3HG       MET  10   3.720  -3.967   5.525
   83   1HE   MET  10          1HE       MET  10   4.679  -3.883   8.083
   84   2HE   MET  10          2HE       MET  10   6.142  -4.766   8.592
   85   3HE   MET  10          3HE       MET  10   6.291  -3.348   7.535
   86    H    GLN  11           H        GLN  11   5.401  -7.016   2.594
   87    HA   GLN  11           HA       GLN  11   6.537  -7.024  -0.150
   88   1HB   GLN  11          2HB       GLN  11   5.812  -9.127   1.931
   89   2HB   GLN  11          3HB       GLN  11   5.793  -9.581   0.227
   90   1HG   GLN  11          2HG       GLN  11   8.158  -8.558   1.848
   91   2HG   GLN  11          3HG       GLN  11   7.925 -10.178   1.167
   92   1HE2  GLN  11          1HE2      GLN  11   7.122  -9.794  -1.411
   93   2HE2  GLN  11          2HE2      GLN  11   8.080  -8.577  -2.245
   94    H    VAL  12           H        VAL  12   5.274  -8.027  -1.858
   95    HA   VAL  12           HA       VAL  12   2.377  -7.300  -1.641
   96    HB   VAL  12           HB       VAL  12   4.216  -7.117  -4.065
   97   1HG1  VAL  12          1HG1      VAL  12   1.852  -7.376  -4.684
   98   2HG1  VAL  12          2HG1      VAL  12   1.384  -6.109  -3.523
   99   3HG1  VAL  12          3HG1      VAL  12   2.349  -5.704  -4.952
  100   1HG2  VAL  12          1HG2      VAL  12   3.262  -4.973  -2.129
  101   2HG2  VAL  12          2HG2      VAL  12   4.954  -5.443  -2.431
  102   3HG2  VAL  12          3HG2      VAL  12   4.025  -4.629  -3.689
  103    H    SER  13           H        SER  13   0.869  -8.672  -2.825
  104    HA   SER  13           HA       SER  13   1.920 -10.970  -4.301
  105   1HB   SER  13          2HB       SER  13   0.304 -11.238  -1.731
  106   2HB   SER  13          3HB       SER  13   0.396 -12.529  -2.944
  107    HG   SER  13           HG       SER  13   2.830 -11.431  -2.191
  108    H    GLY  14           H        GLY  14  -0.149 -12.229  -5.161
  109   1HA   GLY  14          2HA       GLY  14  -2.219 -12.166  -6.188
  110   2HA   GLY  14          3HA       GLY  14  -2.522 -10.546  -5.550
  111    H    MET  15           H        MET  15  -0.146  -9.307  -6.538
  112    HA   MET  15           HA       MET  15  -0.734  -8.247  -8.913
  113   1HB   MET  15          2HB       MET  15   1.564  -7.516  -9.056
  114   2HB   MET  15          3HB       MET  15   1.146  -7.664  -7.343
  115   1HG   MET  15          2HG       MET  15   3.176  -8.705  -7.292
  116   2HG   MET  15          3HG       MET  15   2.168 -10.106  -7.642
  117   1HE   MET  15          1HE       MET  15   5.180 -11.180  -9.721
  118   2HE   MET  15          2HE       MET  15   5.046 -10.615  -8.039
  119   3HE   MET  15          3HE       MET  15   3.807 -11.703  -8.720
  120    H    THR  16           H        THR  16  -0.453  -8.517 -11.080
  121    HA   THR  16           HA       THR  16   0.707 -11.066 -12.109
  122    HB   THR  16           HB       THR  16  -0.708 -10.110 -14.217
  123    HG1  THR  16           1HG      THR  16  -2.308  -9.527 -11.956
  124   1HG2  THR  16          1HG2      THR  16  -2.519 -11.684 -13.514
  125   2HG2  THR  16          2HG2      THR  16  -0.897 -12.376 -13.358
  126   3HG2  THR  16          3HG2      THR  16  -1.758 -11.819 -11.908
  127    H    CYS  17           H        CYS  17   0.487  -7.492 -12.776
  128    HA   CYS  17           HA       CYS  17   3.112  -7.746 -14.154
  129   1HB   CYS  17          2HB       CYS  17   2.349  -6.337 -15.928
  130   2HB   CYS  17          3HB       CYS  17   1.189  -7.665 -15.777
  131    H    ALA  18           H        ALA  18   4.229  -5.702 -14.355
  132    HA   ALA  18           HA       ALA  18   4.274  -4.273 -11.818
  133   1HB   ALA  18          1HB       ALA  18   6.338  -4.954 -12.987
  134   2HB   ALA  18          2HB       ALA  18   5.911  -3.914 -14.364
  135   3HB   ALA  18          3HB       ALA  18   6.261  -3.194 -12.779
  136    H    ALA  19           H        ALA  19   1.844  -3.762 -12.642
  137    HA   ALA  19           HA       ALA  19   1.906  -0.864 -13.298
  138   1HB   ALA  19          1HB       ALA  19   0.151  -1.024 -14.947
  139   2HB   ALA  19          2HB       ALA  19   1.499  -2.054 -15.462
  140   3HB   ALA  19          3HB       ALA  19   0.041  -2.779 -14.756
  141    H    CYS  20           H        CYS  20  -0.367  -3.601 -12.617
  142    HA   CYS  20           HA       CYS  20  -2.333  -2.042 -11.476
  143   1HB   CYS  20          2HB       CYS  20  -1.636  -4.906 -10.662
  144   2HB   CYS  20          3HB       CYS  20  -3.201  -4.086 -10.474
  145    H    ALA  21           H        ALA  21   0.440  -3.474  -9.799
  146    HA   ALA  21           HA       ALA  21  -0.211  -2.776  -7.179
  147   1HB   ALA  21          1HB       ALA  21   2.595  -2.715  -8.335
  148   2HB   ALA  21          2HB       ALA  21   2.083  -3.096  -6.671
  149   3HB   ALA  21          3HB       ALA  21   1.714  -4.215  -7.980
  150    H    ALA  22           H        ALA  22   0.682  -0.580  -9.796
  151    HA   ALA  22           HA       ALA  22   1.496   1.627  -8.068
  152   1HB   ALA  22          1HB       ALA  22   2.107   1.458 -10.494
  153   2HB   ALA  22          2HB       ALA  22   0.388   1.650 -10.911
  154   3HB   ALA  22          3HB       ALA  22   1.248   2.960 -10.090
  155    H    ARG  23           H        ARG  23  -1.461   0.531  -9.752
  156    HA   ARG  23           HA       ARG  23  -3.099   2.784  -9.156
  157   1HB   ARG  23          2HB       ARG  23  -3.737  -0.119  -9.779
  158   2HB   ARG  23          3HB       ARG  23  -4.987   1.096  -9.536
  159   1HG   ARG  23          2HG       ARG  23  -4.588   2.187 -11.478
  160   2HG   ARG  23          3HG       ARG  23  -2.847   1.898 -11.463
  161   1HD   ARG  23          2HD       ARG  23  -2.956  -0.125 -12.487
  162   2HD   ARG  23          3HD       ARG  23  -4.545  -0.553 -11.882
  163    HE   ARG  23           HE       ARG  23  -3.860   0.873 -14.324
  164   1HH1  ARG  23          2HH2      ARG  23  -6.392   0.385 -11.936
  165   2HH1  ARG  23          1HH2      ARG  23  -7.723   0.681 -13.013
  166   1HH2  ARG  23          2HH1      ARG  23  -5.590   1.343 -15.800
  167   2HH2  ARG  23          1HH1      ARG  23  -7.237   1.283 -15.266
  168    H    ILE  24           H        ILE  24  -2.646  -0.351  -7.411
  169    HA   ILE  24           HA       ILE  24  -4.571   0.286  -5.441
  170    HB   ILE  24           HB       ILE  24  -3.838  -1.399  -4.082
  171   1HG1  ILE  24          2HG1      ILE  24  -1.243  -1.187  -5.519
  172   2HG1  ILE  24          3HG1      ILE  24  -1.592  -1.015  -3.783
  173   1HG2  ILE  24          1HG2      ILE  24  -3.214  -2.406  -6.883
  174   2HG2  ILE  24          2HG2      ILE  24  -4.063  -3.214  -5.546
  175   3HG2  ILE  24          3HG2      ILE  24  -4.847  -1.894  -6.405
  176   1HD1  ILE  24          1HD1      ILE  24  -0.443  -3.102  -4.139
  177   2HD1  ILE  24          2HD1      ILE  24  -2.136  -3.452  -3.711
  178   3HD1  ILE  24          3HD1      ILE  24  -1.590  -3.541  -5.413
  179    H    GLU  25           H        GLU  25  -0.996   0.780  -5.150
  180    HA   GLU  25           HA       GLU  25  -1.096   2.245  -2.775
  181   1HB   GLU  25          2HB       GLU  25   0.804   2.051  -5.072
  182   2HB   GLU  25          3HB       GLU  25   0.982   3.470  -4.025
  183   1HG   GLU  25          2HG       GLU  25   2.370   1.505  -3.312
  184   2HG   GLU  25          3HG       GLU  25   1.295   2.115  -2.058
  185    H    LYS  26           H        LYS  26  -1.732   3.496  -6.064
  186    HA   LYS  26           HA       LYS  26  -1.672   6.237  -5.100
  187   1HB   LYS  26          2HB       LYS  26  -2.525   5.109  -7.739
  188   2HB   LYS  26          3HB       LYS  26  -2.917   6.758  -7.260
  189   1HG   LYS  26          2HG       LYS  26  -0.928   7.031  -8.398
  190   2HG   LYS  26          3HG       LYS  26  -0.438   7.142  -6.700
  191   1HD   LYS  26          2HD       LYS  26   0.333   4.762  -6.782
  192   2HD   LYS  26          3HD       LYS  26  -0.363   4.680  -8.396
  193   1HE   LYS  26          2HE       LYS  26   1.908   4.906  -8.872
  194   2HE   LYS  26          3HE       LYS  26   1.301   6.549  -9.078
  195   1HZ   LYS  26          1HZ       LYS  26   2.701   5.466  -6.704
  196   2HZ   LYS  26          2HZ       LYS  26   3.328   6.496  -7.817
  197   3HZ   LYS  26          3HZ       LYS  26   2.130   6.998  -6.810
  198    H    GLY  27           H        GLY  27  -4.305   3.910  -5.840
  199   1HA   GLY  27          2HA       GLY  27  -6.489   5.625  -5.078
  200   2HA   GLY  27          3HA       GLY  27  -6.507   3.856  -5.143
  201    H    LEU  28           H        LEU  28  -4.331   3.396  -3.328
  202    HA   LEU  28           HA       LEU  28  -5.756   3.375  -0.871
  203   1HB   LEU  28          2HB       LEU  28  -4.108   1.686  -1.409
  204   2HB   LEU  28          3HB       LEU  28  -2.824   2.885  -1.516
  205    HG   LEU  28           HG       LEU  28  -2.757   1.427   0.463
  206   1HD1  LEU  28          1HD1      LEU  28  -3.078   4.301   1.351
  207   2HD1  LEU  28          2HD1      LEU  28  -2.048   3.032   1.999
  208   3HD1  LEU  28          3HD1      LEU  28  -1.696   3.701   0.400
  209   1HD2  LEU  28          1HD2      LEU  28  -4.924   1.021   1.120
  210   2HD2  LEU  28          2HD2      LEU  28  -4.311   2.079   2.398
  211   3HD2  LEU  28          3HD2      LEU  28  -5.392   2.736   1.180
  212    H    LYS  29           H        LYS  29  -3.076   5.471  -2.107
  213    HA   LYS  29           HA       LYS  29  -2.884   7.121   0.137
  214   1HB   LYS  29          2HB       LYS  29  -1.432   7.163  -1.928
  215   2HB   LYS  29          3HB       LYS  29  -2.717   8.081  -2.724
  216   1HG   LYS  29          2HG       LYS  29  -2.356   9.521  -0.342
  217   2HG   LYS  29          3HG       LYS  29  -0.770   8.882  -0.597
  218   1HD   LYS  29          2HD       LYS  29  -2.313  10.266  -2.843
  219   2HD   LYS  29          3HD       LYS  29  -1.528  11.216  -1.585
  220   1HE   LYS  29          2HE       LYS  29   0.561  10.864  -2.302
  221   2HE   LYS  29          3HE       LYS  29   0.282   9.158  -2.736
  222   1HZ   LYS  29          1HZ       LYS  29   0.832  10.532  -4.549
  223   2HZ   LYS  29          2HZ       LYS  29  -0.686   9.900  -4.752
  224   3HZ   LYS  29          3HZ       LYS  29  -0.489  11.492  -4.329
  225    H    ARG  30           H        ARG  30  -5.647   6.946  -2.089
  226    HA   ARG  30           HA       ARG  30  -6.623   9.601  -1.342
  227   1HB   ARG  30          2HB       ARG  30  -7.417   7.516  -3.251
  228   2HB   ARG  30          3HB       ARG  30  -8.789   8.066  -2.307
  229   1HG   ARG  30          2HG       ARG  30  -8.696   9.474  -4.188
  230   2HG   ARG  30          3HG       ARG  30  -8.075  10.448  -2.852
  231   1HD   ARG  30          2HD       ARG  30  -5.715   9.529  -3.642
  232   2HD   ARG  30          3HD       ARG  30  -6.524   9.150  -5.150
  233    HE   ARG  30           HE       ARG  30  -5.647  11.708  -4.142
  234   1HH1  ARG  30          2HH2      ARG  30  -8.222  10.303  -6.076
  235   2HH1  ARG  30          1HH2      ARG  30  -8.593  11.753  -6.959
  236   1HH2  ARG  30          2HH1      ARG  30  -6.076  13.660  -5.294
  237   2HH2  ARG  30          1HH1      ARG  30  -7.316  13.711  -6.500
  238    H    MET  31           H        MET  31  -6.390   6.726   0.433
  239    HA   MET  31           HA       MET  31  -8.929   6.848   1.768
  240   1HB   MET  31          2HB       MET  31  -8.147   5.012   2.981
  241   2HB   MET  31          3HB       MET  31  -7.380   4.851   1.411
  242   1HG   MET  31          2HG       MET  31  -5.446   4.625   2.513
  243   2HG   MET  31          3HG       MET  31  -5.516   6.321   2.928
  244   1HE   MET  31          1HE       MET  31  -6.296   2.535   5.110
  245   2HE   MET  31          2HE       MET  31  -7.878   3.221   4.666
  246   3HE   MET  31          3HE       MET  31  -6.634   2.893   3.432
  247    HA   PRO  32           HA       PRO  32  -7.885   9.850   4.906
  248   1HB   PRO  32          2HB       PRO  32  -9.213   9.029   7.135
  249   2HB   PRO  32          3HB       PRO  32 -10.042   9.664   5.682
  250   1HG   PRO  32          2HG       PRO  32  -9.596   6.765   6.443
  251   2HG   PRO  32          3HG       PRO  32 -11.100   7.560   5.904
  252   1HD   PRO  32          2HD       PRO  32  -9.489   6.154   4.216
  253   2HD   PRO  32          3HD       PRO  32 -10.385   7.593   3.650
  254    H    GLY  33           H        GLY  33  -5.842   9.860   5.511
  255   1HA   GLY  33          2HA       GLY  33  -4.540   9.621   7.573
  256   2HA   GLY  33          3HA       GLY  33  -4.857   7.889   7.564
  257    H    VAL  34           H        VAL  34  -4.375   7.751   4.518
  258    HA   VAL  34           HA       VAL  34  -1.413   7.748   4.686
  259    HB   VAL  34           HB       VAL  34  -3.233   6.815   2.464
  260   1HG1  VAL  34          1HG1      VAL  34  -0.209   6.630   2.859
  261   2HG1  VAL  34          2HG1      VAL  34  -1.118   5.774   1.600
  262   3HG1  VAL  34          3HG1      VAL  34  -1.043   7.531   1.580
  263   1HG2  VAL  34          1HG2      VAL  34  -2.398   5.598   4.987
  264   2HG2  VAL  34          2HG2      VAL  34  -3.422   4.931   3.715
  265   3HG2  VAL  34          3HG2      VAL  34  -1.672   4.722   3.639
  266    H    THR  35           H        THR  35  -0.074   9.105   3.559
  267    HA   THR  35           HA       THR  35  -1.391  11.461   2.260
  268    HB   THR  35           HB       THR  35   0.807  11.291   4.224
  269    HG1  THR  35           1HG      THR  35  -0.533  12.887   5.176
  270   1HG2  THR  35          1HG2      THR  35   1.141  13.751   3.843
  271   2HG2  THR  35          2HG2      THR  35   1.756  12.730   2.537
  272   3HG2  THR  35          3HG2      THR  35   0.211  13.596   2.332
  273    H    ASP  36           H        ASP  36   1.452   9.172   2.123
  274    HA   ASP  36           HA       ASP  36   1.253   9.619  -0.694
  275   1HB   ASP  36          2HB       ASP  36   3.376  10.954   0.482
  276   2HB   ASP  36          3HB       ASP  36   4.109   9.430  -0.042
  277    H    ALA  37           H        ALA  37   2.547   8.044  -1.927
  278    HA   ALA  37           HA       ALA  37   2.988   5.501  -0.609
  279   1HB   ALA  37          1HB       ALA  37   0.462   5.584  -0.583
  280   2HB   ALA  37          2HB       ALA  37   0.502   5.621  -2.361
  281   3HB   ALA  37          3HB       ALA  37   1.127   4.214  -1.473
  282    H    ASN  38           H        ASN  38   4.059   3.920  -1.840
  283    HA   ASN  38           HA       ASN  38   4.706   4.582  -4.638
  284   1HB   ASN  38          2HB       ASN  38   7.233   4.352  -3.392
  285   2HB   ASN  38          3HB       ASN  38   6.526   5.756  -4.167
  286   1HD2  ASN  38          1HD2      ASN  38   5.913   4.208  -0.937
  287   2HD2  ASN  38          2HD2      ASN  38   6.295   5.684  -0.052
  288    H    VAL  39           H        VAL  39   4.282   2.558  -5.395
  289    HA   VAL  39           HA       VAL  39   5.079   0.234  -3.852
  290    HB   VAL  39           HB       VAL  39   3.038   0.448  -5.334
  291   1HG1  VAL  39          1HG1      VAL  39   4.137   1.403  -7.356
  292   2HG1  VAL  39          2HG1      VAL  39   4.981  -0.143  -7.607
  293   3HG1  VAL  39          3HG1      VAL  39   3.228  -0.080  -7.690
  294   1HG2  VAL  39          1HG2      VAL  39   4.637  -1.785  -4.662
  295   2HG2  VAL  39          2HG2      VAL  39   2.925  -1.735  -5.085
  296   3HG2  VAL  39          3HG2      VAL  39   4.138  -2.005  -6.351
  297    H    ASN  40           H        ASN  40   7.082  -0.826  -4.065
  298    HA   ASN  40           HA       ASN  40   8.971   0.191  -6.150
  299   1HB   ASN  40          2HB       ASN  40   9.492   0.863  -3.792
  300   2HB   ASN  40          3HB       ASN  40   9.640  -0.852  -3.374
  301   1HD2  ASN  40          1HD2      ASN  40  11.857   0.476  -2.847
  302   2HD2  ASN  40          2HD2      ASN  40  13.070   0.293  -4.105
  303    H    LEU  41           H        LEU  41   7.349  -1.499  -7.057
  304    HA   LEU  41           HA       LEU  41   7.738  -4.247  -6.492
  305   1HB   LEU  41          2HB       LEU  41   6.080  -2.633  -8.189
  306   2HB   LEU  41          3HB       LEU  41   6.829  -3.822  -9.234
  307    HG   LEU  41           HG       LEU  41   4.583  -4.362  -8.234
  308   1HD1  LEU  41          1HD1      LEU  41   5.919  -6.098  -9.287
  309   2HD1  LEU  41          2HD1      LEU  41   6.829  -6.364  -7.787
  310   3HD1  LEU  41          3HD1      LEU  41   5.098  -6.753  -7.859
  311   1HD2  LEU  41          1HD2      LEU  41   5.497  -3.656  -5.805
  312   2HD2  LEU  41          2HD2      LEU  41   4.222  -4.867  -6.043
  313   3HD2  LEU  41          3HD2      LEU  41   5.886  -5.373  -5.726
  314    H    ALA  42           H        ALA  42   9.645  -2.055  -8.334
  315    HA   ALA  42           HA       ALA  42  11.224  -3.706  -9.944
  316   1HB   ALA  42          1HB       ALA  42  12.088  -1.476  -8.065
  317   2HB   ALA  42          2HB       ALA  42  13.071  -2.158  -9.369
  318   3HB   ALA  42          3HB       ALA  42  11.572  -1.281  -9.762
  319    H    THR  43           H        THR  43  11.124  -3.513  -6.358
  320    HA   THR  43           HA       THR  43  12.926  -5.885  -6.320
  321    HB   THR  43           HB       THR  43  14.144  -3.934  -5.594
  322    HG1  THR  43           1HG      THR  43  14.847  -4.808  -3.628
  323   1HG2  THR  43          1HG2      THR  43  12.006  -3.682  -3.443
  324   2HG2  THR  43          2HG2      THR  43  13.585  -2.873  -3.378
  325   3HG2  THR  43          3HG2      THR  43  12.452  -2.500  -4.684
  326    H    GLU  44           H        GLU  44  10.034  -5.686  -6.586
  327    HA   GLU  44           HA       GLU  44   8.080  -6.423  -5.778
  328   1HB   GLU  44          2HB       GLU  44   9.986  -8.453  -4.543
  329   2HB   GLU  44          3HB       GLU  44   8.232  -8.647  -4.671
  330   1HG   GLU  44          2HG       GLU  44   8.411  -8.269  -7.167
  331   2HG   GLU  44          3HG       GLU  44  10.168  -8.405  -6.984
  332    H    THR  45           H        THR  45   9.257  -4.273  -3.978
  333    HA   THR  45           HA       THR  45   7.912  -5.029  -1.434
  334    HB   THR  45           HB       THR  45   9.995  -2.874  -1.968
  335    HG1  THR  45           1HG      THR  45  11.498  -4.398  -1.280
  336   1HG2  THR  45          1HG2      THR  45   8.713  -2.662   0.159
  337   2HG2  THR  45          2HG2      THR  45   9.144  -4.348   0.553
  338   3HG2  THR  45          3HG2      THR  45  10.408  -3.103   0.455
  339    H    VAL  46           H        VAL  46   6.540  -3.374  -0.471
  340    HA   VAL  46           HA       VAL  46   5.783  -1.086  -2.248
  341    HB   VAL  46           HB       VAL  46   3.919  -2.548  -2.232
  342   1HG1  VAL  46          1HG1      VAL  46   4.117  -2.641   0.822
  343   2HG1  VAL  46          2HG1      VAL  46   2.777  -3.277  -0.145
  344   3HG1  VAL  46          3HG1      VAL  46   4.377  -4.001  -0.292
  345   1HG2  VAL  46          1HG2      VAL  46   3.423  -0.160  -1.933
  346   2HG2  VAL  46          2HG2      VAL  46   2.204  -1.219  -1.190
  347   3HG2  VAL  46          3HG2      VAL  46   3.369  -0.380  -0.166
  348    H    ASN  47           H        ASN  47   5.651   0.999  -1.255
  349    HA   ASN  47           HA       ASN  47   6.282   1.078   1.644
  350   1HB   ASN  47          2HB       ASN  47   7.449   2.718  -0.656
  351   2HB   ASN  47          3HB       ASN  47   7.451   3.279   1.019
  352   1HD2  ASN  47          1HD2      ASN  47   8.423   1.649   2.660
  353   2HD2  ASN  47          2HD2      ASN  47   9.979   1.035   2.132
  354    H    VAL  48           H        VAL  48   4.782   2.429   2.723
  355    HA   VAL  48           HA       VAL  48   3.071   4.185   1.123
  356    HB   VAL  48           HB       VAL  48   1.579   2.571   1.170
  357   1HG1  VAL  48          1HG1      VAL  48   1.229   0.763   2.740
  358   2HG1  VAL  48          2HG1      VAL  48   2.883   0.732   2.130
  359   3HG1  VAL  48          3HG1      VAL  48   2.530   1.392   3.753
  360   1HG2  VAL  48          1HG2      VAL  48  -0.027   2.806   2.981
  361   2HG2  VAL  48          2HG2      VAL  48   1.232   3.330   4.090
  362   3HG2  VAL  48          3HG2      VAL  48   0.731   4.398   2.745
  363    H    ILE  49           H        ILE  49   2.915   6.097   2.029
  364    HA   ILE  49           HA       ILE  49   4.488   6.524   4.458
  365    HB   ILE  49           HB       ILE  49   3.861   8.561   2.290
  366   1HG1  ILE  49          2HG1      ILE  49   4.966   6.795   1.101
  367   2HG1  ILE  49          3HG1      ILE  49   6.023   8.188   1.293
  368   1HG2  ILE  49          1HG2      ILE  49   5.911   9.652   3.194
  369   2HG2  ILE  49          2HG2      ILE  49   4.593   9.536   4.363
  370   3HG2  ILE  49          3HG2      ILE  49   5.964   8.428   4.484
  371   1HD1  ILE  49          1HD1      ILE  49   6.190   5.602   2.892
  372   2HD1  ILE  49          2HD1      ILE  49   7.319   6.170   1.652
  373   3HD1  ILE  49          3HD1      ILE  49   7.188   7.050   3.175
  374    H    TYR  50           H        TYR  50   2.966   6.674   6.151
  375    HA   TYR  50           HA       TYR  50   0.493   8.329   5.710
  376   1HB   TYR  50          2HB       TYR  50  -0.862   6.632   6.736
  377   2HB   TYR  50          3HB       TYR  50  -0.038   5.946   5.356
  378    HD1  TYR  50           HD1      TYR  50   2.008   4.450   5.774
  379    HD2  TYR  50           HD2      TYR  50  -0.486   5.825   8.986
  380    HE1  TYR  50           HE1      TYR  50   2.531   2.409   7.054
  381    HE2  TYR  50           HE2      TYR  50   0.284   3.929  10.379
  382    HH   TYR  50           HH       TYR  50   2.234   1.268   9.037
  383    H    ASP  51           H        ASP  51  -0.689   8.607   7.762
  384    HA   ASP  51           HA       ASP  51   1.215   9.514   9.859
  385   1HB   ASP  51          2HB       ASP  51  -0.405  11.113   9.208
  386   2HB   ASP  51          3HB       ASP  51  -1.731   9.971   9.439
  387    HA   PRO  52           HA       PRO  52   0.030   5.594  11.807
  388   1HB   PRO  52          2HB       PRO  52   2.051   5.207  13.535
  389   2HB   PRO  52          3HB       PRO  52   2.277   5.054  11.776
  390   1HG   PRO  52          2HG       PRO  52   2.795   7.529  13.493
  391   2HG   PRO  52          3HG       PRO  52   3.937   6.749  12.365
  392   1HD   PRO  52          2HD       PRO  52   2.405   8.885  11.636
  393   2HD   PRO  52          3HD       PRO  52   2.758   7.557  10.484
  394    H    ALA  53           H        ALA  53  -0.434   8.730  12.935
  395    HA   ALA  53           HA       ALA  53  -1.276   7.955  15.649
  396   1HB   ALA  53          1HB       ALA  53  -2.055  10.244  15.733
  397   2HB   ALA  53          2HB       ALA  53  -0.404  10.262  15.064
  398   3HB   ALA  53          3HB       ALA  53  -1.815  10.441  13.988
  399    H    GLU  54           H        GLU  54  -2.328   7.994  12.285
  400    HA   GLU  54           HA       GLU  54  -5.154   7.930  13.102
  401   1HB   GLU  54          2HB       GLU  54  -3.803   9.615  11.288
  402   2HB   GLU  54          3HB       GLU  54  -4.675   8.486  10.248
  403   1HG   GLU  54          2HG       GLU  54  -5.998  10.006  12.538
  404   2HG   GLU  54          3HG       GLU  54  -5.869  10.628  10.892
  405    H    THR  55           H        THR  55  -2.997   6.800  10.512
  406    HA   THR  55           HA       THR  55  -4.338   4.212  10.489
  407    HB   THR  55           HB       THR  55  -2.461   3.928   8.441
  408    HG1  THR  55           1HG      THR  55  -3.624   6.465   8.339
  409   1HG2  THR  55          1HG2      THR  55  -4.794   3.233   8.499
  410   2HG2  THR  55          2HG2      THR  55  -5.368   4.936   8.439
  411   3HG2  THR  55          3HG2      THR  55  -4.482   4.226   7.055
  412    H    GLY  56           H        GLY  56  -2.752   2.523   9.784
  413   1HA   GLY  56          2HA       GLY  56  -0.420   2.021  11.315
  414   2HA   GLY  56          3HA       GLY  56  -1.857   1.197  11.979
  415    H    THR  57           H        THR  57  -1.496  -0.853  11.128
  416    HA   THR  57           HA       THR  57  -0.917  -1.406   8.311
  417    HB   THR  57           HB       THR  57  -1.124  -3.755   9.285
  418    HG1  THR  57           1HG      THR  57  -1.376  -3.856  11.527
  419   1HG2  THR  57          1HG2      THR  57   1.075  -2.550   9.173
  420   2HG2  THR  57          2HG2      THR  57   0.773  -1.803  10.749
  421   3HG2  THR  57          3HG2      THR  57   0.981  -3.559  10.627
  422    H    ALA  58           H        ALA  58  -3.446  -1.436  10.736
  423    HA   ALA  58           HA       ALA  58  -5.273  -3.030   9.725
  424   1HB   ALA  58          1HB       ALA  58  -5.883  -0.414  11.158
  425   2HB   ALA  58          2HB       ALA  58  -6.989  -1.798  11.037
  426   3HB   ALA  58          3HB       ALA  58  -5.465  -1.958  11.929
  427    H    ALA  59           H        ALA  59  -5.332   0.406   8.900
  428    HA   ALA  59           HA       ALA  59  -7.856  -0.082   7.434
  429   1HB   ALA  59          1HB       ALA  59  -8.000   2.214   7.010
  430   2HB   ALA  59          2HB       ALA  59  -7.330   2.092   8.647
  431   3HB   ALA  59          3HB       ALA  59  -6.274   2.464   7.265
  432    H    ILE  60           H        ILE  60  -4.439   0.255   6.764
  433    HA   ILE  60           HA       ILE  60  -4.506   0.361   3.934
  434    HB   ILE  60           HB       ILE  60  -2.487  -0.323   6.078
  435   1HG1  ILE  60          2HG1      ILE  60  -1.186   1.295   4.652
  436   2HG1  ILE  60          3HG1      ILE  60  -2.602   1.357   3.581
  437   1HG2  ILE  60          1HG2      ILE  60  -2.036  -1.101   3.176
  438   2HG2  ILE  60          2HG2      ILE  60  -0.789  -0.958   4.437
  439   3HG2  ILE  60          3HG2      ILE  60  -2.030  -2.195   4.587
  440   1HD1  ILE  60          1HD1      ILE  60  -2.748   2.006   6.570
  441   2HD1  ILE  60          2HD1      ILE  60  -2.290   3.228   5.385
  442   3HD1  ILE  60          3HD1      ILE  60  -3.894   2.482   5.294
  443    H    GLN  61           H        GLN  61  -4.314  -2.455   6.162
  444    HA   GLN  61           HA       GLN  61  -4.242  -4.317   4.055
  445   1HB   GLN  61          2HB       GLN  61  -3.797  -4.476   6.597
  446   2HB   GLN  61          3HB       GLN  61  -5.474  -5.006   6.725
  447   1HG   GLN  61          2HG       GLN  61  -5.000  -7.053   5.728
  448   2HG   GLN  61          3HG       GLN  61  -3.792  -6.384   4.630
  449   1HE2  GLN  61          1HE2      GLN  61  -1.781  -5.380   5.875
  450   2HE2  GLN  61          2HE2      GLN  61  -1.112  -6.465   7.084
  451    H    GLU  62           H        GLU  62  -6.977  -2.978   5.887
  452    HA   GLU  62           HA       GLU  62  -9.161  -4.227   4.685
  453   1HB   GLU  62          2HB       GLU  62  -8.798  -2.195   6.493
  454   2HB   GLU  62          3HB       GLU  62  -9.384  -1.260   5.120
  455   1HG   GLU  62          2HG       GLU  62 -10.778  -3.684   6.335
  456   2HG   GLU  62          3HG       GLU  62 -11.134  -2.004   6.735
  457    H    LYS  63           H        LYS  63  -7.584  -1.166   3.553
  458    HA   LYS  63           HA       LYS  63  -9.137  -1.103   1.177
  459   1HB   LYS  63          2HB       LYS  63  -6.863   0.427   2.381
  460   2HB   LYS  63          3HB       LYS  63  -7.038   0.491   0.644
  461   1HG   LYS  63          2HG       LYS  63  -9.157   1.258   2.667
  462   2HG   LYS  63          3HG       LYS  63  -8.167   2.354   1.678
  463   1HD   LYS  63          2HD       LYS  63  -9.767   2.355   0.105
  464   2HD   LYS  63          3HD       LYS  63  -9.296   0.709  -0.259
  465   1HE   LYS  63          2HE       LYS  63 -11.667   0.676   0.048
  466   2HE   LYS  63          3HE       LYS  63 -11.007  -0.093   1.497
  467   1HZ   LYS  63          1HZ       LYS  63 -11.962   2.674   1.310
  468   2HZ   LYS  63          2HZ       LYS  63 -12.689   1.409   2.080
  469   3HZ   LYS  63          3HZ       LYS  63 -11.270   1.993   2.646
  470    H    ILE  64           H        ILE  64  -5.972  -2.572   1.845
  471    HA   ILE  64           HA       ILE  64  -4.999  -2.950  -0.740
  472    HB   ILE  64           HB       ILE  64  -4.666  -4.083   1.933
  473   1HG1  ILE  64          2HG1      ILE  64  -3.302  -2.276   0.897
  474   2HG1  ILE  64          3HG1      ILE  64  -2.420  -3.643   1.568
  475   1HG2  ILE  64          1HG2      ILE  64  -4.028  -5.827  -0.420
  476   2HG2  ILE  64          2HG2      ILE  64  -3.246  -5.949   1.177
  477   3HG2  ILE  64          3HG2      ILE  64  -4.982  -6.204   1.039
  478   1HD1  ILE  64          1HD1      ILE  64  -2.949  -3.181  -1.398
  479   2HD1  ILE  64          2HD1      ILE  64  -1.413  -2.996  -0.529
  480   3HD1  ILE  64          3HD1      ILE  64  -2.138  -4.600  -0.718
  481    H    GLU  65           H        GLU  65  -7.134  -5.027   1.342
  482    HA   GLU  65           HA       GLU  65  -7.852  -6.976  -0.592
  483   1HB   GLU  65          2HB       GLU  65  -9.275  -5.901   1.882
  484   2HB   GLU  65          3HB       GLU  65  -9.933  -7.209   0.898
  485   1HG   GLU  65          2HG       GLU  65  -7.136  -7.383   2.023
  486   2HG   GLU  65          3HG       GLU  65  -8.562  -7.871   2.950
  487    H    LYS  66           H        LYS  66  -9.653  -4.016   0.412
  488    HA   LYS  66           HA       LYS  66 -11.728  -4.397  -1.422
  489   1HB   LYS  66          2HB       LYS  66 -10.926  -2.355   0.438
  490   2HB   LYS  66          3HB       LYS  66 -11.370  -1.545  -1.064
  491   1HG   LYS  66          2HG       LYS  66 -13.075  -3.630   0.368
  492   2HG   LYS  66          3HG       LYS  66 -13.232  -1.890   0.613
  493   1HD   LYS  66          2HD       LYS  66 -13.745  -1.555  -1.790
  494   2HD   LYS  66          3HD       LYS  66 -13.580  -3.292  -2.090
  495   1HE   LYS  66          2HE       LYS  66 -15.432  -3.753  -0.482
  496   2HE   LYS  66          3HE       LYS  66 -15.625  -2.014  -0.209
  497   1HZ   LYS  66          1HZ       LYS  66 -16.005  -3.399  -2.785
  498   2HZ   LYS  66          2HZ       LYS  66 -17.200  -2.852  -1.798
  499   3HZ   LYS  66          3HZ       LYS  66 -16.194  -1.782  -2.536
  500    H    LEU  67           H        LEU  67  -8.624  -2.855  -2.008
  501    HA   LEU  67           HA       LEU  67  -9.229  -1.828  -4.644
  502   1HB   LEU  67          2HB       LEU  67  -6.667  -2.356  -3.122
  503   2HB   LEU  67          3HB       LEU  67  -6.679  -1.686  -4.752
  504    HG   LEU  67           HG       LEU  67  -8.331  -0.370  -2.568
  505   1HD1  LEU  67          1HD1      LEU  67  -6.020  -0.541  -1.695
  506   2HD1  LEU  67          2HD1      LEU  67  -5.413   0.184  -3.188
  507   3HD1  LEU  67          3HD1      LEU  67  -6.454   1.129  -2.102
  508   1HD2  LEU  67          1HD2      LEU  67  -6.980   0.710  -5.086
  509   2HD2  LEU  67          2HD2      LEU  67  -8.711   0.350  -4.929
  510   3HD2  LEU  67          3HD2      LEU  67  -7.984   1.636  -3.955
  511    H    GLY  68           H        GLY  68  -8.620  -4.999  -3.408
  512   1HA   GLY  68          2HA       GLY  68  -9.012  -6.923  -4.614
  513   2HA   GLY  68          3HA       GLY  68  -8.685  -6.096  -6.143
  514    H    TYR  69           H        TYR  69  -6.629  -6.116  -3.149
  515    HA   TYR  69           HA       TYR  69  -4.568  -7.709  -4.603
  516   1HB   TYR  69          2HB       TYR  69  -4.586  -4.867  -4.001
  517   2HB   TYR  69          3HB       TYR  69  -3.360  -5.633  -3.018
  518    HD1  TYR  69           HD1      TYR  69  -1.292  -6.325  -3.980
  519    HD2  TYR  69           HD2      TYR  69  -4.657  -5.427  -6.520
  520    HE1  TYR  69           HE1      TYR  69   0.198  -6.070  -5.881
  521    HE2  TYR  69           HE2      TYR  69  -3.181  -5.332  -8.456
  522    HH   TYR  69           HH       TYR  69   0.366  -5.872  -8.202
  523    H    HIS  70           H        HIS  70  -2.679  -8.124  -2.999
  524    HA   HIS  70           HA       HIS  70  -3.587  -8.219  -0.223
  525   1HB   HIS  70          2HB       HIS  70  -3.956 -10.506  -1.544
  526   2HB   HIS  70          3HB       HIS  70  -2.232 -10.712  -1.214
  527    HD1  HIS  70           1HD      HIS  70  -5.535  -9.887   0.718
  528    HD2  HIS  70           2HD      HIS  70  -1.727 -11.647   1.241
  529    HE1  HIS  70           1HE      HIS  70  -5.465 -10.785   3.082
  530    H    VAL  71           H        VAL  71  -1.981  -7.874   1.207
  531    HA   VAL  71           HA       VAL  71   0.750  -7.328   0.164
  532    HB   VAL  71           HB       VAL  71  -0.644  -5.336   0.899
  533   1HG1  VAL  71          1HG1      VAL  71  -1.742  -6.426   2.899
  534   2HG1  VAL  71          2HG1      VAL  71  -0.169  -6.381   3.722
  535   3HG1  VAL  71          3HG1      VAL  71  -0.962  -4.873   3.244
  536   1HG2  VAL  71          1HG2      VAL  71   1.766  -5.212   0.748
  537   2HG2  VAL  71          2HG2      VAL  71   1.179  -4.261   2.118
  538   3HG2  VAL  71          3HG2      VAL  71   1.941  -5.839   2.406
  539    H    VAL  72           H        VAL  72   2.437  -8.166   1.485
  540    HA   VAL  72           HA       VAL  72   1.578 -10.168   3.526
  541    HB   VAL  72           HB       VAL  72   4.006 -10.328   1.851
  542   1HG1  VAL  72          1HG1      VAL  72   4.191 -11.513   3.985
  543   2HG1  VAL  72          2HG1      VAL  72   2.649 -12.345   3.675
  544   3HG1  VAL  72          3HG1      VAL  72   4.067 -12.675   2.659
  545   1HG2  VAL  72          1HG2      VAL  72   2.816 -12.203   0.648
  546   2HG2  VAL  72          2HG2      VAL  72   1.325 -11.745   1.494
  547   3HG2  VAL  72          3HG2      VAL  72   2.084 -10.625   0.340
  548    H    ILE  73           H        ILE  73   2.468 -10.013   5.401
  549    HA   ILE  73           HA       ILE  73   4.088  -7.599   6.039
  550    HB   ILE  73           HB       ILE  73   2.351  -9.292   7.846
  551   1HG1  ILE  73          2HG1      ILE  73   0.959  -8.071   6.256
  552   2HG1  ILE  73          3HG1      ILE  73   0.843  -7.395   7.875
  553   1HG2  ILE  73          1HG2      ILE  73   4.114  -8.279   9.168
  554   2HG2  ILE  73          2HG2      ILE  73   3.928  -6.730   8.344
  555   3HG2  ILE  73          3HG2      ILE  73   2.648  -7.334   9.418
  556   1HD1  ILE  73          1HD1      ILE  73   2.427  -6.186   5.571
  557   2HD1  ILE  73          2HD1      ILE  73   0.893  -5.610   6.225
  558   3HD1  ILE  73          3HD1      ILE  73   2.346  -5.524   7.225
  559    H    GLU  74           H        GLU  74   5.956  -8.802   5.134
  560    HA   GLU  74           HA       GLU  74   6.819 -11.079   6.455
  561   1HB   GLU  74          2HB       GLU  74   7.514  -9.936   4.112
  562   2HB   GLU  74          3HB       GLU  74   8.963  -9.626   5.098
  563   1HG   GLU  74          2HG       GLU  74   8.913 -12.115   5.685
  564   2HG   GLU  74          3HG       GLU  74   7.628 -12.294   4.473
  565    H    GLY  75           H        GLY  75   6.830  -8.048   7.510
  566   1HA   GLY  75          2HA       GLY  75   7.625  -7.029   9.481
  567   2HA   GLY  75          3HA       GLY  75   8.565  -8.488   9.840
  568    H    ARG  76           H        ARG  76   8.530  -5.373   8.039
  569    HA   ARG  76           HA       ARG  76  11.391  -5.281   8.038
  570   1HB   ARG  76          2HB       ARG  76  10.496  -6.396   5.764
  571   2HB   ARG  76          3HB       ARG  76   9.941  -4.758   5.434
  572   1HG   ARG  76          2HG       ARG  76  12.005  -4.484   4.544
  573   2HG   ARG  76          3HG       ARG  76  12.507  -4.223   6.218
  574   1HD   ARG  76          2HD       ARG  76  12.763  -6.832   6.315
  575   2HD   ARG  76          3HD       ARG  76  12.763  -6.781   4.555
  576    HE   ARG  76           HE       ARG  76  14.891  -6.193   6.357
  577   1HH1  ARG  76          2HH2      ARG  76  13.561  -4.991   3.342
  578   2HH1  ARG  76          1HH2      ARG  76  15.019  -4.225   2.786
  579   1HH2  ARG  76          2HH1      ARG  76  16.873  -5.245   5.665
  580   2HH2  ARG  76          1HH1      ARG  76  16.968  -4.405   4.150
  Start of MODEL   27
    1   1H    MET   1          H1        MET   1  -1.016  19.129  18.349
    2   2H    MET   1          H2        MET   1  -0.644  18.773  19.917
    3   3H    MET   1          H3        MET   1   0.552  19.156  18.845
    4    HA   MET   1           HA       MET   1   0.549  16.835  19.273
    5   1HB   MET   1          2HB       MET   1  -2.312  17.010  18.237
    6   2HB   MET   1          3HB       MET   1  -1.365  15.515  18.264
    7   1HG   MET   1          2HG       MET   1  -1.017  15.759  20.704
    8   2HG   MET   1          3HG       MET   1  -2.067  17.189  20.706
    9   1HE   MET   1          1HE       MET   1  -3.439  16.053  22.678
   10   2HE   MET   1          2HE       MET   1  -4.140  14.422  22.557
   11   3HE   MET   1          3HE       MET   1  -2.374  14.625  22.594
   12    H    LEU   2           H        LEU   2  -1.298  17.876  16.352
   13    HA   LEU   2           HA       LEU   2  -0.815  17.854  14.179
   14   1HB   LEU   2          2HB       LEU   2   1.995  18.149  15.186
   15   2HB   LEU   2          3HB       LEU   2   1.849  17.302  13.668
   16    HG   LEU   2           HG       LEU   2   0.400  19.233  12.833
   17   1HD1  LEU   2          1HD1      LEU   2   1.591  20.573  15.312
   18   2HD1  LEU   2          2HD1      LEU   2   0.700  21.386  14.011
   19   3HD1  LEU   2          3HD1      LEU   2  -0.135  20.228  15.061
   20   1HD2  LEU   2          1HD2      LEU   2   3.304  19.737  13.599
   21   2HD2  LEU   2          2HD2      LEU   2   2.724  18.893  12.148
   22   3HD2  LEU   2          3HD2      LEU   2   2.388  20.619  12.357
   23    H    SER   3           H        SER   3   0.433  16.239  12.517
   24    HA   SER   3           HA       SER   3  -0.149  13.463  13.377
   25   1HB   SER   3          2HB       SER   3  -0.376  14.707  10.598
   26   2HB   SER   3          3HB       SER   3  -0.846  13.071  11.073
   27    HG   SER   3           HG       SER   3  -2.488  13.962  12.345
   28    H    GLU   4           H        GLU   4   1.502  12.036  12.698
   29    HA   GLU   4           HA       GLU   4   4.130  13.249  12.018
   30   1HB   GLU   4          2HB       GLU   4   3.221  10.889  13.577
   31   2HB   GLU   4          3HB       GLU   4   4.696  10.716  12.664
   32   1HG   GLU   4          2HG       GLU   4   5.413  12.879  13.767
   33   2HG   GLU   4          3HG       GLU   4   4.059  12.620  14.857
   34    H    GLN   5           H        GLN   5   5.382  11.321  10.696
   35    HA   GLN   5           HA       GLN   5   3.550   9.930   8.866
   36   1HB   GLN   5          2HB       GLN   5   6.115  11.397   8.178
   37   2HB   GLN   5          3HB       GLN   5   5.281  10.350   7.042
   38   1HG   GLN   5          2HG       GLN   5   4.014  12.853   8.309
   39   2HG   GLN   5          3HG       GLN   5   4.959  12.861   6.851
   40   1HE2  GLN   5          1HE2      GLN   5   3.339   9.880   6.774
   41   2HE2  GLN   5          2HE2      GLN   5   1.971  10.401   5.825
   42    H    LYS   6           H        LYS   6   4.338   7.820   8.417
   43    HA   LYS   6           HA       LYS   6   7.191   7.379   8.784
   44   1HB   LYS   6          2HB       LYS   6   5.146   5.536  10.104
   45   2HB   LYS   6          3HB       LYS   6   6.836   5.112   9.776
   46   1HG   LYS   6          2HG       LYS   6   7.524   7.191  11.073
   47   2HG   LYS   6          3HG       LYS   6   5.844   7.320  11.618
   48   1HD   LYS   6          2HD       LYS   6   6.035   4.964  12.520
   49   2HD   LYS   6          3HD       LYS   6   7.746   4.970  12.021
   50   1HE   LYS   6          2HE       LYS   6   8.074   7.059  13.449
   51   2HE   LYS   6          3HE       LYS   6   6.418   6.865  14.037
   52   1HZ   LYS   6          1HZ       LYS   6   7.079   4.701  14.903
   53   2HZ   LYS   6          2HZ       LYS   6   8.626   4.944  14.382
   54   3HZ   LYS   6          3HZ       LYS   6   7.983   5.919  15.542
   55    H    GLU   7           H        GLU   7   7.932   5.568   7.653
   56    HA   GLU   7           HA       GLU   7   6.500   5.152   5.117
   57   1HB   GLU   7          2HB       GLU   7   9.482   4.807   5.544
   58   2HB   GLU   7          3HB       GLU   7   8.560   5.228   4.106
   59   1HG   GLU   7          2HG       GLU   7   9.713   7.160   4.675
   60   2HG   GLU   7          3HG       GLU   7   8.109   7.494   5.347
   61    H    ILE   8           H        ILE   8   5.465   3.111   5.456
   62    HA   ILE   8           HA       ILE   8   6.883   1.077   6.996
   63    HB   ILE   8           HB       ILE   8   4.412   0.794   5.380
   64   1HG1  ILE   8          2HG1      ILE   8   3.919   2.774   6.713
   65   2HG1  ILE   8          3HG1      ILE   8   2.974   1.345   7.124
   66   1HG2  ILE   8          1HG2      ILE   8   3.900  -0.829   7.235
   67   2HG2  ILE   8          2HG2      ILE   8   5.277  -1.233   6.191
   68   3HG2  ILE   8          3HG2      ILE   8   5.575  -0.516   7.791
   69   1HD1  ILE   8          1HD1      ILE   8   4.311   0.874   9.029
   70   2HD1  ILE   8          2HD1      ILE   8   5.508   2.106   8.554
   71   3HD1  ILE   8          3HD1      ILE   8   3.884   2.602   9.112
   72    H    ALA   9           H        ALA   9   7.347  -1.056   5.907
   73    HA   ALA   9           HA       ALA   9   7.779  -0.931   2.976
   74   1HB   ALA   9          1HB       ALA   9   9.813  -1.941   5.019
   75   2HB   ALA   9          2HB       ALA   9   9.957  -2.026   3.251
   76   3HB   ALA   9          3HB       ALA   9   9.973  -0.450   4.071
   77    H    MET  10           H        MET  10   6.693  -2.681   2.139
   78    HA   MET  10           HA       MET  10   6.504  -5.190   3.727
   79   1HB   MET  10          2HB       MET  10   4.160  -3.560   2.670
   80   2HB   MET  10          3HB       MET  10   4.046  -5.276   3.070
   81   1HG   MET  10          2HG       MET  10   4.696  -4.865   5.367
   82   2HG   MET  10          3HG       MET  10   4.874  -3.140   5.052
   83   1HE   MET  10          1HE       MET  10   1.263  -1.868   4.653
   84   2HE   MET  10          2HE       MET  10   2.985  -1.445   4.724
   85   3HE   MET  10          3HE       MET  10   2.339  -2.329   3.319
   86    H    GLN  11           H        GLN  11   5.445  -6.898   2.345
   87    HA   GLN  11           HA       GLN  11   6.684  -6.859  -0.355
   88   1HB   GLN  11          2HB       GLN  11   5.928  -8.990   1.693
   89   2HB   GLN  11          3HB       GLN  11   6.020  -9.432  -0.006
   90   1HG   GLN  11          2HG       GLN  11   8.258  -8.247   1.701
   91   2HG   GLN  11          3HG       GLN  11   8.140  -9.918   1.130
   92   1HE2  GLN  11          1HE2      GLN  11   7.406  -9.724  -1.498
   93   2HE2  GLN  11          2HE2      GLN  11   8.335  -8.524  -2.381
   94    H    VAL  12           H        VAL  12   5.469  -7.512  -2.169
   95    HA   VAL  12           HA       VAL  12   2.530  -7.044  -1.886
   96    HB   VAL  12           HB       VAL  12   4.364  -6.932  -4.316
   97   1HG1  VAL  12          1HG1      VAL  12   1.388  -6.328  -3.999
   98   2HG1  VAL  12          2HG1      VAL  12   2.359  -5.885  -5.414
   99   3HG1  VAL  12          3HG1      VAL  12   2.118  -7.587  -5.021
  100   1HG2  VAL  12          1HG2      VAL  12   3.021  -4.763  -2.646
  101   2HG2  VAL  12          2HG2      VAL  12   4.771  -5.043  -2.812
  102   3HG2  VAL  12          3HG2      VAL  12   3.831  -4.474  -4.193
  103    H    SER  13           H        SER  13   1.025  -8.598  -2.629
  104    HA   SER  13           HA       SER  13   1.989 -10.868  -4.187
  105   1HB   SER  13          2HB       SER  13   2.144 -11.658  -1.842
  106   2HB   SER  13          3HB       SER  13   0.433 -11.236  -1.591
  107    HG   SER  13           HG       SER  13   0.801 -13.471  -2.169
  108    H    GLY  14           H        GLY  14  -0.146 -12.213  -4.570
  109   1HA   GLY  14          2HA       GLY  14  -1.967 -12.240  -6.029
  110   2HA   GLY  14          3HA       GLY  14  -2.666 -11.093  -4.871
  111    H    MET  15           H        MET  15  -0.196 -11.104  -7.504
  112    HA   MET  15           HA       MET  15  -1.249  -8.499  -8.479
  113   1HB   MET  15          2HB       MET  15   0.963  -7.619  -8.616
  114   2HB   MET  15          3HB       MET  15   0.814  -8.342  -7.007
  115   1HG   MET  15          2HG       MET  15   2.888  -9.104  -7.629
  116   2HG   MET  15          3HG       MET  15   1.894 -10.452  -8.181
  117   1HE   MET  15          1HE       MET  15   4.543 -10.536 -10.961
  118   2HE   MET  15          2HE       MET  15   4.727 -10.415  -9.193
  119   3HE   MET  15          3HE       MET  15   3.482 -11.484  -9.894
  120    H    THR  16           H        THR  16  -1.030  -8.111 -10.702
  121    HA   THR  16           HA       THR  16  -0.380 -10.438 -12.447
  122    HB   THR  16           HB       THR  16  -1.294  -8.598 -14.141
  123    HG1  THR  16           1HG      THR  16  -2.915  -7.891 -11.990
  124   1HG2  THR  16          1HG2      THR  16  -2.369 -10.761 -13.775
  125   2HG2  THR  16          2HG2      THR  16  -3.101 -10.185 -12.262
  126   3HG2  THR  16          3HG2      THR  16  -3.586  -9.475 -13.823
  127    H    CYS  17           H        CYS  17   0.189  -6.862 -12.184
  128    HA   CYS  17           HA       CYS  17   2.983  -7.278 -13.034
  129   1HB   CYS  17          2HB       CYS  17   2.748  -5.784 -14.938
  130   2HB   CYS  17          3HB       CYS  17   1.587  -7.104 -15.114
  131    H    ALA  18           H        ALA  18   4.187  -5.272 -13.077
  132    HA   ALA  18           HA       ALA  18   3.833  -3.687 -10.681
  133   1HB   ALA  18          1HB       ALA  18   5.965  -2.681 -11.381
  134   2HB   ALA  18          2HB       ALA  18   6.046  -4.450 -11.500
  135   3HB   ALA  18          3HB       ALA  18   5.840  -3.472 -12.965
  136    H    ALA  19           H        ALA  19   1.585  -3.277 -12.126
  137    HA   ALA  19           HA       ALA  19   1.722  -0.373 -12.652
  138   1HB   ALA  19          1HB       ALA  19   0.452  -0.476 -14.704
  139   2HB   ALA  19          2HB       ALA  19   1.921  -1.447 -14.908
  140   3HB   ALA  19          3HB       ALA  19   0.358  -2.244 -14.636
  141    H    CYS  20           H        CYS  20  -0.454  -3.299 -12.563
  142    HA   CYS  20           HA       CYS  20  -2.573  -1.845 -11.256
  143   1HB   CYS  20          2HB       CYS  20  -1.917  -4.822 -10.977
  144   2HB   CYS  20          3HB       CYS  20  -3.478  -4.031 -10.711
  145    H    ALA  21           H        ALA  21   0.331  -3.526 -10.114
  146    HA   ALA  21           HA       ALA  21  -0.098  -3.183  -7.359
  147   1HB   ALA  21          1HB       ALA  21   2.587  -3.006  -8.753
  148   2HB   ALA  21          2HB       ALA  21   2.225  -3.605  -7.112
  149   3HB   ALA  21          3HB       ALA  21   1.707  -4.531  -8.522
  150    H    ALA  22           H        ALA  22   0.493  -0.658  -9.733
  151    HA   ALA  22           HA       ALA  22   1.408   1.330  -7.770
  152   1HB   ALA  22          1HB       ALA  22   1.173   2.903  -9.576
  153   2HB   ALA  22          2HB       ALA  22   2.014   1.470 -10.207
  154   3HB   ALA  22          3HB       ALA  22   0.293   1.736 -10.573
  155    H    ARG  23           H        ARG  23  -1.535   0.441  -9.589
  156    HA   ARG  23           HA       ARG  23  -3.199   2.538  -8.744
  157   1HB   ARG  23          2HB       ARG  23  -3.713  -0.267  -9.733
  158   2HB   ARG  23          3HB       ARG  23  -5.055   0.677  -9.080
  159   1HG   ARG  23          2HG       ARG  23  -4.828   2.408 -10.640
  160   2HG   ARG  23          3HG       ARG  23  -3.225   1.891 -11.173
  161   1HD   ARG  23          2HD       ARG  23  -5.519  -0.032 -11.479
  162   2HD   ARG  23          3HD       ARG  23  -5.471   1.360 -12.573
  163    HE   ARG  23           HE       ARG  23  -2.965   0.568 -12.877
  164   1HH1  ARG  23          2HH2      ARG  23  -5.871  -1.493 -12.879
  165   2HH1  ARG  23          1HH2      ARG  23  -5.049  -2.803 -13.682
  166   1HH2  ARG  23          2HH1      ARG  23  -2.068  -1.037 -14.272
  167   2HH2  ARG  23          1HH1      ARG  23  -2.814  -2.609 -14.181
  168    H    ILE  24           H        ILE  24  -2.585  -0.596  -7.061
  169    HA   ILE  24           HA       ILE  24  -4.451  -0.070  -5.018
  170    HB   ILE  24           HB       ILE  24  -3.446  -1.653  -3.629
  171   1HG1  ILE  24          2HG1      ILE  24  -1.079  -1.267  -5.400
  172   2HG1  ILE  24          3HG1      ILE  24  -1.172  -1.157  -3.629
  173   1HG2  ILE  24          1HG2      ILE  24  -3.128  -2.634  -6.494
  174   2HG2  ILE  24          2HG2      ILE  24  -3.664  -3.499  -5.038
  175   3HG2  ILE  24          3HG2      ILE  24  -4.709  -2.281  -5.755
  176   1HD1  ILE  24          1HD1      ILE  24  -1.212  -3.664  -5.317
  177   2HD1  ILE  24          2HD1      ILE  24   0.046  -3.155  -4.188
  178   3HD1  ILE  24          3HD1      ILE  24  -1.544  -3.651  -3.564
  179    H    GLU  25           H        GLU  25  -0.959   0.746  -4.997
  180    HA   GLU  25           HA       GLU  25  -0.943   2.060  -2.498
  181   1HB   GLU  25          2HB       GLU  25   0.754   2.248  -5.016
  182   2HB   GLU  25          3HB       GLU  25   1.055   3.332  -3.653
  183   1HG   GLU  25          2HG       GLU  25   0.926   0.319  -3.274
  184   2HG   GLU  25          3HG       GLU  25   2.411   1.187  -3.688
  185    H    LYS  26           H        LYS  26  -1.686   3.300  -5.745
  186    HA   LYS  26           HA       LYS  26  -1.724   6.075  -4.774
  187   1HB   LYS  26          2HB       LYS  26  -2.629   5.009  -7.452
  188   2HB   LYS  26          3HB       LYS  26  -2.370   6.704  -7.013
  189   1HG   LYS  26          2HG       LYS  26  -0.247   4.521  -7.166
  190   2HG   LYS  26          3HG       LYS  26  -0.481   5.853  -8.292
  191   1HD   LYS  26          2HD       LYS  26   0.130   7.465  -6.493
  192   2HD   LYS  26          3HD       LYS  26   0.377   6.109  -5.365
  193   1HE   LYS  26          2HE       LYS  26   2.118   5.154  -6.819
  194   2HE   LYS  26          3HE       LYS  26   1.920   6.492  -7.966
  195   1HZ   LYS  26          1HZ       LYS  26   3.778   6.837  -6.498
  196   2HZ   LYS  26          2HZ       LYS  26   2.648   7.991  -6.203
  197   3HZ   LYS  26          3HZ       LYS  26   2.844   6.728  -5.164
  198    H    GLY  27           H        GLY  27  -4.207   3.629  -5.554
  199   1HA   GLY  27          2HA       GLY  27  -6.491   5.244  -4.920
  200   2HA   GLY  27          3HA       GLY  27  -6.365   3.477  -4.793
  201    H    LEU  28           H        LEU  28  -4.266   3.193  -2.977
  202    HA   LEU  28           HA       LEU  28  -5.666   3.534  -0.518
  203   1HB   LEU  28          2HB       LEU  28  -4.210   1.698  -0.954
  204   2HB   LEU  28          3HB       LEU  28  -2.802   2.741  -1.133
  205    HG   LEU  28           HG       LEU  28  -3.134   1.366   1.000
  206   1HD1  LEU  28          1HD1      LEU  28  -1.338   2.875   0.813
  207   2HD1  LEU  28          2HD1      LEU  28  -2.390   4.285   0.957
  208   3HD1  LEU  28          3HD1      LEU  28  -2.111   3.262   2.365
  209   1HD2  LEU  28          1HD2      LEU  28  -4.404   2.399   2.821
  210   2HD2  LEU  28          2HD2      LEU  28  -4.969   3.671   1.782
  211   3HD2  LEU  28          3HD2      LEU  28  -5.476   1.998   1.472
  212    H    LYS  29           H        LYS  29  -3.059   5.390  -2.074
  213    HA   LYS  29           HA       LYS  29  -2.480   7.260  -0.121
  214   1HB   LYS  29          2HB       LYS  29  -1.686   6.905  -2.656
  215   2HB   LYS  29          3HB       LYS  29  -2.865   8.196  -2.952
  216   1HG   LYS  29          2HG       LYS  29  -1.553   9.371  -0.947
  217   2HG   LYS  29          3HG       LYS  29  -0.363   8.118  -1.325
  218   1HD   LYS  29          2HD       LYS  29   0.399   9.712  -2.889
  219   2HD   LYS  29          3HD       LYS  29  -0.863   8.988  -3.861
  220   1HE   LYS  29          2HE       LYS  29  -1.272  11.312  -4.015
  221   2HE   LYS  29          3HE       LYS  29  -2.464  10.760  -2.822
  222   1HZ   LYS  29          1HZ       LYS  29  -0.914  11.518  -1.094
  223   2HZ   LYS  29          2HZ       LYS  29   0.182  11.953  -2.180
  224   3HZ   LYS  29          3HZ       LYS  29  -1.267  12.769  -2.098
  225    H    ARG  30           H        ARG  30  -5.481   6.941  -1.899
  226    HA   ARG  30           HA       ARG  30  -6.373   9.697  -1.397
  227   1HB   ARG  30          2HB       ARG  30  -7.041   7.476  -3.154
  228   2HB   ARG  30          3HB       ARG  30  -8.491   7.973  -2.318
  229   1HG   ARG  30          2HG       ARG  30  -6.719  10.098  -3.564
  230   2HG   ARG  30          3HG       ARG  30  -7.570   8.987  -4.638
  231   1HD   ARG  30          2HD       ARG  30  -9.706   9.497  -3.580
  232   2HD   ARG  30          3HD       ARG  30  -8.925  10.693  -2.515
  233    HE   ARG  30           HE       ARG  30  -8.134  11.520  -4.986
  234   1HH1  ARG  30          2HH2      ARG  30 -11.317  10.826  -3.639
  235   2HH1  ARG  30          1HH2      ARG  30 -12.198  11.795  -4.778
  236   1HH2  ARG  30          2HH1      ARG  30  -9.259  12.854  -6.499
  237   2HH2  ARG  30          1HH1      ARG  30 -10.981  13.012  -6.421
  238    H    MET  31           H        MET  31  -6.036   7.080   0.650
  239    HA   MET  31           HA       MET  31  -8.679   7.296   1.915
  240   1HB   MET  31          2HB       MET  31  -6.280   5.562   2.592
  241   2HB   MET  31          3HB       MET  31  -7.917   5.340   3.200
  242   1HG   MET  31          2HG       MET  31  -7.167   5.161   0.245
  243   2HG   MET  31          3HG       MET  31  -7.278   3.804   1.342
  244   1HE   MET  31          1HE       MET  31  -8.716   4.276  -1.563
  245   2HE   MET  31          2HE       MET  31  -8.603   2.783  -0.608
  246   3HE   MET  31          3HE       MET  31 -10.190   3.364  -1.184
  247    HA   PRO  32           HA       PRO  32  -7.429  10.194   4.930
  248   1HB   PRO  32          2HB       PRO  32  -8.650   9.322   7.275
  249   2HB   PRO  32          3HB       PRO  32  -9.487  10.129   5.919
  250   1HG   PRO  32          2HG       PRO  32  -9.245   7.157   6.433
  251   2HG   PRO  32          3HG       PRO  32 -10.724   8.083   6.040
  252   1HD   PRO  32          2HD       PRO  32  -9.411   6.740   4.126
  253   2HD   PRO  32          3HD       PRO  32 -10.011   8.383   3.769
  254    H    GLY  33           H        GLY  33  -5.758  10.601   6.349
  255   1HA   GLY  33          2HA       GLY  33  -4.100  10.183   7.904
  256   2HA   GLY  33          3HA       GLY  33  -4.516   8.471   7.925
  257    H    VAL  34           H        VAL  34  -4.331   8.414   4.812
  258    HA   VAL  34           HA       VAL  34  -1.439   7.926   4.785
  259    HB   VAL  34           HB       VAL  34  -3.407   7.593   2.500
  260   1HG1  VAL  34          1HG1      VAL  34  -0.554   6.614   3.042
  261   2HG1  VAL  34          2HG1      VAL  34  -1.552   6.073   1.697
  262   3HG1  VAL  34          3HG1      VAL  34  -1.059   7.751   1.783
  263   1HG2  VAL  34          1HG2      VAL  34  -4.114   6.158   4.369
  264   2HG2  VAL  34          2HG2      VAL  34  -3.347   5.180   3.118
  265   3HG2  VAL  34          3HG2      VAL  34  -2.445   5.592   4.596
  266    H    THR  35           H        THR  35   0.066   9.137   3.661
  267    HA   THR  35           HA       THR  35  -0.904  11.772   2.631
  268    HB   THR  35           HB       THR  35   1.676  10.966   3.855
  269    HG1  THR  35           1HG      THR  35   0.821  12.555   5.382
  270   1HG2  THR  35          1HG2      THR  35   0.798  13.623   2.664
  271   2HG2  THR  35          2HG2      THR  35   2.214  13.397   3.714
  272   3HG2  THR  35          3HG2      THR  35   2.163  12.612   2.130
  273    H    ASP  36           H        ASP  36   1.722   9.266   2.005
  274    HA   ASP  36           HA       ASP  36   1.134   9.526  -0.820
  275   1HB   ASP  36          2HB       ASP  36   3.681  10.495   0.438
  276   2HB   ASP  36          3HB       ASP  36   3.707   9.735  -1.147
  277    H    ALA  37           H        ALA  37   2.461   7.877  -2.032
  278    HA   ALA  37           HA       ALA  37   2.944   5.410  -0.527
  279   1HB   ALA  37          1HB       ALA  37   0.972   4.246  -1.443
  280   2HB   ALA  37          2HB       ALA  37   0.425   5.669  -0.564
  281   3HB   ALA  37          3HB       ALA  37   0.501   5.702  -2.339
  282    H    ASN  38           H        ASN  38   3.843   3.701  -1.859
  283    HA   ASN  38           HA       ASN  38   4.663   4.484  -4.564
  284   1HB   ASN  38          2HB       ASN  38   7.049   4.010  -2.862
  285   2HB   ASN  38          3HB       ASN  38   6.818   5.071  -4.242
  286   1HD2  ASN  38          1HD2      ASN  38   6.004   4.674  -0.787
  287   2HD2  ASN  38          2HD2      ASN  38   6.254   6.373  -0.365
  288    H    VAL  39           H        VAL  39   4.489   2.585  -5.604
  289    HA   VAL  39           HA       VAL  39   4.988   0.067  -4.175
  290    HB   VAL  39           HB       VAL  39   3.117   0.380  -5.813
  291   1HG1  VAL  39          1HG1      VAL  39   4.388   1.633  -7.602
  292   2HG1  VAL  39          2HG1      VAL  39   5.257   0.124  -7.969
  293   3HG1  VAL  39          3HG1      VAL  39   3.510   0.208  -8.179
  294   1HG2  VAL  39          1HG2      VAL  39   3.822  -1.802  -5.088
  295   2HG2  VAL  39          2HG2      VAL  39   3.547  -1.858  -6.841
  296   3HG2  VAL  39          3HG2      VAL  39   5.202  -1.766  -6.211
  297    H    ASN  40           H        ASN  40   7.003  -0.894  -4.153
  298    HA   ASN  40           HA       ASN  40   9.140   0.221  -5.936
  299   1HB   ASN  40          2HB       ASN  40   9.445   0.753  -3.540
  300   2HB   ASN  40          3HB       ASN  40   9.344  -0.964  -3.144
  301   1HD2  ASN  40          1HD2      ASN  40  11.551  -0.286  -2.184
  302   2HD2  ASN  40          2HD2      ASN  40  12.932  -0.456  -3.258
  303    H    LEU  41           H        LEU  41   7.532  -1.388  -7.103
  304    HA   LEU  41           HA       LEU  41   7.868  -4.174  -6.608
  305   1HB   LEU  41          2HB       LEU  41   6.160  -2.550  -8.156
  306   2HB   LEU  41          3HB       LEU  41   7.023  -3.496  -9.346
  307    HG   LEU  41           HG       LEU  41   4.821  -4.386  -8.546
  308   1HD1  LEU  41          1HD1      LEU  41   6.406  -5.871  -9.685
  309   2HD1  LEU  41          2HD1      LEU  41   7.193  -6.251  -8.144
  310   3HD1  LEU  41          3HD1      LEU  41   5.513  -6.743  -8.428
  311   1HD2  LEU  41          1HD2      LEU  41   4.386  -5.226  -6.478
  312   2HD2  LEU  41          2HD2      LEU  41   6.073  -5.542  -6.076
  313   3HD2  LEU  41          3HD2      LEU  41   5.451  -3.895  -6.005
  314    H    ALA  42           H        ALA  42   9.797  -1.878  -8.279
  315    HA   ALA  42           HA       ALA  42  11.445  -3.316  -9.981
  316   1HB   ALA  42          1HB       ALA  42  12.279  -1.406  -7.760
  317   2HB   ALA  42          2HB       ALA  42  13.250  -1.854  -9.172
  318   3HB   ALA  42          3HB       ALA  42  11.750  -0.919  -9.393
  319    H    THR  43           H        THR  43  11.267  -3.502  -6.394
  320    HA   THR  43           HA       THR  43  12.903  -5.977  -6.578
  321    HB   THR  43           HB       THR  43  14.383  -4.304  -5.698
  322    HG1  THR  43           1HG      THR  43  13.354  -6.106  -3.790
  323   1HG2  THR  43          1HG2      THR  43  12.274  -3.767  -3.565
  324   2HG2  THR  43          2HG2      THR  43  13.941  -3.158  -3.550
  325   3HG2  THR  43          3HG2      THR  43  12.827  -2.643  -4.826
  326    H    GLU  44           H        GLU  44  10.086  -5.658  -6.775
  327    HA   GLU  44           HA       GLU  44   8.143  -6.485  -6.028
  328   1HB   GLU  44          2HB       GLU  44  10.094  -8.441  -4.751
  329   2HB   GLU  44          3HB       GLU  44   8.354  -8.713  -4.909
  330   1HG   GLU  44          2HG       GLU  44   8.476  -8.455  -7.357
  331   2HG   GLU  44          3HG       GLU  44  10.228  -8.208  -7.252
  332    H    THR  45           H        THR  45   9.213  -4.294  -4.272
  333    HA   THR  45           HA       THR  45   7.989  -5.029  -1.659
  334    HB   THR  45           HB       THR  45  10.125  -2.998  -2.437
  335    HG1  THR  45           1HG      THR  45  11.457  -4.541  -1.326
  336   1HG2  THR  45          1HG2      THR  45   9.161  -3.920   0.297
  337   2HG2  THR  45          2HG2      THR  45  10.597  -2.923   0.001
  338   3HG2  THR  45          3HG2      THR  45   8.999  -2.272  -0.374
  339    H    VAL  46           H        VAL  46   6.871  -3.189  -0.550
  340    HA   VAL  46           HA       VAL  46   6.008  -0.926  -2.272
  341    HB   VAL  46           HB       VAL  46   4.214  -2.529  -2.479
  342   1HG1  VAL  46          1HG1      VAL  46   4.540  -3.995  -0.548
  343   2HG1  VAL  46          2HG1      VAL  46   4.156  -2.660   0.563
  344   3HG1  VAL  46          3HG1      VAL  46   2.909  -3.323  -0.507
  345   1HG2  VAL  46          1HG2      VAL  46   3.688  -0.128  -2.166
  346   2HG2  VAL  46          2HG2      VAL  46   2.372  -1.218  -1.684
  347   3HG2  VAL  46          3HG2      VAL  46   3.371  -0.436  -0.443
  348    H    ASN  47           H        ASN  47   5.665   0.998  -1.177
  349    HA   ASN  47           HA       ASN  47   6.437   1.029   1.671
  350   1HB   ASN  47          2HB       ASN  47   7.713   2.494  -0.683
  351   2HB   ASN  47          3HB       ASN  47   7.752   3.182   0.941
  352   1HD2  ASN  47          1HD2      ASN  47   8.527   1.604   2.730
  353   2HD2  ASN  47          2HD2      ASN  47  10.079   0.896   2.317
  354    H    VAL  48           H        VAL  48   5.045   2.475   2.823
  355    HA   VAL  48           HA       VAL  48   3.277   4.159   1.175
  356    HB   VAL  48           HB       VAL  48   2.031   2.138   1.533
  357   1HG1  VAL  48          1HG1      VAL  48   3.150   1.198   3.500
  358   2HG1  VAL  48          2HG1      VAL  48   2.487   2.495   4.526
  359   3HG1  VAL  48          3HG1      VAL  48   1.407   1.323   3.754
  360   1HG2  VAL  48          1HG2      VAL  48   0.118   3.117   2.774
  361   2HG2  VAL  48          2HG2      VAL  48   1.143   4.463   3.295
  362   3HG2  VAL  48          3HG2      VAL  48   0.811   4.222   1.569
  363    H    ILE  49           H        ILE  49   3.097   6.133   2.023
  364    HA   ILE  49           HA       ILE  49   4.626   6.640   4.462
  365    HB   ILE  49           HB       ILE  49   3.859   8.696   2.339
  366   1HG1  ILE  49          2HG1      ILE  49   5.064   7.063   1.102
  367   2HG1  ILE  49          3HG1      ILE  49   6.056   8.496   1.350
  368   1HG2  ILE  49          1HG2      ILE  49   5.968   8.669   4.526
  369   2HG2  ILE  49          2HG2      ILE  49   5.797   9.921   3.276
  370   3HG2  ILE  49          3HG2      ILE  49   4.502   9.655   4.449
  371   1HD1  ILE  49          1HD1      ILE  49   6.315   5.868   2.868
  372   2HD1  ILE  49          2HD1      ILE  49   7.427   6.510   1.646
  373   3HD1  ILE  49          3HD1      ILE  49   7.253   7.340   3.202
  374    H    TYR  50           H        TYR  50   3.069   6.634   6.130
  375    HA   TYR  50           HA       TYR  50   0.616   8.296   5.752
  376   1HB   TYR  50          2HB       TYR  50  -0.770   6.635   6.835
  377   2HB   TYR  50          3HB       TYR  50  -0.154   6.102   5.291
  378    HD1  TYR  50           HD1      TYR  50   0.927   5.833   8.932
  379    HD2  TYR  50           HD2      TYR  50   0.091   3.803   5.226
  380    HE1  TYR  50           HE1      TYR  50   1.255   3.683  10.044
  381    HE2  TYR  50           HE2      TYR  50   0.380   1.633   6.370
  382    HH   TYR  50           HH       TYR  50   1.427   1.412   9.776
  383    H    ASP  51           H        ASP  51  -0.493   8.747   7.751
  384    HA   ASP  51           HA       ASP  51   1.447   9.321   9.922
  385   1HB   ASP  51          2HB       ASP  51  -0.011  11.117   9.585
  386   2HB   ASP  51          3HB       ASP  51  -1.430  10.063   9.511
  387    HA   PRO  52           HA       PRO  52   0.109   5.326  11.517
  388   1HB   PRO  52          2HB       PRO  52   1.986   4.866  13.372
  389   2HB   PRO  52          3HB       PRO  52   2.418   5.027  11.651
  390   1HG   PRO  52          2HG       PRO  52   2.504   7.222  13.762
  391   2HG   PRO  52          3HG       PRO  52   3.833   6.707  12.683
  392   1HD   PRO  52          2HD       PRO  52   2.175   8.807  12.072
  393   2HD   PRO  52          3HD       PRO  52   2.816   7.709  10.810
  394    H    ALA  53           H        ALA  53  -0.901   8.161  12.799
  395    HA   ALA  53           HA       ALA  53  -1.832   6.999  15.372
  396   1HB   ALA  53          1HB       ALA  53  -2.506   9.233  15.936
  397   2HB   ALA  53          2HB       ALA  53  -0.800   9.278  15.442
  398   3HB   ALA  53          3HB       ALA  53  -2.068   9.855  14.342
  399    H    GLU  54           H        GLU  54  -2.764   8.305  12.158
  400    HA   GLU  54           HA       GLU  54  -5.617   7.792  12.738
  401   1HB   GLU  54          2HB       GLU  54  -4.147   9.640  11.012
  402   2HB   GLU  54          3HB       GLU  54  -5.220   8.626  10.040
  403   1HG   GLU  54          2HG       GLU  54  -6.529  10.457  10.542
  404   2HG   GLU  54          3HG       GLU  54  -7.102   9.223  11.666
  405    H    THR  55           H        THR  55  -3.233   7.086  10.158
  406    HA   THR  55           HA       THR  55  -4.334   4.420   9.892
  407    HB   THR  55           HB       THR  55  -2.393   4.448   7.881
  408    HG1  THR  55           1HG      THR  55  -3.897   6.568   7.364
  409   1HG2  THR  55          1HG2      THR  55  -5.390   5.160   7.899
  410   2HG2  THR  55          2HG2      THR  55  -4.435   4.597   6.499
  411   3HG2  THR  55          3HG2      THR  55  -4.719   3.499   7.877
  412    H    GLY  56           H        GLY  56  -2.313   3.015   9.164
  413   1HA   GLY  56          2HA       GLY  56  -0.598   1.983  11.041
  414   2HA   GLY  56          3HA       GLY  56  -2.280   1.739  11.604
  415    H    THR  57           H        THR  57  -1.944  -0.613  10.939
  416    HA   THR  57           HA       THR  57  -1.329  -1.277   8.156
  417    HB   THR  57           HB       THR  57  -1.733  -3.602   9.187
  418    HG1  THR  57           1HG      THR  57  -1.810  -3.556  11.488
  419   1HG2  THR  57          1HG2      THR  57   0.543  -2.588   8.966
  420   2HG2  THR  57          2HG2      THR  57   0.342  -1.768  10.524
  421   3HG2  THR  57          3HG2      THR  57   0.410  -3.541  10.454
  422    H    ALA  58           H        ALA  58  -3.968  -1.055  10.439
  423    HA   ALA  58           HA       ALA  58  -5.877  -2.578   9.434
  424   1HB   ALA  58          1HB       ALA  58  -7.537  -1.062  10.500
  425   2HB   ALA  58          2HB       ALA  58  -6.100  -1.293  11.516
  426   3HB   ALA  58          3HB       ALA  58  -6.296   0.209  10.587
  427    H    ALA  59           H        ALA  59  -5.528   0.772   8.356
  428    HA   ALA  59           HA       ALA  59  -8.006   0.468   6.772
  429   1HB   ALA  59          1HB       ALA  59  -7.772   2.688   6.042
  430   2HB   ALA  59          2HB       ALA  59  -7.186   2.701   7.720
  431   3HB   ALA  59          3HB       ALA  59  -6.036   2.712   6.345
  432    H    ILE  60           H        ILE  60  -4.562   0.560   6.191
  433    HA   ILE  60           HA       ILE  60  -4.450   0.284   3.397
  434    HB   ILE  60           HB       ILE  60  -2.644  -0.334   5.763
  435   1HG1  ILE  60          2HG1      ILE  60  -1.119   1.067   4.281
  436   2HG1  ILE  60          3HG1      ILE  60  -2.487   1.187   3.171
  437   1HG2  ILE  60          1HG2      ILE  60  -0.885  -1.190   4.287
  438   2HG2  ILE  60          2HG2      ILE  60  -2.211  -2.334   4.438
  439   3HG2  ILE  60          3HG2      ILE  60  -2.054  -1.348   2.958
  440   1HD1  ILE  60          1HD1      ILE  60  -2.170   3.185   4.711
  441   2HD1  ILE  60          2HD1      ILE  60  -3.744   2.434   4.989
  442   3HD1  ILE  60          3HD1      ILE  60  -2.399   2.122   6.102
  443    H    GLN  61           H        GLN  61  -4.578  -2.317   5.893
  444    HA   GLN  61           HA       GLN  61  -4.502  -4.307   3.891
  445   1HB   GLN  61          2HB       GLN  61  -4.016  -4.352   6.412
  446   2HB   GLN  61          3HB       GLN  61  -5.707  -4.835   6.603
  447   1HG   GLN  61          2HG       GLN  61  -5.323  -6.864   5.354
  448   2HG   GLN  61          3HG       GLN  61  -3.810  -6.260   4.666
  449   1HE2  GLN  61          1HE2      GLN  61  -2.098  -5.561   6.399
  450   2HE2  GLN  61          2HE2      GLN  61  -1.887  -6.726   7.697
  451    H    GLU  62           H        GLU  62  -7.240  -2.826   5.627
  452    HA   GLU  62           HA       GLU  62  -9.446  -4.161   4.574
  453   1HB   GLU  62          2HB       GLU  62  -8.958  -1.818   6.036
  454   2HB   GLU  62          3HB       GLU  62  -9.728  -1.187   4.603
  455   1HG   GLU  62          2HG       GLU  62 -10.885  -3.447   6.305
  456   2HG   GLU  62          3HG       GLU  62 -11.158  -1.737   6.639
  457    H    LYS  63           H        LYS  63  -7.789  -1.295   3.141
  458    HA   LYS  63           HA       LYS  63  -9.308  -1.375   0.705
  459   1HB   LYS  63          2HB       LYS  63  -6.895   0.113   1.774
  460   2HB   LYS  63          3HB       LYS  63  -7.555   0.356   0.184
  461   1HG   LYS  63          2HG       LYS  63  -9.010   0.775   2.856
  462   2HG   LYS  63          3HG       LYS  63  -8.424   2.012   1.762
  463   1HD   LYS  63          2HD       LYS  63 -10.627   2.056   1.108
  464   2HD   LYS  63          3HD       LYS  63 -10.029   0.822   0.005
  465   1HE   LYS  63          2HE       LYS  63 -11.880  -0.316   0.807
  466   2HE   LYS  63          3HE       LYS  63 -10.767  -0.792   2.088
  467   1HZ   LYS  63          1HZ       LYS  63 -12.519  -0.144   3.167
  468   2HZ   LYS  63          2HZ       LYS  63 -11.574   1.154   3.335
  469   3HZ   LYS  63          3HZ       LYS  63 -12.855   1.217   2.272
  470    H    ILE  64           H        ILE  64  -6.068  -2.578   1.516
  471    HA   ILE  64           HA       ILE  64  -5.088  -3.160  -0.986
  472    HB   ILE  64           HB       ILE  64  -4.750  -4.107   1.760
  473   1HG1  ILE  64          2HG1      ILE  64  -3.437  -2.312   0.525
  474   2HG1  ILE  64          3HG1      ILE  64  -2.521  -3.532   1.405
  475   1HG2  ILE  64          1HG2      ILE  64  -3.977  -5.976  -0.434
  476   2HG2  ILE  64          2HG2      ILE  64  -3.243  -5.930   1.191
  477   3HG2  ILE  64          3HG2      ILE  64  -4.963  -6.266   1.028
  478   1HD1  ILE  64          1HD1      ILE  64  -3.009  -3.633  -1.601
  479   2HD1  ILE  64          2HD1      ILE  64  -1.536  -3.042  -0.809
  480   3HD1  ILE  64          3HD1      ILE  64  -2.001  -4.741  -0.652
  481    H    GLU  65           H        GLU  65  -7.150  -5.156   1.236
  482    HA   GLU  65           HA       GLU  65  -7.766  -7.285  -0.530
  483   1HB   GLU  65          2HB       GLU  65  -9.189  -6.092   1.881
  484   2HB   GLU  65          3HB       GLU  65  -9.807  -7.509   1.029
  485   1HG   GLU  65          2HG       GLU  65  -6.925  -7.565   1.903
  486   2HG   GLU  65          3HG       GLU  65  -8.191  -7.740   3.125
  487    H    LYS  66           H        LYS  66  -9.822  -4.425   0.299
  488    HA   LYS  66           HA       LYS  66 -11.832  -5.084  -1.558
  489   1HB   LYS  66          2HB       LYS  66 -11.101  -2.714   0.066
  490   2HB   LYS  66          3HB       LYS  66 -12.042  -2.317  -1.367
  491   1HG   LYS  66          2HG       LYS  66 -12.864  -4.597   0.460
  492   2HG   LYS  66          3HG       LYS  66 -13.291  -2.948   0.880
  493   1HD   LYS  66          2HD       LYS  66 -13.894  -3.993  -1.912
  494   2HD   LYS  66          3HD       LYS  66 -14.957  -4.415  -0.561
  495   1HE   LYS  66          2HE       LYS  66 -15.438  -2.097  -0.070
  496   2HE   LYS  66          3HE       LYS  66 -14.216  -1.521  -1.216
  497   1HZ   LYS  66          1HZ       LYS  66 -16.646  -3.005  -1.970
  498   2HZ   LYS  66          2HZ       LYS  66 -16.442  -1.377  -2.091
  499   3HZ   LYS  66          3HZ       LYS  66 -15.517  -2.389  -3.003
  500    H    LEU  67           H        LEU  67  -8.848  -3.354  -2.203
  501    HA   LEU  67           HA       LEU  67  -9.564  -2.512  -4.886
  502   1HB   LEU  67          2HB       LEU  67  -6.951  -2.681  -3.375
  503   2HB   LEU  67          3HB       LEU  67  -7.062  -2.102  -5.038
  504    HG   LEU  67           HG       LEU  67  -8.835  -0.864  -2.905
  505   1HD1  LEU  67          1HD1      LEU  67  -6.046   0.112  -3.577
  506   2HD1  LEU  67          2HD1      LEU  67  -7.191   0.828  -2.435
  507   3HD1  LEU  67          3HD1      LEU  67  -6.458  -0.749  -2.090
  508   1HD2  LEU  67          1HD2      LEU  67  -8.702   1.097  -4.403
  509   2HD2  LEU  67          2HD2      LEU  67  -7.609   0.216  -5.487
  510   3HD2  LEU  67          3HD2      LEU  67  -9.292  -0.312  -5.296
  511    H    GLY  68           H        GLY  68  -8.610  -5.526  -3.465
  512   1HA   GLY  68          2HA       GLY  68  -8.837  -7.549  -4.543
  513   2HA   GLY  68          3HA       GLY  68  -8.631  -6.791  -6.124
  514    H    TYR  69           H        TYR  69  -6.560  -6.619  -3.149
  515    HA   TYR  69           HA       TYR  69  -4.353  -8.052  -4.559
  516   1HB   TYR  69          2HB       TYR  69  -4.570  -5.196  -3.891
  517   2HB   TYR  69          3HB       TYR  69  -3.185  -5.933  -3.123
  518    HD1  TYR  69           HD1      TYR  69  -1.234  -6.520  -4.339
  519    HD2  TYR  69           HD2      TYR  69  -4.865  -5.523  -6.438
  520    HE1  TYR  69           HE1      TYR  69   0.035  -6.265  -6.414
  521    HE2  TYR  69           HE2      TYR  69  -3.628  -5.434  -8.547
  522    HH   TYR  69           HH       TYR  69  -0.063  -5.835  -8.701
  523    H    HIS  70           H        HIS  70  -2.485  -8.357  -2.884
  524    HA   HIS  70           HA       HIS  70  -3.467  -8.486  -0.095
  525   1HB   HIS  70          2HB       HIS  70  -3.857 -10.690  -1.341
  526   2HB   HIS  70          3HB       HIS  70  -2.104 -10.878  -1.369
  527    HD1  HIS  70           1HD      HIS  70  -1.400 -10.101   1.666
  528    HD2  HIS  70           2HD      HIS  70  -4.745 -12.342   0.398
  529    HE1  HIS  70           1HE      HIS  70  -2.161 -11.459   3.653
  530    H    VAL  71           H        VAL  71  -1.955  -7.638   1.210
  531    HA   VAL  71           HA       VAL  71   0.823  -7.263   0.230
  532    HB   VAL  71           HB       VAL  71  -0.494  -5.324   1.074
  533   1HG1  VAL  71          1HG1      VAL  71  -0.208  -6.600   3.830
  534   2HG1  VAL  71          2HG1      VAL  71  -0.886  -5.010   3.447
  535   3HG1  VAL  71          3HG1      VAL  71  -1.735  -6.476   2.936
  536   1HG2  VAL  71          1HG2      VAL  71   1.955  -5.976   2.733
  537   2HG2  VAL  71          2HG2      VAL  71   1.967  -5.312   1.079
  538   3HG2  VAL  71          3HG2      VAL  71   1.285  -4.367   2.409
  539    H    VAL  72           H        VAL  72   2.608  -7.970   1.605
  540    HA   VAL  72           HA       VAL  72   1.956 -10.074   3.611
  541    HB   VAL  72           HB       VAL  72   4.112 -10.251   1.574
  542   1HG1  VAL  72          1HG1      VAL  72   4.330 -12.591   2.400
  543   2HG1  VAL  72          2HG1      VAL  72   4.686 -11.412   3.660
  544   3HG1  VAL  72          3HG1      VAL  72   3.117 -12.247   3.648
  545   1HG2  VAL  72          1HG2      VAL  72   2.776 -12.156   0.626
  546   2HG2  VAL  72          2HG2      VAL  72   1.443 -11.724   1.717
  547   3HG2  VAL  72          3HG2      VAL  72   1.959 -10.601   0.438
  548    H    ILE  73           H        ILE  73   3.338 -10.130   5.336
  549    HA   ILE  73           HA       ILE  73   5.065  -7.728   5.688
  550    HB   ILE  73           HB       ILE  73   3.279  -9.041   7.739
  551   1HG1  ILE  73          2HG1      ILE  73   2.446  -6.515   7.707
  552   2HG1  ILE  73          3HG1      ILE  73   3.097  -6.530   6.065
  553   1HG2  ILE  73          1HG2      ILE  73   3.946  -7.214   9.190
  554   2HG2  ILE  73          2HG2      ILE  73   5.392  -8.121   8.749
  555   3HG2  ILE  73          3HG2      ILE  73   5.048  -6.577   7.943
  556   1HD1  ILE  73          1HD1      ILE  73   0.661  -7.032   6.264
  557   2HD1  ILE  73          2HD1      ILE  73   1.575  -8.335   5.484
  558   3HD1  ILE  73          3HD1      ILE  73   1.083  -8.494   7.193
  559    H    GLU  74           H        GLU  74   6.848  -9.238   4.835
  560    HA   GLU  74           HA       GLU  74   7.703 -11.261   6.559
  561   1HB   GLU  74          2HB       GLU  74   8.928  -9.880   4.161
  562   2HB   GLU  74          3HB       GLU  74   9.728 -11.156   5.059
  563   1HG   GLU  74          2HG       GLU  74   7.700 -12.636   4.681
  564   2HG   GLU  74          3HG       GLU  74   7.082 -11.396   3.572
  565    H    GLY  75           H        GLY  75   7.773  -8.103   7.002
  566   1HA   GLY  75          2HA       GLY  75   8.660  -6.844   8.762
  567   2HA   GLY  75          3HA       GLY  75   9.578  -8.264   9.274
  568    H    ARG  76           H        ARG  76   9.486  -5.799   6.692
  569    HA   ARG  76           HA       ARG  76  10.989  -4.639   5.554
  570   1HB   ARG  76          2HB       ARG  76  11.149  -3.845   7.940
  571   2HB   ARG  76          3HB       ARG  76  12.537  -4.893   8.113
  572   1HG   ARG  76          2HG       ARG  76  13.047  -3.267   5.801
  573   2HG   ARG  76          3HG       ARG  76  12.249  -2.185   6.947
  574   1HD   ARG  76          2HD       ARG  76  14.635  -2.028   7.282
  575   2HD   ARG  76          3HD       ARG  76  13.954  -2.890   8.690
  576    HE   ARG  76           HE       ARG  76  14.536  -4.837   6.789
  577   1HH1  ARG  76          2HH2      ARG  76  16.431  -2.596   8.709
  578   2HH1  ARG  76          1HH2      ARG  76  17.934  -3.459   8.535
  579   1HH2  ARG  76          2HH1      ARG  76  16.383  -5.969   6.488
  580   2HH2  ARG  76          1HH1      ARG  76  17.913  -5.496   7.190
  Start of MODEL   28
    1   1H    MET   1          H1        MET   1   3.396  19.249  14.869
    2   2H    MET   1          H2        MET   1   4.304  18.434  15.979
    3   3H    MET   1          H3        MET   1   3.299  17.611  14.965
    4    HA   MET   1           HA       MET   1   2.319  17.750  17.147
    5   1HB   MET   1          2HB       MET   1   2.824  20.709  16.677
    6   2HB   MET   1          3HB       MET   1   1.552  20.159  17.775
    7   1HG   MET   1          2HG       MET   1   3.092  18.955  19.153
    8   2HG   MET   1          3HG       MET   1   4.466  19.409  18.126
    9   1HE   MET   1          1HE       MET   1   5.432  20.102  20.642
   10   2HE   MET   1          2HE       MET   1   4.706  21.419  21.598
   11   3HE   MET   1          3HE       MET   1   3.836  19.880  21.411
   12    H    LEU   2           H        LEU   2   1.146  16.649  15.260
   13    HA   LEU   2           HA       LEU   2  -1.473  17.424  15.375
   14   1HB   LEU   2          2HB       LEU   2  -0.363  19.092  13.435
   15   2HB   LEU   2          3HB       LEU   2  -0.881  17.751  12.442
   16    HG   LEU   2           HG       LEU   2  -2.650  19.233  14.430
   17   1HD1  LEU   2          1HD1      LEU   2  -1.947  20.661  12.551
   18   2HD1  LEU   2          2HD1      LEU   2  -2.484  19.423  11.393
   19   3HD1  LEU   2          3HD1      LEU   2  -3.667  20.250  12.430
   20   1HD2  LEU   2          1HD2      LEU   2  -3.451  16.923  14.048
   21   2HD2  LEU   2          2HD2      LEU   2  -4.505  18.076  13.223
   22   3HD2  LEU   2          3HD2      LEU   2  -3.313  17.148  12.291
   23    H    SER   3           H        SER   3   0.621  16.212  12.762
   24    HA   SER   3           HA       SER   3  -0.116  13.382  13.219
   25   1HB   SER   3          2HB       SER   3  -0.333  15.036  10.645
   26   2HB   SER   3          3HB       SER   3  -0.177  13.276  10.640
   27    HG   SER   3           HG       SER   3  -2.045  13.051  11.676
   28    H    GLU   4           H        GLU   4   1.795  12.170  13.062
   29    HA   GLU   4           HA       GLU   4   4.265  13.452  12.056
   30   1HB   GLU   4          2HB       GLU   4   3.610  11.145  13.806
   31   2HB   GLU   4          3HB       GLU   4   5.009  10.982  12.776
   32   1HG   GLU   4          2HG       GLU   4   5.739  13.215  13.674
   33   2HG   GLU   4          3HG       GLU   4   4.478  13.005  14.890
   34    H    GLN   5           H        GLN   5   5.493  11.508  10.763
   35    HA   GLN   5           HA       GLN   5   3.622  10.096   8.991
   36   1HB   GLN   5          2HB       GLN   5   6.031  11.751   8.217
   37   2HB   GLN   5          3HB       GLN   5   5.330  10.584   7.109
   38   1HG   GLN   5          2HG       GLN   5   3.519  12.739   8.266
   39   2HG   GLN   5          3HG       GLN   5   4.723  13.174   7.069
   40   1HE2  GLN   5          1HE2      GLN   5   3.095   9.967   7.072
   41   2HE2  GLN   5          2HE2      GLN   5   2.235  10.267   5.579
   42    H    LYS   6           H        LYS   6   4.451   8.056   8.436
   43    HA   LYS   6           HA       LYS   6   7.292   7.603   8.715
   44   1HB   LYS   6          2HB       LYS   6   5.340   5.787  10.175
   45   2HB   LYS   6          3HB       LYS   6   6.999   5.345   9.752
   46   1HG   LYS   6          2HG       LYS   6   7.813   7.403  10.911
   47   2HG   LYS   6          3HG       LYS   6   6.192   7.646  11.574
   48   1HD   LYS   6          2HD       LYS   6   6.252   5.596  12.802
   49   2HD   LYS   6          3HD       LYS   6   7.718   5.036  11.993
   50   1HE   LYS   6          2HE       LYS   6   7.570   7.554  13.737
   51   2HE   LYS   6          3HE       LYS   6   8.071   5.965  14.339
   52   1HZ   LYS   6          1HZ       LYS   6   9.429   7.468  12.195
   53   2HZ   LYS   6          2HZ       LYS   6   9.943   7.325  13.745
   54   3HZ   LYS   6          3HZ       LYS   6   9.887   5.998  12.771
   55    H    GLU   7           H        GLU   7   8.056   5.889   7.617
   56    HA   GLU   7           HA       GLU   7   6.630   5.420   5.084
   57   1HB   GLU   7          2HB       GLU   7   9.624   5.217   5.500
   58   2HB   GLU   7          3HB       GLU   7   8.657   5.579   4.074
   59   1HG   GLU   7          2HG       GLU   7   9.679   7.607   4.626
   60   2HG   GLU   7          3HG       GLU   7   8.094   7.819   5.382
   61    H    ILE   8           H        ILE   8   5.609   3.447   5.674
   62    HA   ILE   8           HA       ILE   8   7.209   1.386   7.013
   63    HB   ILE   8           HB       ILE   8   4.431   1.370   5.997
   64   1HG1  ILE   8          2HG1      ILE   8   4.346   3.193   7.478
   65   2HG1  ILE   8          3HG1      ILE   8   3.661   1.793   8.320
   66   1HG2  ILE   8          1HG2      ILE   8   5.954  -0.340   7.897
   67   2HG2  ILE   8          2HG2      ILE   8   4.167  -0.374   7.805
   68   3HG2  ILE   8          3HG2      ILE   8   5.133  -0.804   6.381
   69   1HD1  ILE   8          1HD1      ILE   8   5.157   2.963   9.805
   70   2HD1  ILE   8          2HD1      ILE   8   5.841   1.372   9.364
   71   3HD1  ILE   8          3HD1      ILE   8   6.463   2.853   8.598
   72    H    ALA   9           H        ALA   9   7.263  -0.764   5.984
   73    HA   ALA   9           HA       ALA   9   7.448  -0.753   3.031
   74   1HB   ALA   9          1HB       ALA   9   9.752  -0.364   3.959
   75   2HB   ALA   9          2HB       ALA   9   9.581  -1.841   4.926
   76   3HB   ALA   9          3HB       ALA   9   9.586  -1.938   3.154
   77    H    MET  10           H        MET  10   6.598  -2.725   2.221
   78    HA   MET  10           HA       MET  10   6.739  -5.096   3.856
   79   1HB   MET  10          2HB       MET  10   4.352  -5.598   3.961
   80   2HB   MET  10          3HB       MET  10   4.777  -4.217   4.950
   81   1HG   MET  10          2HG       MET  10   3.499  -4.007   2.197
   82   2HG   MET  10          3HG       MET  10   2.641  -4.057   3.736
   83   1HE   MET  10          1HE       MET  10   1.244  -2.085   3.313
   84   2HE   MET  10          2HE       MET  10   1.841  -0.462   2.927
   85   3HE   MET  10          3HE       MET  10   1.970  -1.765   1.720
   86    H    GLN  11           H        GLN  11   5.304  -6.909   2.660
   87    HA   GLN  11           HA       GLN  11   6.388  -6.899  -0.107
   88   1HB   GLN  11          2HB       GLN  11   5.578  -9.074   1.882
   89   2HB   GLN  11          3HB       GLN  11   5.900  -9.422   0.187
   90   1HG   GLN  11          2HG       GLN  11   7.842  -8.270   2.252
   91   2HG   GLN  11          3HG       GLN  11   7.854  -9.899   1.553
   92   1HE2  GLN  11          1HE2      GLN  11   7.612  -9.716  -1.056
   93   2HE2  GLN  11          2HE2      GLN  11   8.543  -8.429  -1.801
   94    H    VAL  12           H        VAL  12   5.082  -7.946  -1.752
   95    HA   VAL  12           HA       VAL  12   2.189  -7.211  -1.516
   96    HB   VAL  12           HB       VAL  12   4.078  -7.145  -3.914
   97   1HG1  VAL  12          1HG1      VAL  12   1.163  -6.298  -3.613
   98   2HG1  VAL  12          2HG1      VAL  12   2.202  -5.892  -4.996
   99   3HG1  VAL  12          3HG1      VAL  12   1.799  -7.579  -4.676
  100   1HG2  VAL  12          1HG2      VAL  12   2.892  -4.920  -2.207
  101   2HG2  VAL  12          2HG2      VAL  12   4.619  -5.326  -2.367
  102   3HG2  VAL  12          3HG2      VAL  12   3.738  -4.659  -3.741
  103    H    SER  13           H        SER  13   0.673  -8.642  -2.672
  104    HA   SER  13           HA       SER  13   1.762 -10.936  -4.098
  105   1HB   SER  13          2HB       SER  13   0.120 -11.238  -1.557
  106   2HB   SER  13          3HB       SER  13   0.190 -12.507  -2.789
  107    HG   SER  13           HG       SER  13   2.623 -11.429  -1.941
  108    H    GLY  14           H        GLY  14  -0.046 -12.139  -5.155
  109   1HA   GLY  14          2HA       GLY  14  -1.756 -12.054  -6.693
  110   2HA   GLY  14          3HA       GLY  14  -2.575 -10.865  -5.663
  111    H    MET  15           H        MET  15   0.568 -10.874  -7.407
  112    HA   MET  15           HA       MET  15  -0.270  -8.507  -8.987
  113   1HB   MET  15          2HB       MET  15   1.918  -7.525  -8.774
  114   2HB   MET  15          3HB       MET  15   1.261  -7.832  -7.166
  115   1HG   MET  15          2HG       MET  15   3.452  -8.432  -6.929
  116   2HG   MET  15          3HG       MET  15   2.687 -10.000  -7.181
  117   1HE   MET  15          1HE       MET  15   6.321 -10.266  -8.721
  118   2HE   MET  15          2HE       MET  15   5.836  -9.309  -7.310
  119   3HE   MET  15          3HE       MET  15   5.185 -10.948  -7.540
  120    H    THR  16           H        THR  16   0.980  -8.334 -10.948
  121    HA   THR  16           HA       THR  16   2.739 -10.078 -12.113
  122    HB   THR  16           HB       THR  16   0.884 -11.101 -13.857
  123    HG1  THR  16           1HG      THR  16  -0.125 -11.544 -11.265
  124   1HG2  THR  16          1HG2      THR  16   1.253 -13.295 -12.761
  125   2HG2  THR  16          2HG2      THR  16   2.744 -12.391 -13.051
  126   3HG2  THR  16          3HG2      THR  16   2.096 -12.506 -11.418
  127    H    CYS  17           H        CYS  17  -0.214  -8.226 -12.786
  128    HA   CYS  17           HA       CYS  17   0.323  -7.129 -15.267
  129   1HB   CYS  17          2HB       CYS  17  -1.718  -6.740 -13.910
  130   2HB   CYS  17          3HB       CYS  17  -0.781  -5.754 -12.771
  131    H    ALA  18           H        ALA  18   1.732  -6.257 -12.129
  132    HA   ALA  18           HA       ALA  18   3.491  -5.009 -11.487
  133   1HB   ALA  18          1HB       ALA  18   5.448  -4.861 -12.885
  134   2HB   ALA  18          2HB       ALA  18   4.713  -6.461 -13.103
  135   3HB   ALA  18          3HB       ALA  18   4.515  -5.208 -14.348
  136    H    ALA  19           H        ALA  19   1.045  -3.806 -12.896
  137    HA   ALA  19           HA       ALA  19   2.027  -0.991 -12.803
  138   1HB   ALA  19          1HB       ALA  19   1.680  -1.661 -15.156
  139   2HB   ALA  19          2HB       ALA  19   0.014  -2.134 -14.780
  140   3HB   ALA  19          3HB       ALA  19   0.506  -0.433 -14.632
  141    H    CYS  20           H        CYS  20  -0.875  -3.167 -12.659
  142    HA   CYS  20           HA       CYS  20  -2.563  -1.615 -11.148
  143   1HB   CYS  20          2HB       CYS  20  -1.907  -4.602 -11.117
  144   2HB   CYS  20          3HB       CYS  20  -3.105  -3.966 -10.017
  145    H    ALA  21           H        ALA  21   0.297  -3.319  -9.945
  146    HA   ALA  21           HA       ALA  21   0.049  -2.934  -7.212
  147   1HB   ALA  21          1HB       ALA  21   2.619  -2.571  -8.797
  148   2HB   ALA  21          2HB       ALA  21   2.430  -3.174  -7.133
  149   3HB   ALA  21          3HB       ALA  21   1.861  -4.148  -8.481
  150    H    ALA  22           H        ALA  22   0.741  -0.457  -9.680
  151    HA   ALA  22           HA       ALA  22   1.361   1.664  -7.756
  152   1HB   ALA  22          1HB       ALA  22   0.480   1.830 -10.668
  153   2HB   ALA  22          2HB       ALA  22   1.215   3.117  -9.694
  154   3HB   ALA  22          3HB       ALA  22   2.170   1.681 -10.129
  155    H    ARG  23           H        ARG  23  -1.409   0.638  -9.749
  156    HA   ARG  23           HA       ARG  23  -3.175   2.767  -9.177
  157   1HB   ARG  23          2HB       ARG  23  -3.784  -0.167  -9.742
  158   2HB   ARG  23          3HB       ARG  23  -4.987   1.103  -9.744
  159   1HG   ARG  23          2HG       ARG  23  -2.524   1.280 -11.535
  160   2HG   ARG  23          3HG       ARG  23  -3.922   0.317 -11.995
  161   1HD   ARG  23          2HD       ARG  23  -4.048   3.283 -11.272
  162   2HD   ARG  23          3HD       ARG  23  -3.925   2.696 -12.918
  163    HE   ARG  23           HE       ARG  23  -6.271   2.758 -11.206
  164   1HH1  ARG  23          2HH2      ARG  23  -4.814   1.000 -13.885
  165   2HH1  ARG  23          1HH2      ARG  23  -6.309   0.430 -14.557
  166   1HH2  ARG  23          2HH1      ARG  23  -8.296   1.995 -12.040
  167   2HH2  ARG  23          1HH1      ARG  23  -8.335   1.014 -13.465
  168    H    ILE  24           H        ILE  24  -2.801  -0.412  -7.527
  169    HA   ILE  24           HA       ILE  24  -4.808   0.103  -5.630
  170    HB   ILE  24           HB       ILE  24  -4.040  -1.677  -4.303
  171   1HG1  ILE  24          2HG1      ILE  24  -1.491  -1.329  -5.831
  172   2HG1  ILE  24          3HG1      ILE  24  -1.783  -1.273  -4.071
  173   1HG2  ILE  24          1HG2      ILE  24  -3.489  -2.530  -7.164
  174   2HG2  ILE  24          2HG2      ILE  24  -4.278  -3.420  -5.852
  175   3HG2  ILE  24          3HG2      ILE  24  -5.107  -2.063  -6.616
  176   1HD1  ILE  24          1HD1      ILE  24  -0.580  -3.291  -4.627
  177   2HD1  ILE  24          2HD1      ILE  24  -2.223  -3.691  -4.074
  178   3HD1  ILE  24          3HD1      ILE  24  -1.817  -3.720  -5.821
  179    H    GLU  25           H        GLU  25  -1.233   0.587  -5.180
  180    HA   GLU  25           HA       GLU  25  -1.413   1.833  -2.720
  181   1HB   GLU  25          2HB       GLU  25   0.591   1.572  -4.837
  182   2HB   GLU  25          3HB       GLU  25   0.705   3.152  -4.044
  183   1HG   GLU  25          2HG       GLU  25   2.093   1.386  -2.958
  184   2HG   GLU  25          3HG       GLU  25   0.917   2.115  -1.858
  185    H    LYS  26           H        LYS  26  -2.007   3.308  -5.881
  186    HA   LYS  26           HA       LYS  26  -2.009   6.010  -4.774
  187   1HB   LYS  26          2HB       LYS  26  -2.970   4.957  -7.444
  188   2HB   LYS  26          3HB       LYS  26  -2.878   6.673  -7.015
  189   1HG   LYS  26          2HG       LYS  26  -0.478   4.797  -6.924
  190   2HG   LYS  26          3HG       LYS  26  -0.921   5.731  -8.348
  191   1HD   LYS  26          2HD       LYS  26  -0.582   7.821  -7.187
  192   2HD   LYS  26          3HD       LYS  26  -0.292   7.029  -5.638
  193   1HE   LYS  26          2HE       LYS  26   1.440   6.569  -8.106
  194   2HE   LYS  26          3HE       LYS  26   1.792   7.793  -6.878
  195   1HZ   LYS  26          1HZ       LYS  26   2.972   5.703  -6.554
  196   2HZ   LYS  26          2HZ       LYS  26   2.104   6.126  -5.251
  197   3HZ   LYS  26          3HZ       LYS  26   1.557   4.927  -6.242
  198    H    GLY  27           H        GLY  27  -4.640   3.683  -5.616
  199   1HA   GLY  27          2HA       GLY  27  -6.697   5.530  -4.656
  200   2HA   GLY  27          3HA       GLY  27  -6.931   3.815  -4.903
  201    H    LEU  28           H        LEU  28  -4.606   3.069  -3.194
  202    HA   LEU  28           HA       LEU  28  -5.819   2.875  -0.604
  203   1HB   LEU  28          2HB       LEU  28  -4.190   1.361  -1.490
  204   2HB   LEU  28          3HB       LEU  28  -2.943   2.608  -1.444
  205    HG   LEU  28           HG       LEU  28  -4.396   1.938   1.102
  206   1HD1  LEU  28          1HD1      LEU  28  -3.984  -0.197   0.179
  207   2HD1  LEU  28          2HD1      LEU  28  -2.301   0.214  -0.225
  208   3HD1  LEU  28          3HD1      LEU  28  -2.805   0.073   1.470
  209   1HD2  LEU  28          1HD2      LEU  28  -2.659   3.804   0.874
  210   2HD2  LEU  28          2HD2      LEU  28  -2.240   2.583   2.059
  211   3HD2  LEU  28          3HD2      LEU  28  -1.467   2.558   0.460
  212    H    LYS  29           H        LYS  29  -3.263   5.048  -1.921
  213    HA   LYS  29           HA       LYS  29  -2.953   6.708   0.260
  214   1HB   LYS  29          2HB       LYS  29  -1.698   6.648  -1.997
  215   2HB   LYS  29          3HB       LYS  29  -2.947   7.750  -2.569
  216   1HG   LYS  29          2HG       LYS  29  -2.023   8.835  -0.078
  217   2HG   LYS  29          3HG       LYS  29  -0.606   8.177  -0.850
  218   1HD   LYS  29          2HD       LYS  29  -0.431   9.988  -2.138
  219   2HD   LYS  29          3HD       LYS  29  -1.954   9.640  -2.928
  220   1HE   LYS  29          2HE       LYS  29  -1.578  11.193  -0.325
  221   2HE   LYS  29          3HE       LYS  29  -1.845  11.915  -1.912
  222   1HZ   LYS  29          1HZ       LYS  29  -4.025  10.818  -1.892
  223   2HZ   LYS  29          2HZ       LYS  29  -3.733  10.195  -0.403
  224   3HZ   LYS  29          3HZ       LYS  29  -3.847  11.816  -0.591
  225    H    ARG  30           H        ARG  30  -5.872   6.497  -1.673
  226    HA   ARG  30           HA       ARG  30  -6.726   9.251  -1.066
  227   1HB   ARG  30          2HB       ARG  30  -7.914   6.941  -2.602
  228   2HB   ARG  30          3HB       ARG  30  -8.939   8.223  -2.061
  229   1HG   ARG  30          2HG       ARG  30  -7.538   9.895  -3.190
  230   2HG   ARG  30          3HG       ARG  30  -6.402   8.622  -3.701
  231   1HD   ARG  30          2HD       ARG  30  -8.130   7.545  -5.028
  232   2HD   ARG  30          3HD       ARG  30  -9.363   8.686  -4.430
  233    HE   ARG  30           HE       ARG  30  -7.343  10.249  -5.573
  234   1HH1  ARG  30          2HH2      ARG  30  -9.647   7.815  -6.639
  235   2HH1  ARG  30          1HH2      ARG  30  -9.828   8.435  -8.251
  236   1HH2  ARG  30          2HH1      ARG  30  -7.569  11.142  -7.702
  237   2HH2  ARG  30          1HH1      ARG  30  -8.609  10.386  -8.862
  238    H    MET  31           H        MET  31  -6.471   6.449   0.853
  239    HA   MET  31           HA       MET  31  -8.897   6.843   2.347
  240   1HB   MET  31          2HB       MET  31  -7.977   5.277   3.915
  241   2HB   MET  31          3HB       MET  31  -7.494   4.791   2.291
  242   1HG   MET  31          2HG       MET  31  -5.241   5.787   2.707
  243   2HG   MET  31          3HG       MET  31  -5.726   6.266   4.305
  244   1HE   MET  31          1HE       MET  31  -5.624   1.831   3.216
  245   2HE   MET  31          2HE       MET  31  -7.131   2.753   3.341
  246   3HE   MET  31          3HE       MET  31  -5.925   3.154   2.077
  247    HA   PRO  32           HA       PRO  32  -7.482  10.163   5.155
  248   1HB   PRO  32          2HB       PRO  32  -8.594   9.319   7.536
  249   2HB   PRO  32          3HB       PRO  32  -9.532  10.092   6.231
  250   1HG   PRO  32          2HG       PRO  32  -9.192   7.135   6.786
  251   2HG   PRO  32          3HG       PRO  32 -10.723   8.025   6.526
  252   1HD   PRO  32          2HD       PRO  32  -9.558   6.677   4.521
  253   2HD   PRO  32          3HD       PRO  32 -10.261   8.282   4.194
  254    H    GLY  33           H        GLY  33  -5.533  10.299   6.226
  255   1HA   GLY  33          2HA       GLY  33  -4.016   9.653   7.839
  256   2HA   GLY  33          3HA       GLY  33  -4.434   7.955   7.647
  257    H    VAL  34           H        VAL  34  -4.115   8.019   4.645
  258    HA   VAL  34           HA       VAL  34  -1.160   7.838   4.632
  259    HB   VAL  34           HB       VAL  34  -3.178   6.999   2.552
  260   1HG1  VAL  34          1HG1      VAL  34  -0.976   7.496   1.524
  261   2HG1  VAL  34          2HG1      VAL  34  -0.156   6.578   2.789
  262   3HG1  VAL  34          3HG1      VAL  34  -1.196   5.745   1.615
  263   1HG2  VAL  34          1HG2      VAL  34  -2.720   4.738   3.285
  264   2HG2  VAL  34          2HG2      VAL  34  -1.503   5.270   4.439
  265   3HG2  VAL  34          3HG2      VAL  34  -3.195   5.672   4.723
  266    H    THR  35           H        THR  35   0.168   9.272   3.717
  267    HA   THR  35           HA       THR  35  -1.066  11.603   2.309
  268    HB   THR  35           HB       THR  35   1.218  11.359   4.171
  269    HG1  THR  35           1HG      THR  35  -1.148  12.921   4.203
  270   1HG2  THR  35          1HG2      THR  35   0.439  13.697   2.392
  271   2HG2  THR  35          2HG2      THR  35   1.353  13.892   3.906
  272   3HG2  THR  35          3HG2      THR  35   2.035  12.927   2.587
  273    H    ASP  36           H        ASP  36   1.515   9.098   2.079
  274    HA   ASP  36           HA       ASP  36   1.308   9.616  -0.720
  275   1HB   ASP  36          2HB       ASP  36   3.508  10.879   0.402
  276   2HB   ASP  36          3HB       ASP  36   4.195   9.329  -0.114
  277    H    ALA  37           H        ALA  37   2.475   7.980  -1.989
  278    HA   ALA  37           HA       ALA  37   2.899   5.401  -0.627
  279   1HB   ALA  37          1HB       ALA  37   0.389   5.613  -0.633
  280   2HB   ALA  37          2HB       ALA  37   0.442   5.683  -2.410
  281   3HB   ALA  37          3HB       ALA  37   0.982   4.228  -1.551
  282    H    ASN  38           H        ASN  38   4.105   3.912  -1.778
  283    HA   ASN  38           HA       ASN  38   4.760   4.558  -4.595
  284   1HB   ASN  38          2HB       ASN  38   7.259   4.370  -3.282
  285   2HB   ASN  38          3HB       ASN  38   6.544   5.756  -4.087
  286   1HD2  ASN  38          1HD2      ASN  38   5.916   4.190  -0.864
  287   2HD2  ASN  38          2HD2      ASN  38   6.228   5.680   0.023
  288    H    VAL  39           H        VAL  39   4.794   2.622  -5.565
  289    HA   VAL  39           HA       VAL  39   5.233   0.218  -3.959
  290    HB   VAL  39           HB       VAL  39   3.215   0.545  -5.269
  291   1HG1  VAL  39          1HG1      VAL  39   3.148   0.242  -7.661
  292   2HG1  VAL  39          2HG1      VAL  39   4.125   1.672  -7.306
  293   3HG1  VAL  39          3HG1      VAL  39   4.880   0.140  -7.799
  294   1HG2  VAL  39          1HG2      VAL  39   4.556  -1.831  -6.470
  295   2HG2  VAL  39          2HG2      VAL  39   4.408  -1.730  -4.699
  296   3HG2  VAL  39          3HG2      VAL  39   2.961  -1.648  -5.700
  297    H    ASN  40           H        ASN  40   7.373  -0.220  -3.670
  298    HA   ASN  40           HA       ASN  40   9.293   0.316  -5.843
  299   1HB   ASN  40          2HB       ASN  40   9.733   0.880  -3.447
  300   2HB   ASN  40          3HB       ASN  40   9.750  -0.850  -3.074
  301   1HD2  ASN  40          1HD2      ASN  40  12.002   0.321  -2.379
  302   2HD2  ASN  40          2HD2      ASN  40  13.279   0.103  -3.565
  303    H    LEU  41           H        LEU  41   7.654  -1.291  -6.925
  304    HA   LEU  41           HA       LEU  41   7.950  -4.082  -6.346
  305   1HB   LEU  41          2HB       LEU  41   6.257  -2.451  -7.936
  306   2HB   LEU  41          3HB       LEU  41   7.028  -3.524  -9.081
  307    HG   LEU  41           HG       LEU  41   4.806  -4.216  -8.128
  308   1HD1  LEU  41          1HD1      LEU  41   7.112  -6.177  -7.823
  309   2HD1  LEU  41          2HD1      LEU  41   5.395  -6.610  -7.950
  310   3HD1  LEU  41          3HD1      LEU  41   6.212  -5.817  -9.309
  311   1HD2  LEU  41          1HD2      LEU  41   5.535  -3.660  -5.660
  312   2HD2  LEU  41          2HD2      LEU  41   4.482  -5.047  -6.002
  313   3HD2  LEU  41          3HD2      LEU  41   6.198  -5.297  -5.676
  314    H    ALA  42           H        ALA  42   9.848  -1.852  -8.138
  315    HA   ALA  42           HA       ALA  42  11.457  -3.434  -9.779
  316   1HB   ALA  42          1HB       ALA  42  13.256  -1.868  -9.199
  317   2HB   ALA  42          2HB       ALA  42  11.733  -0.985  -9.456
  318   3HB   ALA  42          3HB       ALA  42  12.331  -1.289  -7.804
  319    H    THR  43           H        THR  43  11.330  -3.319  -6.188
  320    HA   THR  43           HA       THR  43  13.117  -5.697  -6.189
  321    HB   THR  43           HB       THR  43  14.281  -3.703  -5.436
  322    HG1  THR  43           1HG      THR  43  15.107  -4.750  -3.556
  323   1HG2  THR  43          1HG2      THR  43  12.304  -2.679  -4.166
  324   2HG2  THR  43          2HG2      THR  43  12.655  -3.832  -2.868
  325   3HG2  THR  43          3HG2      THR  43  13.872  -2.640  -3.341
  326    H    GLU  44           H        GLU  44  10.347  -5.686  -6.577
  327    HA   GLU  44           HA       GLU  44   8.319  -6.320  -5.782
  328   1HB   GLU  44          2HB       GLU  44  10.214  -8.426  -4.682
  329   2HB   GLU  44          3HB       GLU  44   8.456  -8.610  -4.807
  330   1HG   GLU  44          2HG       GLU  44   8.601  -8.117  -7.274
  331   2HG   GLU  44          3HG       GLU  44  10.366  -8.195  -7.132
  332    H    THR  45           H        THR  45   9.166  -4.217  -4.088
  333    HA   THR  45           HA       THR  45   8.045  -5.034  -1.441
  334    HB   THR  45           HB       THR  45  10.232  -3.035  -2.191
  335    HG1  THR  45           1HG      THR  45  10.834  -5.286  -2.132
  336   1HG2  THR  45          1HG2      THR  45   9.020  -3.743   0.504
  337   2HG2  THR  45          2HG2      THR  45  10.538  -2.845   0.286
  338   3HG2  THR  45          3HG2      THR  45   9.021  -2.141  -0.291
  339    H    VAL  46           H        VAL  46   6.775  -3.250  -0.427
  340    HA   VAL  46           HA       VAL  46   6.119  -0.992  -2.251
  341    HB   VAL  46           HB       VAL  46   4.303  -2.532  -2.495
  342   1HG1  VAL  46          1HG1      VAL  46   4.067  -2.473   0.542
  343   2HG1  VAL  46          2HG1      VAL  46   2.838  -3.138  -0.546
  344   3HG1  VAL  46          3HG1      VAL  46   4.433  -3.895  -0.456
  345   1HG2  VAL  46          1HG2      VAL  46   3.827  -0.060  -2.284
  346   2HG2  VAL  46          2HG2      VAL  46   2.513  -1.198  -1.944
  347   3HG2  VAL  46          3HG2      VAL  46   3.326  -0.368  -0.606
  348    H    ASN  47           H        ASN  47   5.695   1.017  -1.205
  349    HA   ASN  47           HA       ASN  47   6.307   1.054   1.678
  350   1HB   ASN  47          2HB       ASN  47   7.556   2.654  -0.600
  351   2HB   ASN  47          3HB       ASN  47   7.452   3.327   1.029
  352   1HD2  ASN  47          1HD2      ASN  47   8.269   1.805   2.845
  353   2HD2  ASN  47          2HD2      ASN  47   9.887   1.214   2.500
  354    H    VAL  48           H        VAL  48   5.085   2.646   2.829
  355    HA   VAL  48           HA       VAL  48   3.244   4.296   1.233
  356    HB   VAL  48           HB       VAL  48   2.258   2.460   3.450
  357   1HG1  VAL  48          1HG1      VAL  48   0.827   4.370   1.538
  358   2HG1  VAL  48          2HG1      VAL  48   0.040   3.329   2.734
  359   3HG1  VAL  48          3HG1      VAL  48   1.075   4.659   3.269
  360   1HG2  VAL  48          1HG2      VAL  48   2.662   1.132   1.399
  361   2HG2  VAL  48          2HG2      VAL  48   0.926   1.387   1.614
  362   3HG2  VAL  48          3HG2      VAL  48   1.817   2.351   0.425
  363    H    ILE  49           H        ILE  49   3.132   6.257   2.066
  364    HA   ILE  49           HA       ILE  49   4.753   6.787   4.453
  365    HB   ILE  49           HB       ILE  49   3.941   8.759   2.284
  366   1HG1  ILE  49          2HG1      ILE  49   5.098   7.079   1.056
  367   2HG1  ILE  49          3HG1      ILE  49   6.115   8.500   1.237
  368   1HG2  ILE  49          1HG2      ILE  49   5.940   9.990   3.105
  369   2HG2  ILE  49          2HG2      ILE  49   4.675   9.799   4.327
  370   3HG2  ILE  49          3HG2      ILE  49   6.124   8.784   4.397
  371   1HD1  ILE  49          1HD1      ILE  49   7.377   7.371   3.062
  372   2HD1  ILE  49          2HD1      ILE  49   6.409   5.899   2.791
  373   3HD1  ILE  49          3HD1      ILE  49   7.472   6.518   1.519
  374    H    TYR  50           H        TYR  50   3.275   6.860   6.190
  375    HA   TYR  50           HA       TYR  50   0.772   8.466   5.835
  376   1HB   TYR  50          2HB       TYR  50  -0.596   6.705   6.702
  377   2HB   TYR  50          3HB       TYR  50   0.256   6.182   5.270
  378    HD1  TYR  50           HD1      TYR  50   0.013   5.825   8.952
  379    HD2  TYR  50           HD2      TYR  50   1.810   4.276   5.364
  380    HE1  TYR  50           HE1      TYR  50   0.436   3.665  10.077
  381    HE2  TYR  50           HE2      TYR  50   1.946   2.045   6.393
  382    HH   TYR  50           HH       TYR  50   1.399   0.764   8.254
  383    H    ASP  51           H        ASP  51  -0.408   8.723   7.813
  384    HA   ASP  51           HA       ASP  51   1.460   9.444  10.007
  385   1HB   ASP  51          2HB       ASP  51  -0.065  11.143   9.465
  386   2HB   ASP  51          3HB       ASP  51  -1.446  10.047   9.545
  387    HA   PRO  52           HA       PRO  52   0.234   5.420  11.675
  388   1HB   PRO  52          2HB       PRO  52   2.146   5.027  13.525
  389   2HB   PRO  52          3HB       PRO  52   2.495   4.990  11.776
  390   1HG   PRO  52          2HG       PRO  52   2.813   7.361  13.662
  391   2HG   PRO  52          3HG       PRO  52   4.049   6.685  12.559
  392   1HD   PRO  52          2HD       PRO  52   2.486   8.805  11.867
  393   2HD   PRO  52          3HD       PRO  52   2.960   7.566  10.665
  394    H    ALA  53           H        ALA  53  -0.345   8.496  13.008
  395    HA   ALA  53           HA       ALA  53  -1.401   7.454  15.571
  396   1HB   ALA  53          1HB       ALA  53  -1.633  10.180  14.238
  397   2HB   ALA  53          2HB       ALA  53  -2.104   9.754  15.893
  398   3HB   ALA  53          3HB       ALA  53  -0.387   9.738  15.429
  399    H    GLU  54           H        GLU  54  -2.226   8.022  12.198
  400    HA   GLU  54           HA       GLU  54  -5.095   8.126  12.836
  401   1HB   GLU  54          2HB       GLU  54  -3.613   9.877  11.462
  402   2HB   GLU  54          3HB       GLU  54  -4.017   8.830  10.105
  403   1HG   GLU  54          2HG       GLU  54  -6.181   9.897  11.981
  404   2HG   GLU  54          3HG       GLU  54  -5.460  10.927  10.747
  405    H    THR  55           H        THR  55  -2.796   6.785  10.501
  406    HA   THR  55           HA       THR  55  -4.322   4.260  10.393
  407    HB   THR  55           HB       THR  55  -2.710   3.834   8.263
  408    HG1  THR  55           1HG      THR  55  -3.061   6.613   8.443
  409   1HG2  THR  55          1HG2      THR  55  -4.586   4.616   6.936
  410   2HG2  THR  55          2HG2      THR  55  -5.112   3.681   8.362
  411   3HG2  THR  55          3HG2      THR  55  -5.275   5.471   8.343
  412    H    GLY  56           H        GLY  56  -2.474   2.550   9.710
  413   1HA   GLY  56          2HA       GLY  56  -0.438   1.754  11.297
  414   2HA   GLY  56          3HA       GLY  56  -1.789   1.965  12.440
  415    H    THR  57           H        THR  57  -0.814   0.539   9.610
  416    HA   THR  57           HA       THR  57  -1.654  -0.232   7.890
  417    HB   THR  57           HB       THR  57   0.047  -1.551   7.929
  418    HG1  THR  57           1HG      THR  57  -1.928  -2.918   7.244
  419   1HG2  THR  57          1HG2      THR  57  -1.005  -2.621  10.537
  420   2HG2  THR  57          2HG2      THR  57   0.475  -3.236   9.747
  421   3HG2  THR  57          3HG2      THR  57   0.383  -1.533  10.249
  422    H    ALA  58           H        ALA  58  -3.754  -1.185  10.416
  423    HA   ALA  58           HA       ALA  58  -5.859  -2.556   9.604
  424   1HB   ALA  58          1HB       ALA  58  -5.730   0.332  10.486
  425   2HB   ALA  58          2HB       ALA  58  -7.194  -0.690  10.594
  426   3HB   ALA  58          3HB       ALA  58  -5.735  -1.086  11.538
  427    H    ALA  59           H        ALA  59  -5.237   0.690   8.202
  428    HA   ALA  59           HA       ALA  59  -7.832   0.416   6.765
  429   1HB   ALA  59          1HB       ALA  59  -7.178   2.598   7.739
  430   2HB   ALA  59          2HB       ALA  59  -5.801   2.632   6.604
  431   3HB   ALA  59          3HB       ALA  59  -7.466   2.677   5.989
  432    H    ILE  60           H        ILE  60  -4.414   0.578   6.159
  433    HA   ILE  60           HA       ILE  60  -4.170   0.229   3.398
  434    HB   ILE  60           HB       ILE  60  -2.573  -0.299   5.860
  435   1HG1  ILE  60          2HG1      ILE  60  -1.735   0.855   3.265
  436   2HG1  ILE  60          3HG1      ILE  60  -2.867   1.779   4.251
  437   1HG2  ILE  60          1HG2      ILE  60  -1.770  -1.525   3.200
  438   2HG2  ILE  60          2HG2      ILE  60  -0.699  -1.252   4.594
  439   3HG2  ILE  60          3HG2      ILE  60  -2.042  -2.383   4.738
  440   1HD1  ILE  60          1HD1      ILE  60  -1.332   1.724   6.190
  441   2HD1  ILE  60          2HD1      ILE  60  -0.098   0.924   5.186
  442   3HD1  ILE  60          3HD1      ILE  60  -0.648   2.570   4.800
  443    H    GLN  61           H        GLN  61  -4.454  -2.433   5.846
  444    HA   GLN  61           HA       GLN  61  -4.586  -4.400   3.822
  445   1HB   GLN  61          2HB       GLN  61  -4.769  -4.355   6.649
  446   2HB   GLN  61          3HB       GLN  61  -6.183  -5.220   6.051
  447   1HG   GLN  61          2HG       GLN  61  -4.914  -7.042   5.941
  448   2HG   GLN  61          3HG       GLN  61  -4.085  -6.362   4.551
  449   1HE2  GLN  61          1HE2      GLN  61  -2.310  -4.602   5.324
  450   2HE2  GLN  61          2HE2      GLN  61  -1.353  -5.084   6.719
  451    H    GLU  62           H        GLU  62  -7.229  -2.615   5.470
  452    HA   GLU  62           HA       GLU  62  -9.456  -3.811   4.341
  453   1HB   GLU  62          2HB       GLU  62  -9.096  -1.768   6.025
  454   2HB   GLU  62          3HB       GLU  62  -9.413  -0.783   4.606
  455   1HG   GLU  62          2HG       GLU  62 -11.248  -2.978   5.675
  456   2HG   GLU  62          3HG       GLU  62 -11.385  -1.274   6.099
  457    H    LYS  63           H        LYS  63  -7.669  -0.991   2.961
  458    HA   LYS  63           HA       LYS  63  -9.111  -1.013   0.446
  459   1HB   LYS  63          2HB       LYS  63  -6.669   0.356   1.624
  460   2HB   LYS  63          3HB       LYS  63  -7.132   0.534  -0.038
  461   1HG   LYS  63          2HG       LYS  63  -8.775   1.375   2.396
  462   2HG   LYS  63          3HG       LYS  63  -7.945   2.419   1.229
  463   1HD   LYS  63          2HD       LYS  63 -10.075   2.660   0.451
  464   2HD   LYS  63          3HD       LYS  63  -9.464   1.355  -0.557
  465   1HE   LYS  63          2HE       LYS  63 -11.383   0.283   0.066
  466   2HE   LYS  63          3HE       LYS  63 -10.504  -0.099   1.559
  467   1HZ   LYS  63          1HZ       LYS  63 -12.612   1.800   1.304
  468   2HZ   LYS  63          2HZ       LYS  63 -12.239   0.613   2.427
  469   3HZ   LYS  63          3HZ       LYS  63 -11.423   2.014   2.444
  470    H    ILE  64           H        ILE  64  -6.020  -2.450   1.469
  471    HA   ILE  64           HA       ILE  64  -5.014  -3.114  -0.990
  472    HB   ILE  64           HB       ILE  64  -4.827  -4.035   1.762
  473   1HG1  ILE  64          2HG1      ILE  64  -3.350  -2.384   0.566
  474   2HG1  ILE  64          3HG1      ILE  64  -2.554  -3.656   1.484
  475   1HG2  ILE  64          1HG2      ILE  64  -5.174  -6.207   1.086
  476   2HG2  ILE  64          2HG2      ILE  64  -4.146  -6.013  -0.359
  477   3HG2  ILE  64          3HG2      ILE  64  -3.434  -6.000   1.278
  478   1HD1  ILE  64          1HD1      ILE  64  -2.133  -4.944  -0.529
  479   2HD1  ILE  64          2HD1      ILE  64  -2.985  -3.751  -1.529
  480   3HD1  ILE  64          3HD1      ILE  64  -1.478  -3.300  -0.697
  481    H    GLU  65           H        GLU  65  -7.250  -4.953   1.170
  482    HA   GLU  65           HA       GLU  65  -7.966  -7.060  -0.579
  483   1HB   GLU  65          2HB       GLU  65  -9.268  -5.762   1.839
  484   2HB   GLU  65          3HB       GLU  65 -10.075  -7.069   0.971
  485   1HG   GLU  65          2HG       GLU  65  -7.220  -7.415   1.896
  486   2HG   GLU  65          3HG       GLU  65  -8.574  -7.662   3.003
  487    H    LYS  66           H        LYS  66  -9.861  -4.060   0.161
  488    HA   LYS  66           HA       LYS  66 -11.919  -4.621  -1.647
  489   1HB   LYS  66          2HB       LYS  66 -11.022  -2.315  -0.134
  490   2HB   LYS  66          3HB       LYS  66 -11.679  -1.798  -1.673
  491   1HG   LYS  66          2HG       LYS  66 -13.817  -2.375  -1.167
  492   2HG   LYS  66          3HG       LYS  66 -13.364  -3.863  -0.305
  493   1HD   LYS  66          2HD       LYS  66 -12.483  -2.581   1.548
  494   2HD   LYS  66          3HD       LYS  66 -12.965  -1.072   0.767
  495   1HE   LYS  66          2HE       LYS  66 -14.703  -1.313   2.228
  496   2HE   LYS  66          3HE       LYS  66 -15.401  -2.069   0.783
  497   1HZ   LYS  66          1HZ       LYS  66 -15.710  -3.375   2.806
  498   2HZ   LYS  66          2HZ       LYS  66 -14.684  -4.214   1.813
  499   3HZ   LYS  66          3HZ       LYS  66 -14.092  -3.342   3.088
  500    H    LEU  67           H        LEU  67  -8.850  -3.006  -2.341
  501    HA   LEU  67           HA       LEU  67  -9.477  -2.277  -5.058
  502   1HB   LEU  67          2HB       LEU  67  -6.911  -2.528  -3.467
  503   2HB   LEU  67          3HB       LEU  67  -6.918  -2.051  -5.160
  504    HG   LEU  67           HG       LEU  67  -8.705  -0.563  -3.208
  505   1HD1  LEU  67          1HD1      LEU  67  -6.523  -0.451  -2.138
  506   2HD1  LEU  67          2HD1      LEU  67  -5.750  -0.085  -3.667
  507   3HD1  LEU  67          3HD1      LEU  67  -6.851   1.097  -2.928
  508   1HD2  LEU  67          1HD2      LEU  67  -8.352   1.273  -4.820
  509   2HD2  LEU  67          2HD2      LEU  67  -7.242   0.262  -5.763
  510   3HD2  LEU  67          3HD2      LEU  67  -8.962  -0.156  -5.664
  511    H    GLY  68           H        GLY  68  -8.724  -5.298  -3.561
  512   1HA   GLY  68          2HA       GLY  68  -9.073  -7.324  -4.591
  513   2HA   GLY  68          3HA       GLY  68  -8.799  -6.620  -6.190
  514    H    TYR  69           H        TYR  69  -6.737  -6.417  -3.212
  515    HA   TYR  69           HA       TYR  69  -4.602  -7.986  -4.577
  516   1HB   TYR  69          2HB       TYR  69  -4.742  -5.115  -4.189
  517   2HB   TYR  69          3HB       TYR  69  -3.485  -5.755  -3.155
  518    HD1  TYR  69           HD1      TYR  69  -4.773  -5.828  -6.676
  519    HD2  TYR  69           HD2      TYR  69  -1.399  -6.465  -4.072
  520    HE1  TYR  69           HE1      TYR  69  -3.284  -5.887  -8.626
  521    HE2  TYR  69           HE2      TYR  69   0.104  -6.297  -5.990
  522    HH   TYR  69           HH       TYR  69   0.290  -6.046  -8.248
  523    H    HIS  70           H        HIS  70  -2.691  -8.198  -2.906
  524    HA   HIS  70           HA       HIS  70  -3.650  -8.315  -0.138
  525   1HB   HIS  70          2HB       HIS  70  -4.126 -10.525  -1.310
  526   2HB   HIS  70          3HB       HIS  70  -2.385 -10.730  -1.486
  527    HD1  HIS  70           1HD      HIS  70  -2.996 -13.010  -0.011
  528    HD2  HIS  70           2HD      HIS  70  -3.574  -9.314   1.912
  529    HE1  HIS  70           1HE      HIS  70  -3.288 -13.504   2.474
  530    H    VAL  71           H        VAL  71  -1.893  -8.265   1.360
  531    HA   VAL  71           HA       VAL  71   0.790  -7.608   0.268
  532    HB   VAL  71           HB       VAL  71  -1.051  -6.040   1.977
  533   1HG1  VAL  71          1HG1      VAL  71   1.829  -6.254   2.916
  534   2HG1  VAL  71          2HG1      VAL  71   0.604  -5.084   3.452
  535   3HG1  VAL  71          3HG1      VAL  71   0.390  -6.794   3.819
  536   1HG2  VAL  71          1HG2      VAL  71   1.565  -5.208   0.673
  537   2HG2  VAL  71          2HG2      VAL  71   0.046  -5.340  -0.215
  538   3HG2  VAL  71          3HG2      VAL  71   0.194  -4.187   1.128
  539    H    VAL  72           H        VAL  72   2.501  -8.237   1.696
  540    HA   VAL  72           HA       VAL  72   1.809 -10.394   3.627
  541    HB   VAL  72           HB       VAL  72   3.988 -10.495   1.600
  542   1HG1  VAL  72          1HG1      VAL  72   4.686 -11.621   3.660
  543   2HG1  VAL  72          2HG1      VAL  72   3.142 -12.502   3.725
  544   3HG1  VAL  72          3HG1      VAL  72   4.310 -12.826   2.430
  545   1HG2  VAL  72          1HG2      VAL  72   2.711 -12.454   0.698
  546   2HG2  VAL  72          2HG2      VAL  72   1.392 -12.076   1.824
  547   3HG2  VAL  72          3HG2      VAL  72   1.820 -10.936   0.532
  548    H    ILE  73           H        ILE  73   3.180 -10.524   5.357
  549    HA   ILE  73           HA       ILE  73   4.805  -8.067   5.921
  550    HB   ILE  73           HB       ILE  73   3.146  -9.654   7.877
  551   1HG1  ILE  73          2HG1      ILE  73   1.621  -8.504   6.381
  552   2HG1  ILE  73          3HG1      ILE  73   1.690  -7.756   7.967
  553   1HG2  ILE  73          1HG2      ILE  73   5.042  -8.608   8.985
  554   2HG2  ILE  73          2HG2      ILE  73   4.793  -7.091   8.118
  555   3HG2  ILE  73          3HG2      ILE  73   3.613  -7.638   9.328
  556   1HD1  ILE  73          1HD1      ILE  73   1.549  -6.046   6.260
  557   2HD1  ILE  73          2HD1      ILE  73   3.111  -5.922   7.081
  558   3HD1  ILE  73          3HD1      ILE  73   3.003  -6.658   5.466
  559    H    GLU  74           H        GLU  74   6.644  -9.428   4.969
  560    HA   GLU  74           HA       GLU  74   7.564 -11.560   6.497
  561   1HB   GLU  74          2HB       GLU  74   8.822  -9.760   4.413
  562   2HB   GLU  74          3HB       GLU  74   9.702 -11.056   5.198
  563   1HG   GLU  74          2HG       GLU  74   7.920 -12.682   4.461
  564   2HG   GLU  74          3HG       GLU  74   7.226 -11.388   3.466
  565    H    GLY  75           H        GLY  75   7.374  -8.485   7.377
  566   1HA   GLY  75          2HA       GLY  75   8.280  -7.164   9.081
  567   2HA   GLY  75          3HA       GLY  75   8.920  -8.668   9.764
  568    H    ARG  76           H        ARG  76   9.579  -6.043   7.383
  569    HA   ARG  76           HA       ARG  76  12.431  -6.737   7.289
  570   1HB   ARG  76          2HB       ARG  76  10.876  -7.889   5.534
  571   2HB   ARG  76          3HB       ARG  76  10.669  -6.286   4.838
  572   1HG   ARG  76          2HG       ARG  76  13.298  -7.820   5.162
  573   2HG   ARG  76          3HG       ARG  76  12.304  -7.749   3.704
  574   1HD   ARG  76          2HD       ARG  76  13.811  -6.090   3.141
  575   2HD   ARG  76          3HD       ARG  76  12.571  -5.138   3.937
  576    HE   ARG  76           HE       ARG  76  13.898  -4.746   5.759
  577   1HH1  ARG  76          2HH2      ARG  76  15.330  -7.349   3.920
  578   2HH1  ARG  76          1HH2      ARG  76  16.918  -7.247   4.622
  579   1HH2  ARG  76          2HH1      ARG  76  15.965  -4.488   6.699
  580   2HH2  ARG  76          1HH1      ARG  76  17.293  -5.540   6.287
  Start of MODEL   29
    1   1H    MET   1          H1        MET   1   4.277  16.143  15.448
    2   2H    MET   1          H2        MET   1   5.076  16.112  16.886
    3   3H    MET   1          H3        MET   1   3.833  15.148  16.612
    4    HA   MET   1           HA       MET   1   3.052  17.020  17.981
    5   1HB   MET   1          2HB       MET   1   4.694  18.557  15.971
    6   2HB   MET   1          3HB       MET   1   3.252  19.344  16.621
    7   1HG   MET   1          2HG       MET   1   4.010  19.075  18.893
    8   2HG   MET   1          3HG       MET   1   5.519  18.323  18.337
    9   1HE   MET   1          1HE       MET   1   6.662  20.273  19.935
   10   2HE   MET   1          2HE       MET   1   6.427  22.010  19.625
   11   3HE   MET   1          3HE       MET   1   5.075  21.031  20.236
   12    H    LEU   2           H        LEU   2   2.756  18.393  14.729
   13    HA   LEU   2           HA       LEU   2  -0.040  17.599  14.367
   14   1HB   LEU   2          2HB       LEU   2   2.027  19.200  12.940
   15   2HB   LEU   2          3HB       LEU   2   1.169  18.117  11.859
   16    HG   LEU   2           HG       LEU   2  -1.007  19.013  12.659
   17   1HD1  LEU   2          1HD1      LEU   2  -1.013  21.159  13.912
   18   2HD1  LEU   2          2HD1      LEU   2  -0.327  19.858  14.896
   19   3HD1  LEU   2          3HD1      LEU   2   0.747  21.044  14.127
   20   1HD2  LEU   2          1HD2      LEU   2  -0.810  21.141  11.435
   21   2HD2  LEU   2          2HD2      LEU   2   0.960  21.082  11.585
   22   3HD2  LEU   2          3HD2      LEU   2   0.105  19.861  10.618
   23    H    SER   3           H        SER   3  -0.450  16.210  12.249
   24    HA   SER   3           HA       SER   3   0.128  13.644  12.421
   25   1HB   SER   3          2HB       SER   3   0.090  15.212   9.797
   26   2HB   SER   3          3HB       SER   3  -0.396  13.534  10.031
   27    HG   SER   3           HG       SER   3  -2.102  14.223  11.286
   28    H    GLU   4           H        GLU   4   2.068  12.698  12.796
   29    HA   GLU   4           HA       GLU   4   4.520  13.588  11.435
   30   1HB   GLU   4          2HB       GLU   4   3.832  11.556  13.500
   31   2HB   GLU   4          3HB       GLU   4   5.403  11.646  12.768
   32   1HG   GLU   4          2HG       GLU   4   5.817  13.782  13.565
   33   2HG   GLU   4          3HG       GLU   4   4.128  14.045  13.981
   34    H    GLN   5           H        GLN   5   5.614  11.864  10.114
   35    HA   GLN   5           HA       GLN   5   3.682  10.066   8.729
   36   1HB   GLN   5          2HB       GLN   5   5.673  12.009   7.554
   37   2HB   GLN   5          3HB       GLN   5   4.966  10.696   6.621
   38   1HG   GLN   5          2HG       GLN   5   3.146  12.662   8.101
   39   2HG   GLN   5          3HG       GLN   5   3.858  13.065   6.552
   40   1HE2  GLN   5          1HE2      GLN   5   3.598  11.348   4.832
   41   2HE2  GLN   5          2HE2      GLN   5   2.147  10.356   4.764
   42    H    LYS   6           H        LYS   6   4.586   8.146   7.960
   43    HA   LYS   6           HA       LYS   6   7.455   7.717   8.242
   44   1HB   LYS   6          2HB       LYS   6   6.566   7.096  10.401
   45   2HB   LYS   6          3HB       LYS   6   5.348   6.024   9.658
   46   1HG   LYS   6          2HG       LYS   6   7.113   4.606   8.800
   47   2HG   LYS   6          3HG       LYS   6   8.360   5.758   9.353
   48   1HD   LYS   6          2HD       LYS   6   7.579   5.354  11.716
   49   2HD   LYS   6          3HD       LYS   6   6.444   4.144  11.093
   50   1HE   LYS   6          2HE       LYS   6   8.617   3.073   9.981
   51   2HE   LYS   6          3HE       LYS   6   9.495   4.125  11.092
   52   1HZ   LYS   6          1HZ       LYS   6   9.269   2.138  12.205
   53   2HZ   LYS   6          2HZ       LYS   6   8.043   3.025  12.852
   54   3HZ   LYS   6          3HZ       LYS   6   7.722   1.879  11.712
   55    H    GLU   7           H        GLU   7   8.128   5.906   7.201
   56    HA   GLU   7           HA       GLU   7   6.647   5.200   4.745
   57   1HB   GLU   7          2HB       GLU   7   9.609   4.929   4.815
   58   2HB   GLU   7          3HB       GLU   7   8.522   5.525   3.585
   59   1HG   GLU   7          2HG       GLU   7   9.825   7.364   4.150
   60   2HG   GLU   7          3HG       GLU   7   8.382   7.687   5.110
   61    H    ILE   8           H        ILE   8   5.721   3.258   5.502
   62    HA   ILE   8           HA       ILE   8   7.434   1.322   6.910
   63    HB   ILE   8           HB       ILE   8   4.601   1.186   6.039
   64   1HG1  ILE   8          2HG1      ILE   8   4.753   3.054   7.617
   65   2HG1  ILE   8          3HG1      ILE   8   3.834   1.673   8.232
   66   1HG2  ILE   8          1HG2      ILE   8   6.338  -0.446   7.802
   67   2HG2  ILE   8          2HG2      ILE   8   4.546  -0.560   7.864
   68   3HG2  ILE   8          3HG2      ILE   8   5.410  -0.947   6.360
   69   1HD1  ILE   8          1HD1      ILE   8   5.674   0.867   9.493
   70   2HD1  ILE   8          2HD1      ILE   8   6.723   2.152   8.838
   71   3HD1  ILE   8          3HD1      ILE   8   5.347   2.563   9.913
   72    H    ALA   9           H        ALA   9   7.450  -0.898   5.909
   73    HA   ALA   9           HA       ALA   9   7.475  -0.924   2.955
   74   1HB   ALA   9          1HB       ALA   9   9.626  -2.097   2.968
   75   2HB   ALA   9          2HB       ALA   9   9.824  -0.504   3.730
   76   3HB   ALA   9          3HB       ALA   9   9.726  -1.959   4.736
   77    H    MET  10           H        MET  10   6.584  -2.894   2.224
   78    HA   MET  10           HA       MET  10   6.707  -5.270   3.889
   79   1HB   MET  10          2HB       MET  10   4.265  -5.622   4.005
   80   2HB   MET  10          3HB       MET  10   4.821  -4.300   5.013
   81   1HG   MET  10          2HG       MET  10   3.691  -3.880   2.248
   82   2HG   MET  10          3HG       MET  10   2.662  -3.996   3.668
   83   1HE   MET  10          1HE       MET  10   1.979  -2.191   5.190
   84   2HE   MET  10          2HE       MET  10   3.562  -2.458   5.959
   85   3HE   MET  10          3HE       MET  10   3.005  -0.802   5.600
   86    H    GLN  11           H        GLN  11   5.287  -7.075   2.674
   87    HA   GLN  11           HA       GLN  11   6.455  -7.081  -0.071
   88   1HB   GLN  11          2HB       GLN  11   6.031  -9.050   2.124
   89   2HB   GLN  11          3HB       GLN  11   5.529  -9.641   0.548
   90   1HG   GLN  11          2HG       GLN  11   8.222  -8.338   0.564
   91   2HG   GLN  11          3HG       GLN  11   8.057  -9.808   1.517
   92   1HE2  GLN  11          1HE2      GLN  11   8.176  -8.573  -1.791
   93   2HE2  GLN  11          2HE2      GLN  11   7.997 -10.148  -2.540
   94    H    VAL  12           H        VAL  12   5.120  -8.343  -1.727
   95    HA   VAL  12           HA       VAL  12   2.239  -7.557  -1.503
   96    HB   VAL  12           HB       VAL  12   4.063  -7.221  -3.917
   97   1HG1  VAL  12          1HG1      VAL  12   1.724  -7.571  -4.568
   98   2HG1  VAL  12          2HG1      VAL  12   1.180  -6.370  -3.373
   99   3HG1  VAL  12          3HG1      VAL  12   2.139  -5.869  -4.780
  100   1HG2  VAL  12          1HG2      VAL  12   2.996  -5.166  -1.937
  101   2HG2  VAL  12          2HG2      VAL  12   4.707  -5.561  -2.229
  102   3HG2  VAL  12          3HG2      VAL  12   3.761  -4.768  -3.487
  103    H    SER  13           H        SER  13   0.754  -8.941  -2.519
  104    HA   SER  13           HA       SER  13   1.811 -11.314  -3.988
  105   1HB   SER  13          2HB       SER  13  -0.333 -11.219  -1.825
  106   2HB   SER  13          3HB       SER  13  -0.094 -12.599  -2.915
  107    HG   SER  13           HG       SER  13   2.194 -11.650  -1.680
  108    H    GLY  14           H        GLY  14  -0.095 -12.284  -5.306
  109   1HA   GLY  14          2HA       GLY  14  -1.874 -12.025  -6.750
  110   2HA   GLY  14          3HA       GLY  14  -2.216 -10.426  -6.083
  111    H    MET  15           H        MET  15   0.397  -9.289  -6.514
  112    HA   MET  15           HA       MET  15   0.227  -8.098  -8.886
  113   1HB   MET  15          2HB       MET  15   2.615  -7.532  -8.754
  114   2HB   MET  15          3HB       MET  15   1.764  -7.378  -7.233
  115   1HG   MET  15          2HG       MET  15   3.753  -8.363  -6.573
  116   2HG   MET  15          3HG       MET  15   2.692  -9.764  -6.672
  117   1HE   MET  15          1HE       MET  15   6.200 -11.209  -7.622
  118   2HE   MET  15          2HE       MET  15   5.836  -9.961  -6.412
  119   3HE   MET  15          3HE       MET  15   4.775 -11.382  -6.574
  120    H    THR  16           H        THR  16   0.868  -8.168 -10.900
  121    HA   THR  16           HA       THR  16   2.420 -10.351 -12.109
  122    HB   THR  16           HB       THR  16   0.416 -10.434 -13.863
  123    HG1  THR  16           1HG      THR  16  -1.011 -10.017 -11.451
  124   1HG2  THR  16          1HG2      THR  16   0.170 -11.984 -11.249
  125   2HG2  THR  16          2HG2      THR  16  -0.525 -12.408 -12.821
  126   3HG2  THR  16          3HG2      THR  16   1.234 -12.408 -12.607
  127    H    CYS  17           H        CYS  17   0.070  -7.824 -12.986
  128    HA   CYS  17           HA       CYS  17   1.418  -6.820 -15.209
  129   1HB   CYS  17          2HB       CYS  17  -0.352  -5.187 -13.351
  130   2HB   CYS  17          3HB       CYS  17  -0.082  -4.918 -15.079
  131    H    ALA  18           H        ALA  18   2.071  -6.145 -11.858
  132    HA   ALA  18           HA       ALA  18   3.439  -4.797 -10.717
  133   1HB   ALA  18          1HB       ALA  18   5.382  -3.760 -11.676
  134   2HB   ALA  18          2HB       ALA  18   5.208  -5.396 -12.334
  135   3HB   ALA  18          3HB       ALA  18   4.786  -3.984 -13.325
  136    H    ALA  19           H        ALA  19   2.621  -3.041 -13.742
  137    HA   ALA  19           HA       ALA  19   2.373  -0.456 -12.742
  138   1HB   ALA  19          1HB       ALA  19   0.655  -1.805 -14.870
  139   2HB   ALA  19          2HB       ALA  19   0.860  -0.054 -14.649
  140   3HB   ALA  19          3HB       ALA  19   2.243  -1.055 -15.126
  141    H    CYS  20           H        CYS  20  -0.201  -2.972 -12.806
  142    HA   CYS  20           HA       CYS  20  -2.219  -1.448 -11.625
  143   1HB   CYS  20          2HB       CYS  20  -1.664  -4.437 -11.561
  144   2HB   CYS  20          3HB       CYS  20  -3.166  -3.715 -10.961
  145    H    ALA  21           H        ALA  21   0.570  -2.918 -10.045
  146    HA   ALA  21           HA       ALA  21  -0.512  -2.723  -7.383
  147   1HB   ALA  21          1HB       ALA  21   1.452  -4.175  -8.206
  148   2HB   ALA  21          2HB       ALA  21   2.430  -2.698  -8.073
  149   3HB   ALA  21          3HB       ALA  21   1.589  -3.366  -6.649
  150    H    ALA  22           H        ALA  22   0.628  -0.320  -9.698
  151    HA   ALA  22           HA       ALA  22   1.261   1.671  -7.645
  152   1HB   ALA  22          1HB       ALA  22   1.244   3.261  -9.431
  153   2HB   ALA  22          2HB       ALA  22   2.118   1.822  -9.997
  154   3HB   ALA  22          3HB       ALA  22   0.452   2.133 -10.541
  155    H    ARG  23           H        ARG  23  -1.539   0.659  -9.638
  156    HA   ARG  23           HA       ARG  23  -3.269   2.809  -8.927
  157   1HB   ARG  23          2HB       ARG  23  -3.900  -0.017  -9.847
  158   2HB   ARG  23          3HB       ARG  23  -5.111   1.250  -9.643
  159   1HG   ARG  23          2HG       ARG  23  -4.174   2.623 -11.361
  160   2HG   ARG  23          3HG       ARG  23  -2.652   1.733 -11.350
  161   1HD   ARG  23          2HD       ARG  23  -3.689   1.052 -13.313
  162   2HD   ARG  23          3HD       ARG  23  -3.874  -0.302 -12.181
  163    HE   ARG  23           HE       ARG  23  -6.190   1.347 -12.052
  164   1HH1  ARG  23          2HH2      ARG  23  -4.565  -1.113 -14.014
  165   2HH1  ARG  23          1HH2      ARG  23  -5.918  -1.437 -15.039
  166   1HH2  ARG  23          2HH1      ARG  23  -8.068   0.867 -13.362
  167   2HH2  ARG  23          1HH1      ARG  23  -7.977  -0.332 -14.610
  168    H    ILE  24           H        ILE  24  -2.691  -0.401  -7.368
  169    HA   ILE  24           HA       ILE  24  -4.657   0.051  -5.397
  170    HB   ILE  24           HB       ILE  24  -3.898  -1.617  -4.072
  171   1HG1  ILE  24          2HG1      ILE  24  -1.266  -1.258  -5.359
  172   2HG1  ILE  24          3HG1      ILE  24  -1.689  -1.162  -3.640
  173   1HG2  ILE  24          1HG2      ILE  24  -3.958  -3.403  -5.556
  174   2HG2  ILE  24          2HG2      ILE  24  -4.760  -2.118  -6.452
  175   3HG2  ILE  24          3HG2      ILE  24  -3.079  -2.544  -6.843
  176   1HD1  ILE  24          1HD1      ILE  24  -1.454  -3.641  -5.371
  177   2HD1  ILE  24          2HD1      ILE  24  -0.397  -3.169  -4.041
  178   3HD1  ILE  24          3HD1      ILE  24  -2.073  -3.650  -3.694
  179    H    GLU  25           H        GLU  25  -1.122   0.701  -5.001
  180    HA   GLU  25           HA       GLU  25  -1.213   2.159  -2.668
  181   1HB   GLU  25          2HB       GLU  25   0.523   2.195  -5.115
  182   2HB   GLU  25          3HB       GLU  25   0.699   3.550  -3.995
  183   1HG   GLU  25          2HG       GLU  25   2.246   1.590  -3.573
  184   2HG   GLU  25          3HG       GLU  25   1.310   2.122  -2.182
  185    H    LYS  26           H        LYS  26  -2.109   3.470  -5.879
  186    HA   LYS  26           HA       LYS  26  -2.409   6.167  -4.750
  187   1HB   LYS  26          2HB       LYS  26  -3.576   5.136  -7.345
  188   2HB   LYS  26          3HB       LYS  26  -3.365   6.818  -6.854
  189   1HG   LYS  26          2HG       LYS  26  -1.204   4.811  -7.523
  190   2HG   LYS  26          3HG       LYS  26  -1.686   6.203  -8.474
  191   1HD   LYS  26          2HD       LYS  26  -0.649   7.725  -6.904
  192   2HD   LYS  26          3HD       LYS  26  -0.499   6.472  -5.667
  193   1HE   LYS  26          2HE       LYS  26   1.670   6.909  -6.659
  194   2HE   LYS  26          3HE       LYS  26   1.145   5.237  -6.868
  195   1HZ   LYS  26          1HZ       LYS  26   2.118   6.129  -8.859
  196   2HZ   LYS  26          2HZ       LYS  26   0.542   5.754  -9.126
  197   3HZ   LYS  26          3HZ       LYS  26   0.998   7.328  -8.943
  198    H    GLY  27           H        GLY  27  -4.769   3.574  -5.580
  199   1HA   GLY  27          2HA       GLY  27  -7.077   5.038  -4.662
  200   2HA   GLY  27          3HA       GLY  27  -6.933   3.285  -4.841
  201    H    LEU  28           H        LEU  28  -4.584   3.147  -3.082
  202    HA   LEU  28           HA       LEU  28  -5.816   2.783  -0.493
  203   1HB   LEU  28          2HB       LEU  28  -4.096   1.397  -1.425
  204   2HB   LEU  28          3HB       LEU  28  -2.931   2.720  -1.389
  205    HG   LEU  28           HG       LEU  28  -4.316   1.791   1.131
  206   1HD1  LEU  28          1HD1      LEU  28  -3.464  -0.192   0.039
  207   2HD1  LEU  28          2HD1      LEU  28  -1.873   0.567  -0.186
  208   3HD1  LEU  28          3HD1      LEU  28  -2.461   0.180   1.443
  209   1HD2  LEU  28          1HD2      LEU  28  -2.192   2.632   2.144
  210   2HD2  LEU  28          2HD2      LEU  28  -1.588   3.046   0.530
  211   3HD2  LEU  28          3HD2      LEU  28  -2.990   3.890   1.220
  212    H    LYS  29           H        LYS  29  -3.327   5.086  -1.745
  213    HA   LYS  29           HA       LYS  29  -3.103   6.718   0.456
  214   1HB   LYS  29          2HB       LYS  29  -1.726   6.904  -1.572
  215   2HB   LYS  29          3HB       LYS  29  -3.104   7.570  -2.451
  216   1HG   LYS  29          2HG       LYS  29  -2.849   9.238  -0.137
  217   2HG   LYS  29          3HG       LYS  29  -1.228   8.857  -0.575
  218   1HD   LYS  29          2HD       LYS  29  -3.207   9.789  -2.708
  219   2HD   LYS  29          3HD       LYS  29  -2.477  10.949  -1.580
  220   1HE   LYS  29          2HE       LYS  29  -0.306  10.484  -2.205
  221   2HE   LYS  29          3HE       LYS  29  -0.695   9.014  -3.132
  222   1HZ   LYS  29          1HZ       LYS  29  -0.045  10.924  -4.340
  223   2HZ   LYS  29          2HZ       LYS  29  -1.613  10.542  -4.759
  224   3HZ   LYS  29          3HZ       LYS  29  -1.288  11.831  -3.765
  225    H    ARG  30           H        ARG  30  -5.796   6.691  -1.848
  226    HA   ARG  30           HA       ARG  30  -6.958   9.123  -1.087
  227   1HB   ARG  30          2HB       ARG  30  -7.729   6.787  -2.623
  228   2HB   ARG  30          3HB       ARG  30  -9.103   7.295  -1.658
  229   1HG   ARG  30          2HG       ARG  30  -7.447   9.122  -3.460
  230   2HG   ARG  30          3HG       ARG  30  -8.937   8.299  -3.950
  231   1HD   ARG  30          2HD       ARG  30 -10.191   9.453  -2.151
  232   2HD   ARG  30          3HD       ARG  30  -8.722  10.338  -1.687
  233    HE   ARG  30           HE       ARG  30  -9.181  10.709  -4.469
  234   1HH1  ARG  30          2HH2      ARG  30 -10.528  11.631  -1.353
  235   2HH1  ARG  30          1HH2      ARG  30 -11.237  13.120  -1.898
  236   1HH2  ARG  30          2HH1      ARG  30 -10.107  12.684  -5.258
  237   2HH2  ARG  30          1HH1      ARG  30 -10.981  13.729  -4.189
  238    H    MET  31           H        MET  31  -6.626   6.390   1.001
  239    HA   MET  31           HA       MET  31  -8.962   6.824   2.605
  240   1HB   MET  31          2HB       MET  31  -7.937   5.284   4.147
  241   2HB   MET  31          3HB       MET  31  -7.502   4.791   2.512
  242   1HG   MET  31          2HG       MET  31  -5.271   5.798   2.795
  243   2HG   MET  31          3HG       MET  31  -5.686   6.319   4.412
  244   1HE   MET  31          1HE       MET  31  -5.457   1.879   3.338
  245   2HE   MET  31          2HE       MET  31  -7.012   2.721   3.424
  246   3HE   MET  31          3HE       MET  31  -5.787   3.180   2.193
  247    HA   PRO  32           HA       PRO  32  -7.491  10.228   5.249
  248   1HB   PRO  32          2HB       PRO  32  -8.404   9.473   7.727
  249   2HB   PRO  32          3HB       PRO  32  -9.476  10.124   6.451
  250   1HG   PRO  32          2HG       PRO  32  -8.956   7.209   7.106
  251   2HG   PRO  32          3HG       PRO  32 -10.542   8.016   6.923
  252   1HD   PRO  32          2HD       PRO  32  -9.460   6.642   4.889
  253   2HD   PRO  32          3HD       PRO  32 -10.252   8.201   4.554
  254    H    GLY  33           H        GLY  33  -5.527  10.502   6.317
  255   1HA   GLY  33          2HA       GLY  33  -3.896  10.009   7.838
  256   2HA   GLY  33          3HA       GLY  33  -4.379   8.320   7.893
  257    H    VAL  34           H        VAL  34  -4.150   8.150   4.776
  258    HA   VAL  34           HA       VAL  34  -1.174   7.984   4.675
  259    HB   VAL  34           HB       VAL  34  -3.259   7.103   2.684
  260   1HG1  VAL  34          1HG1      VAL  34  -1.113   7.591   1.569
  261   2HG1  VAL  34          2HG1      VAL  34  -0.225   6.701   2.815
  262   3HG1  VAL  34          3HG1      VAL  34  -1.296   5.838   1.701
  263   1HG2  VAL  34          1HG2      VAL  34  -2.767   4.846   3.399
  264   2HG2  VAL  34          2HG2      VAL  34  -1.543   5.377   4.535
  265   3HG2  VAL  34          3HG2      VAL  34  -3.227   5.780   4.844
  266    H    THR  35           H        THR  35   0.093   9.376   3.489
  267    HA   THR  35           HA       THR  35  -1.377  11.584   2.107
  268    HB   THR  35           HB       THR  35   0.455  11.781   4.201
  269    HG1  THR  35           1HG      THR  35  -0.530  13.681   2.361
  270   1HG2  THR  35          1HG2      THR  35   1.690  12.917   1.647
  271   2HG2  THR  35          2HG2      THR  35   2.228  13.191   3.313
  272   3HG2  THR  35          3HG2      THR  35   2.365  11.573   2.603
  273    H    ASP  36           H        ASP  36   1.400   9.278   1.776
  274    HA   ASP  36           HA       ASP  36   0.829   9.268  -1.043
  275   1HB   ASP  36          2HB       ASP  36   3.232  10.681  -0.105
  276   2HB   ASP  36          3HB       ASP  36   3.611   9.342  -1.183
  277    H    ALA  37           H        ALA  37   2.103   7.627  -2.180
  278    HA   ALA  37           HA       ALA  37   3.017   5.431  -0.595
  279   1HB   ALA  37          1HB       ALA  37   0.447   5.315  -0.331
  280   2HB   ALA  37          2HB       ALA  37   0.392   4.927  -2.055
  281   3HB   ALA  37          3HB       ALA  37   1.243   3.854  -0.912
  282    H    ASN  38           H        ASN  38   3.942   3.690  -1.881
  283    HA   ASN  38           HA       ASN  38   4.372   4.304  -4.737
  284   1HB   ASN  38          2HB       ASN  38   6.997   4.253  -3.692
  285   2HB   ASN  38          3HB       ASN  38   6.147   5.608  -4.411
  286   1HD2  ASN  38          1HD2      ASN  38   5.892   4.013  -1.167
  287   2HD2  ASN  38          2HD2      ASN  38   6.224   5.503  -0.284
  288    H    VAL  39           H        VAL  39   4.449   2.331  -5.639
  289    HA   VAL  39           HA       VAL  39   5.064   0.023  -3.974
  290    HB   VAL  39           HB       VAL  39   3.052   0.211  -5.339
  291   1HG1  VAL  39          1HG1      VAL  39   4.020   1.255  -7.410
  292   2HG1  VAL  39          2HG1      VAL  39   4.755  -0.314  -7.811
  293   3HG1  VAL  39          3HG1      VAL  39   3.022  -0.173  -7.698
  294   1HG2  VAL  39          1HG2      VAL  39   4.470  -2.188  -6.380
  295   2HG2  VAL  39          2HG2      VAL  39   4.345  -1.984  -4.617
  296   3HG2  VAL  39          3HG2      VAL  39   2.886  -2.006  -5.598
  297    H    ASN  40           H        ASN  40   7.236  -0.379  -3.690
  298    HA   ASN  40           HA       ASN  40   9.123   0.193  -5.894
  299   1HB   ASN  40          2HB       ASN  40   9.573   0.837  -3.513
  300   2HB   ASN  40          3HB       ASN  40   9.663  -0.885  -3.103
  301   1HD2  ASN  40          1HD2      ASN  40  11.881   0.353  -2.469
  302   2HD2  ASN  40          2HD2      ASN  40  13.145   0.151  -3.674
  303    H    LEU  41           H        LEU  41   7.505  -1.520  -6.892
  304    HA   LEU  41           HA       LEU  41   7.919  -4.269  -6.186
  305   1HB   LEU  41          2HB       LEU  41   6.137  -2.801  -7.820
  306   2HB   LEU  41          3HB       LEU  41   6.955  -3.866  -8.939
  307    HG   LEU  41           HG       LEU  41   4.783  -4.655  -7.939
  308   1HD1  LEU  41          1HD1      LEU  41   5.516  -6.998  -7.700
  309   2HD1  LEU  41          2HD1      LEU  41   6.317  -6.207  -9.068
  310   3HD1  LEU  41          3HD1      LEU  41   7.202  -6.474  -7.551
  311   1HD2  LEU  41          1HD2      LEU  41   6.259  -5.560  -5.463
  312   2HD2  LEU  41          2HD2      LEU  41   5.489  -3.970  -5.502
  313   3HD2  LEU  41          3HD2      LEU  41   4.528  -5.433  -5.783
  314    H    ALA  42           H        ALA  42   9.719  -2.065  -8.104
  315    HA   ALA  42           HA       ALA  42  11.359  -3.677  -9.679
  316   1HB   ALA  42          1HB       ALA  42  12.170  -1.362  -7.875
  317   2HB   ALA  42          2HB       ALA  42  13.103  -2.002  -9.239
  318   3HB   ALA  42          3HB       ALA  42  11.536  -1.216  -9.535
  319    H    THR  43           H        THR  43  11.334  -3.372  -6.084
  320    HA   THR  43           HA       THR  43  13.330  -5.604  -6.027
  321    HB   THR  43           HB       THR  43  14.277  -3.553  -5.154
  322    HG1  THR  43           1HG      THR  43  13.756  -5.661  -3.352
  323   1HG2  THR  43          1HG2      THR  43  12.307  -3.804  -2.834
  324   2HG2  THR  43          2HG2      THR  43  13.562  -2.576  -3.063
  325   3HG2  THR  43          3HG2      THR  43  12.146  -2.614  -4.132
  326    H    GLU  44           H        GLU  44  10.329  -5.625  -6.293
  327    HA   GLU  44           HA       GLU  44   8.519  -6.590  -5.446
  328   1HB   GLU  44          2HB       GLU  44  10.557  -8.410  -5.510
  329   2HB   GLU  44          3HB       GLU  44  10.014  -8.586  -3.847
  330   1HG   GLU  44          2HG       GLU  44   7.618  -8.754  -4.869
  331   2HG   GLU  44          3HG       GLU  44   8.429  -8.915  -6.443
  332    H    THR  45           H        THR  45   9.000  -4.331  -3.940
  333    HA   THR  45           HA       THR  45   7.761  -5.156  -1.390
  334    HB   THR  45           HB       THR  45   9.971  -3.059  -1.676
  335    HG1  THR  45           1HG      THR  45  10.150  -5.842  -1.415
  336   1HG2  THR  45          1HG2      THR  45   8.531  -2.986   0.321
  337   2HG2  THR  45          2HG2      THR  45   8.887  -4.719   0.607
  338   3HG2  THR  45          3HG2      THR  45  10.187  -3.502   0.739
  339    H    VAL  46           H        VAL  46   6.448  -3.440  -0.439
  340    HA   VAL  46           HA       VAL  46   5.859  -1.156  -2.279
  341    HB   VAL  46           HB       VAL  46   3.981  -2.669  -2.341
  342   1HG1  VAL  46          1HG1      VAL  46   3.842  -2.372   0.674
  343   2HG1  VAL  46          2HG1      VAL  46   2.643  -3.192  -0.341
  344   3HG1  VAL  46          3HG1      VAL  46   4.262  -3.876  -0.191
  345   1HG2  VAL  46          1HG2      VAL  46   3.461  -0.275  -2.359
  346   2HG2  VAL  46          2HG2      VAL  46   2.220  -1.228  -1.516
  347   3HG2  VAL  46          3HG2      VAL  46   3.353  -0.254  -0.583
  348    H    ASN  47           H        ASN  47   5.647   0.888  -1.302
  349    HA   ASN  47           HA       ASN  47   6.290   1.019   1.582
  350   1HB   ASN  47          2HB       ASN  47   7.480   2.583  -0.753
  351   2HB   ASN  47          3HB       ASN  47   7.470   3.225   0.893
  352   1HD2  ASN  47          1HD2      ASN  47   8.340   1.603   2.630
  353   2HD2  ASN  47          2HD2      ASN  47   9.913   0.966   2.174
  354    H    VAL  48           H        VAL  48   5.164   2.724   2.689
  355    HA   VAL  48           HA       VAL  48   3.175   4.209   1.122
  356    HB   VAL  48           HB       VAL  48   2.024   2.174   1.534
  357   1HG1  VAL  48          1HG1      VAL  48   2.841   2.441   4.440
  358   2HG1  VAL  48          2HG1      VAL  48   1.584   1.338   3.847
  359   3HG1  VAL  48          3HG1      VAL  48   3.259   1.146   3.313
  360   1HG2  VAL  48          1HG2      VAL  48   0.771   4.267   1.741
  361   2HG2  VAL  48          2HG2      VAL  48   0.107   2.986   2.758
  362   3HG2  VAL  48          3HG2      VAL  48   1.055   4.296   3.485
  363    H    ILE  49           H        ILE  49   2.926   6.197   1.915
  364    HA   ILE  49           HA       ILE  49   4.737   6.919   4.113
  365    HB   ILE  49           HB       ILE  49   3.778   8.704   1.848
  366   1HG1  ILE  49          2HG1      ILE  49   4.913   6.902   0.734
  367   2HG1  ILE  49          3HG1      ILE  49   5.884   8.365   0.711
  368   1HG2  ILE  49          1HG2      ILE  49   4.619   9.909   3.758
  369   2HG2  ILE  49          2HG2      ILE  49   6.078   8.918   3.830
  370   3HG2  ILE  49          3HG2      ILE  49   5.802  10.008   2.452
  371   1HD1  ILE  49          1HD1      ILE  49   7.273   7.461   2.598
  372   2HD1  ILE  49          2HD1      ILE  49   6.337   5.950   2.507
  373   3HD1  ILE  49          3HD1      ILE  49   7.332   6.472   1.139
  374    H    TYR  50           H        TYR  50   3.271   6.847   5.871
  375    HA   TYR  50           HA       TYR  50   0.801   8.528   5.702
  376   1HB   TYR  50          2HB       TYR  50  -0.591   6.752   6.439
  377   2HB   TYR  50          3HB       TYR  50   0.345   6.164   5.075
  378    HD1  TYR  50           HD1      TYR  50   2.095   4.407   5.454
  379    HD2  TYR  50           HD2      TYR  50  -0.340   5.878   8.672
  380    HE1  TYR  50           HE1      TYR  50   2.298   2.227   6.614
  381    HE2  TYR  50           HE2      TYR  50   0.149   3.835   9.966
  382    HH   TYR  50           HH       TYR  50   1.675   0.984   8.463
  383    H    ASP  51           H        ASP  51  -0.357   8.514   7.777
  384    HA   ASP  51           HA       ASP  51   1.580   9.284   9.858
  385   1HB   ASP  51          2HB       ASP  51  -0.139  10.890   9.220
  386   2HB   ASP  51          3HB       ASP  51  -1.416   9.749   9.672
  387    HA   PRO  52           HA       PRO  52   0.425   5.287  11.646
  388   1HB   PRO  52          2HB       PRO  52   2.483   4.811  13.286
  389   2HB   PRO  52          3HB       PRO  52   2.643   4.722  11.515
  390   1HG   PRO  52          2HG       PRO  52   3.299   7.109  13.305
  391   2HG   PRO  52          3HG       PRO  52   4.370   6.359  12.085
  392   1HD   PRO  52          2HD       PRO  52   2.836   8.559  11.543
  393   2HD   PRO  52          3HD       PRO  52   3.137   7.292  10.315
  394    H    ALA  53           H        ALA  53   0.156   8.451  12.960
  395    HA   ALA  53           HA       ALA  53  -0.701   7.506  15.613
  396   1HB   ALA  53          1HB       ALA  53  -1.073  10.179  14.213
  397   2HB   ALA  53          2HB       ALA  53  -1.304   9.815  15.929
  398   3HB   ALA  53          3HB       ALA  53   0.332   9.780  15.233
  399    H    GLU  54           H        GLU  54  -1.850   7.956  12.277
  400    HA   GLU  54           HA       GLU  54  -4.611   8.139  13.283
  401   1HB   GLU  54          2HB       GLU  54  -3.509  10.059  11.884
  402   2HB   GLU  54          3HB       GLU  54  -3.879   9.022  10.497
  403   1HG   GLU  54          2HG       GLU  54  -6.278   8.903  11.366
  404   2HG   GLU  54          3HG       GLU  54  -5.815  10.072  12.614
  405    H    THR  55           H        THR  55  -2.677   6.836  10.608
  406    HA   THR  55           HA       THR  55  -4.409   4.460  10.520
  407    HB   THR  55           HB       THR  55  -2.812   3.976   8.339
  408    HG1  THR  55           1HG      THR  55  -3.294   6.738   8.518
  409   1HG2  THR  55          1HG2      THR  55  -4.764   4.715   7.061
  410   2HG2  THR  55          2HG2      THR  55  -5.223   3.726   8.464
  411   3HG2  THR  55          3HG2      THR  55  -5.452   5.514   8.503
  412    H    GLY  56           H        GLY  56  -3.075   2.612   9.749
  413   1HA   GLY  56          2HA       GLY  56  -0.589   2.027  11.040
  414   2HA   GLY  56          3HA       GLY  56  -1.990   1.283  11.845
  415    H    THR  57           H        THR  57  -2.160  -0.741  11.044
  416    HA   THR  57           HA       THR  57  -1.396  -1.581   8.353
  417    HB   THR  57           HB       THR  57  -1.966  -3.801   9.511
  418    HG1  THR  57           1HG      THR  57  -2.261  -3.591  11.784
  419   1HG2  THR  57          1HG2      THR  57   0.371  -2.867   9.455
  420   2HG2  THR  57          2HG2      THR  57   0.058  -1.941  10.930
  421   3HG2  THR  57          3HG2      THR  57   0.057  -3.713  10.981
  422    H    ALA  58           H        ALA  58  -4.113  -1.043  10.485
  423    HA   ALA  58           HA       ALA  58  -6.062  -2.534   9.532
  424   1HB   ALA  58          1HB       ALA  58  -6.401   0.304  10.541
  425   2HB   ALA  58          2HB       ALA  58  -7.674  -0.935  10.487
  426   3HB   ALA  58          3HB       ALA  58  -6.258  -1.162  11.532
  427    H    ALA  59           H        ALA  59  -5.605   0.723   8.317
  428    HA   ALA  59           HA       ALA  59  -8.060   0.437   6.662
  429   1HB   ALA  59          1HB       ALA  59  -7.603   2.715   5.915
  430   2HB   ALA  59          2HB       ALA  59  -7.481   2.615   7.683
  431   3HB   ALA  59          3HB       ALA  59  -6.005   2.656   6.691
  432    H    ILE  60           H        ILE  60  -4.607   0.373   6.341
  433    HA   ILE  60           HA       ILE  60  -4.267   0.123   3.536
  434    HB   ILE  60           HB       ILE  60  -2.709  -0.327   6.061
  435   1HG1  ILE  60          2HG1      ILE  60  -1.992   0.907   3.448
  436   2HG1  ILE  60          3HG1      ILE  60  -3.115   1.768   4.482
  437   1HG2  ILE  60          1HG2      ILE  60  -1.826  -1.445   3.371
  438   2HG2  ILE  60          2HG2      ILE  60  -0.772  -1.142   4.774
  439   3HG2  ILE  60          3HG2      ILE  60  -2.054  -2.347   4.890
  440   1HD1  ILE  60          1HD1      ILE  60  -0.805   2.593   4.835
  441   2HD1  ILE  60          2HD1      ILE  60  -1.555   1.955   6.293
  442   3HD1  ILE  60          3HD1      ILE  60  -0.327   0.992   5.441
  443    H    GLN  61           H        GLN  61  -4.612  -2.545   5.979
  444    HA   GLN  61           HA       GLN  61  -4.551  -4.510   3.889
  445   1HB   GLN  61          2HB       GLN  61  -5.055  -4.520   6.768
  446   2HB   GLN  61          3HB       GLN  61  -6.198  -5.534   5.880
  447   1HG   GLN  61          2HG       GLN  61  -4.645  -7.095   6.254
  448   2HG   GLN  61          3HG       GLN  61  -4.091  -6.539   4.681
  449   1HE2  GLN  61          1HE2      GLN  61  -2.924  -3.990   5.842
  450   2HE2  GLN  61          2HE2      GLN  61  -1.478  -4.533   6.683
  451    H    GLU  62           H        GLU  62  -7.297  -2.811   5.515
  452    HA   GLU  62           HA       GLU  62  -9.452  -3.984   4.195
  453   1HB   GLU  62          2HB       GLU  62  -8.886  -1.267   5.371
  454   2HB   GLU  62          3HB       GLU  62 -10.304  -1.426   4.351
  455   1HG   GLU  62          2HG       GLU  62 -11.114  -3.301   5.773
  456   2HG   GLU  62          3HG       GLU  62  -9.708  -3.073   6.834
  457    H    LYS  63           H        LYS  63  -7.708  -1.020   3.039
  458    HA   LYS  63           HA       LYS  63  -9.140  -0.934   0.589
  459   1HB   LYS  63          2HB       LYS  63  -6.659   0.329   1.754
  460   2HB   LYS  63          3HB       LYS  63  -7.030   0.520   0.073
  461   1HG   LYS  63          2HG       LYS  63  -8.877   1.331   2.360
  462   2HG   LYS  63          3HG       LYS  63  -7.821   2.386   1.414
  463   1HD   LYS  63          2HD       LYS  63  -9.589   2.900   0.283
  464   2HD   LYS  63          3HD       LYS  63  -9.171   1.477  -0.670
  465   1HE   LYS  63          2HE       LYS  63 -10.948   0.179   0.397
  466   2HE   LYS  63          3HE       LYS  63 -11.102   1.347   1.714
  467   1HZ   LYS  63          1HZ       LYS  63 -12.863   1.511   0.117
  468   2HZ   LYS  63          2HZ       LYS  63 -12.002   2.907   0.173
  469   3HZ   LYS  63          3HZ       LYS  63 -11.804   1.871  -1.092
  470    H    ILE  64           H        ILE  64  -6.042  -2.513   1.526
  471    HA   ILE  64           HA       ILE  64  -5.007  -3.090  -0.944
  472    HB   ILE  64           HB       ILE  64  -4.885  -4.149   1.784
  473   1HG1  ILE  64          2HG1      ILE  64  -3.398  -2.400   0.758
  474   2HG1  ILE  64          3HG1      ILE  64  -2.613  -3.744   1.579
  475   1HG2  ILE  64          1HG2      ILE  64  -3.459  -6.047   1.212
  476   2HG2  ILE  64          2HG2      ILE  64  -5.191  -6.265   0.976
  477   3HG2  ILE  64          3HG2      ILE  64  -4.141  -5.977  -0.438
  478   1HD1  ILE  64          1HD1      ILE  64  -2.936  -3.477  -1.434
  479   2HD1  ILE  64          2HD1      ILE  64  -1.448  -3.264  -0.482
  480   3HD1  ILE  64          3HD1      ILE  64  -2.216  -4.860  -0.598
  481    H    GLU  65           H        GLU  65  -7.269  -5.012   1.118
  482    HA   GLU  65           HA       GLU  65  -7.959  -7.038  -0.741
  483   1HB   GLU  65          2HB       GLU  65  -9.333  -5.838   1.693
  484   2HB   GLU  65          3HB       GLU  65 -10.087  -7.132   0.760
  485   1HG   GLU  65          2HG       GLU  65  -7.257  -7.429   1.780
  486   2HG   GLU  65          3HG       GLU  65  -8.647  -7.773   2.809
  487    H    LYS  66           H        LYS  66  -9.769  -4.025   0.077
  488    HA   LYS  66           HA       LYS  66 -11.829  -4.526  -1.745
  489   1HB   LYS  66          2HB       LYS  66 -11.005  -2.308  -0.061
  490   2HB   LYS  66          3HB       LYS  66 -11.545  -1.666  -1.608
  491   1HG   LYS  66          2HG       LYS  66 -13.124  -3.663   0.067
  492   2HG   LYS  66          3HG       LYS  66 -13.330  -1.910   0.161
  493   1HD   LYS  66          2HD       LYS  66 -13.916  -1.820  -2.254
  494   2HD   LYS  66          3HD       LYS  66 -13.739  -3.577  -2.374
  495   1HE   LYS  66          2HE       LYS  66 -15.526  -3.865  -0.640
  496   2HE   LYS  66          3HE       LYS  66 -15.745  -2.108  -0.593
  497   1HZ   LYS  66          1HZ       LYS  66 -17.349  -3.167  -2.008
  498   2HZ   LYS  66          2HZ       LYS  66 -16.380  -2.204  -2.920
  499   3HZ   LYS  66          3HZ       LYS  66 -16.177  -3.838  -2.944
  500    H    LEU  67           H        LEU  67  -8.730  -2.988  -2.391
  501    HA   LEU  67           HA       LEU  67  -9.343  -2.194  -5.113
  502   1HB   LEU  67          2HB       LEU  67  -6.812  -2.433  -3.459
  503   2HB   LEU  67          3HB       LEU  67  -6.763  -1.990  -5.165
  504    HG   LEU  67           HG       LEU  67  -8.653  -0.472  -3.355
  505   1HD1  LEU  67          1HD1      LEU  67  -5.655  -0.049  -3.489
  506   2HD1  LEU  67          2HD1      LEU  67  -6.808   1.195  -2.969
  507   3HD1  LEU  67          3HD1      LEU  67  -6.638  -0.309  -2.064
  508   1HD2  LEU  67          1HD2      LEU  67  -8.659  -0.143  -5.850
  509   2HD2  LEU  67          2HD2      LEU  67  -8.230   1.318  -4.955
  510   3HD2  LEU  67          3HD2      LEU  67  -6.966   0.367  -5.758
  511    H    GLY  68           H        GLY  68  -8.627  -5.233  -3.641
  512   1HA   GLY  68          2HA       GLY  68  -8.926  -7.246  -4.726
  513   2HA   GLY  68          3HA       GLY  68  -8.595  -6.510  -6.298
  514    H    TYR  69           H        TYR  69  -6.624  -6.306  -3.264
  515    HA   TYR  69           HA       TYR  69  -4.470  -7.924  -4.544
  516   1HB   TYR  69          2HB       TYR  69  -4.532  -5.051  -3.958
  517   2HB   TYR  69          3HB       TYR  69  -3.257  -5.849  -3.067
  518    HD1  TYR  69           HD1      TYR  69  -4.721  -5.576  -6.508
  519    HD2  TYR  69           HD2      TYR  69  -1.254  -6.542  -4.139
  520    HE1  TYR  69           HE1      TYR  69  -3.341  -5.470  -8.512
  521    HE2  TYR  69           HE2      TYR  69   0.151  -6.352  -6.131
  522    HH   TYR  69           HH       TYR  69  -1.182  -5.433  -9.337
  523    H    HIS  70           H        HIS  70  -2.684  -8.228  -2.799
  524    HA   HIS  70           HA       HIS  70  -3.702  -8.313  -0.059
  525   1HB   HIS  70          2HB       HIS  70  -4.341 -10.492  -1.025
  526   2HB   HIS  70          3HB       HIS  70  -2.663 -10.788  -1.484
  527    HD1  HIS  70           1HD      HIS  70  -2.731 -12.991   0.082
  528    HD2  HIS  70           2HD      HIS  70  -3.484  -9.343   2.040
  529    HE1  HIS  70           1HE      HIS  70  -2.665 -13.469   2.587
  530    H    VAL  71           H        VAL  71  -2.062  -7.820   1.336
  531    HA   VAL  71           HA       VAL  71   0.674  -7.441   0.239
  532    HB   VAL  71           HB       VAL  71  -0.706  -5.406   0.867
  533   1HG1  VAL  71          1HG1      VAL  71  -1.758  -6.299   2.959
  534   2HG1  VAL  71          2HG1      VAL  71  -0.162  -6.249   3.738
  535   3HG1  VAL  71          3HG1      VAL  71  -0.923  -4.753   3.179
  536   1HG2  VAL  71          1HG2      VAL  71   1.129  -4.236   1.917
  537   2HG2  VAL  71          2HG2      VAL  71   1.922  -5.790   2.293
  538   3HG2  VAL  71          3HG2      VAL  71   1.676  -5.277   0.602
  539    H    VAL  72           H        VAL  72   2.375  -8.291   1.506
  540    HA   VAL  72           HA       VAL  72   1.539 -10.192   3.659
  541    HB   VAL  72           HB       VAL  72   3.845 -10.359   1.816
  542   1HG1  VAL  72          1HG1      VAL  72   4.515 -11.288   3.945
  543   2HG1  VAL  72          2HG1      VAL  72   3.009 -12.226   4.055
  544   3HG1  VAL  72          3HG1      VAL  72   4.225 -12.611   2.819
  545   1HG2  VAL  72          1HG2      VAL  72   1.347 -12.104   2.064
  546   2HG2  VAL  72          2HG2      VAL  72   1.667 -10.970   0.736
  547   3HG2  VAL  72          3HG2      VAL  72   2.692 -12.398   0.944
  548    H    ILE  73           H        ILE  73   2.605 -10.160   5.482
  549    HA   ILE  73           HA       ILE  73   4.056  -7.636   6.141
  550    HB   ILE  73           HB       ILE  73   2.358  -9.400   7.916
  551   1HG1  ILE  73          2HG1      ILE  73   0.916  -8.338   6.272
  552   2HG1  ILE  73          3HG1      ILE  73   0.736  -7.584   7.848
  553   1HG2  ILE  73          1HG2      ILE  73   3.780  -6.745   8.368
  554   2HG2  ILE  73          2HG2      ILE  73   2.469  -7.350   9.412
  555   3HG2  ILE  73          3HG2      ILE  73   3.971  -8.253   9.269
  556   1HD1  ILE  73          1HD1      ILE  73   2.250  -6.410   5.483
  557   2HD1  ILE  73          2HD1      ILE  73   0.699  -5.881   6.146
  558   3HD1  ILE  73          3HD1      ILE  73   2.171  -5.675   7.104
  559    H    GLU  74           H        GLU  74   6.032  -8.801   5.310
  560    HA   GLU  74           HA       GLU  74   7.183 -10.798   6.900
  561   1HB   GLU  74          2HB       GLU  74   8.094  -8.969   4.696
  562   2HB   GLU  74          3HB       GLU  74   9.264  -9.917   5.605
  563   1HG   GLU  74          2HG       GLU  74   6.847 -11.283   4.382
  564   2HG   GLU  74          3HG       GLU  74   8.318 -10.976   3.445
  565    H    GLY  75           H        GLY  75   6.471  -7.880   7.866
  566   1HA   GLY  75          2HA       GLY  75   9.031  -7.131   9.224
  567   2HA   GLY  75          3HA       GLY  75   7.683  -6.066   8.783
  568    H    ARG  76           H        ARG  76   6.018  -8.499  10.006
  569    HA   ARG  76           HA       ARG  76   6.272  -8.156  12.841
  570   1HB   ARG  76          2HB       ARG  76   5.351  -5.872  11.878
  571   2HB   ARG  76          3HB       ARG  76   3.953  -6.821  11.434
  572   1HG   ARG  76          2HG       ARG  76   3.197  -6.053  13.414
  573   2HG   ARG  76          3HG       ARG  76   3.997  -7.473  14.068
  574   1HD   ARG  76          2HD       ARG  76   5.575  -4.861  13.861
  575   2HD   ARG  76          3HD       ARG  76   4.298  -5.010  15.050
  576    HE   ARG  76           HE       ARG  76   5.414  -6.513  16.290
  577   1HH1  ARG  76          2HH2      ARG  76   7.316  -6.233  13.234
  578   2HH1  ARG  76          1HH2      ARG  76   8.762  -6.731  13.987
  579   1HH2  ARG  76          2HH1      ARG  76   7.359  -7.271  17.196
  580   2HH2  ARG  76          1HH1      ARG  76   8.785  -7.422  16.223
  Start of MODEL   30
    1   1H    MET   1          H1        MET   1   4.277  16.143  15.448
    2   2H    MET   1          H2        MET   1   5.076  16.112  16.886
    3   3H    MET   1          H3        MET   1   3.833  15.148  16.612
    4    HA   MET   1           HA       MET   1   3.052  17.020  17.981
    5   1HB   MET   1          2HB       MET   1   4.694  18.557  15.971
    6   2HB   MET   1          3HB       MET   1   3.252  19.344  16.621
    7   1HG   MET   1          2HG       MET   1   4.010  19.075  18.893
    8   2HG   MET   1          3HG       MET   1   5.519  18.323  18.337
    9   1HE   MET   1          1HE       MET   1   6.662  20.273  19.935
   10   2HE   MET   1          2HE       MET   1   6.427  22.010  19.625
   11   3HE   MET   1          3HE       MET   1   5.075  21.031  20.236
   12    H    LEU   2           H        LEU   2   2.756  18.393  14.729
   13    HA   LEU   2           HA       LEU   2  -0.040  17.599  14.367
   14   1HB   LEU   2          2HB       LEU   2   2.027  19.200  12.940
   15   2HB   LEU   2          3HB       LEU   2   1.169  18.117  11.859
   16    HG   LEU   2           HG       LEU   2  -1.007  19.013  12.659
   17   1HD1  LEU   2          1HD1      LEU   2  -1.013  21.159  13.912
   18   2HD1  LEU   2          2HD1      LEU   2  -0.327  19.858  14.896
   19   3HD1  LEU   2          3HD1      LEU   2   0.747  21.044  14.127
   20   1HD2  LEU   2          1HD2      LEU   2  -0.810  21.141  11.435
   21   2HD2  LEU   2          2HD2      LEU   2   0.960  21.082  11.585
   22   3HD2  LEU   2          3HD2      LEU   2   0.105  19.861  10.618
   23    H    SER   3           H        SER   3  -0.450  16.210  12.249
   24    HA   SER   3           HA       SER   3   0.128  13.644  12.421
   25   1HB   SER   3          2HB       SER   3   0.090  15.212   9.797
   26   2HB   SER   3          3HB       SER   3  -0.396  13.534  10.031
   27    HG   SER   3           HG       SER   3  -2.102  14.223  11.286
   28    H    GLU   4           H        GLU   4   2.068  12.698  12.796
   29    HA   GLU   4           HA       GLU   4   4.520  13.588  11.435
   30   1HB   GLU   4          2HB       GLU   4   3.832  11.556  13.500
   31   2HB   GLU   4          3HB       GLU   4   5.403  11.646  12.768
   32   1HG   GLU   4          2HG       GLU   4   5.817  13.782  13.565
   33   2HG   GLU   4          3HG       GLU   4   4.128  14.045  13.981
   34    H    GLN   5           H        GLN   5   5.614  11.864  10.114
   35    HA   GLN   5           HA       GLN   5   3.682  10.066   8.729
   36   1HB   GLN   5          2HB       GLN   5   5.673  12.009   7.554
   37   2HB   GLN   5          3HB       GLN   5   4.966  10.696   6.621
   38   1HG   GLN   5          2HG       GLN   5   3.146  12.662   8.101
   39   2HG   GLN   5          3HG       GLN   5   3.858  13.065   6.552
   40   1HE2  GLN   5          1HE2      GLN   5   3.598  11.348   4.832
   41   2HE2  GLN   5          2HE2      GLN   5   2.147  10.356   4.764
   42    H    LYS   6           H        LYS   6   4.586   8.146   7.960
   43    HA   LYS   6           HA       LYS   6   7.455   7.717   8.242
   44   1HB   LYS   6          2HB       LYS   6   6.566   7.096  10.401
   45   2HB   LYS   6          3HB       LYS   6   5.348   6.024   9.658
   46   1HG   LYS   6          2HG       LYS   6   7.113   4.606   8.800
   47   2HG   LYS   6          3HG       LYS   6   8.360   5.758   9.353
   48   1HD   LYS   6          2HD       LYS   6   7.579   5.354  11.716
   49   2HD   LYS   6          3HD       LYS   6   6.444   4.144  11.093
   50   1HE   LYS   6          2HE       LYS   6   8.617   3.073   9.981
   51   2HE   LYS   6          3HE       LYS   6   9.495   4.125  11.092
   52   1HZ   LYS   6          1HZ       LYS   6   9.269   2.138  12.205
   53   2HZ   LYS   6          2HZ       LYS   6   8.043   3.025  12.852
   54   3HZ   LYS   6          3HZ       LYS   6   7.722   1.879  11.712
   55    H    GLU   7           H        GLU   7   8.128   5.906   7.201
   56    HA   GLU   7           HA       GLU   7   6.647   5.200   4.745
   57   1HB   GLU   7          2HB       GLU   7   9.609   4.929   4.815
   58   2HB   GLU   7          3HB       GLU   7   8.522   5.525   3.585
   59   1HG   GLU   7          2HG       GLU   7   9.825   7.364   4.150
   60   2HG   GLU   7          3HG       GLU   7   8.382   7.687   5.110
   61    H    ILE   8           H        ILE   8   5.721   3.258   5.502
   62    HA   ILE   8           HA       ILE   8   7.434   1.322   6.910
   63    HB   ILE   8           HB       ILE   8   4.601   1.186   6.039
   64   1HG1  ILE   8          2HG1      ILE   8   4.753   3.054   7.617
   65   2HG1  ILE   8          3HG1      ILE   8   3.834   1.673   8.232
   66   1HG2  ILE   8          1HG2      ILE   8   6.338  -0.446   7.802
   67   2HG2  ILE   8          2HG2      ILE   8   4.546  -0.560   7.864
   68   3HG2  ILE   8          3HG2      ILE   8   5.410  -0.947   6.360
   69   1HD1  ILE   8          1HD1      ILE   8   5.674   0.867   9.493
   70   2HD1  ILE   8          2HD1      ILE   8   6.723   2.152   8.838
   71   3HD1  ILE   8          3HD1      ILE   8   5.347   2.563   9.913
   72    H    ALA   9           H        ALA   9   7.450  -0.898   5.909
   73    HA   ALA   9           HA       ALA   9   7.475  -0.924   2.955
   74   1HB   ALA   9          1HB       ALA   9   9.626  -2.097   2.968
   75   2HB   ALA   9          2HB       ALA   9   9.824  -0.504   3.730
   76   3HB   ALA   9          3HB       ALA   9   9.726  -1.959   4.736
   77    H    MET  10           H        MET  10   6.584  -2.894   2.224
   78    HA   MET  10           HA       MET  10   6.707  -5.270   3.889
   79   1HB   MET  10          2HB       MET  10   4.265  -5.622   4.005
   80   2HB   MET  10          3HB       MET  10   4.821  -4.300   5.013
   81   1HG   MET  10          2HG       MET  10   3.691  -3.880   2.248
   82   2HG   MET  10          3HG       MET  10   2.662  -3.996   3.668
   83   1HE   MET  10          1HE       MET  10   1.979  -2.191   5.190
   84   2HE   MET  10          2HE       MET  10   3.562  -2.458   5.959
   85   3HE   MET  10          3HE       MET  10   3.005  -0.802   5.600
   86    H    GLN  11           H        GLN  11   5.287  -7.075   2.674
   87    HA   GLN  11           HA       GLN  11   6.455  -7.081  -0.071
   88   1HB   GLN  11          2HB       GLN  11   6.031  -9.050   2.124
   89   2HB   GLN  11          3HB       GLN  11   5.529  -9.641   0.548
   90   1HG   GLN  11          2HG       GLN  11   8.222  -8.338   0.564
   91   2HG   GLN  11          3HG       GLN  11   8.057  -9.808   1.517
   92   1HE2  GLN  11          1HE2      GLN  11   8.176  -8.573  -1.791
   93   2HE2  GLN  11          2HE2      GLN  11   7.997 -10.148  -2.540
   94    H    VAL  12           H        VAL  12   5.120  -8.343  -1.727
   95    HA   VAL  12           HA       VAL  12   2.239  -7.557  -1.503
   96    HB   VAL  12           HB       VAL  12   4.063  -7.221  -3.917
   97   1HG1  VAL  12          1HG1      VAL  12   1.724  -7.571  -4.568
   98   2HG1  VAL  12          2HG1      VAL  12   1.180  -6.370  -3.373
   99   3HG1  VAL  12          3HG1      VAL  12   2.139  -5.869  -4.780
  100   1HG2  VAL  12          1HG2      VAL  12   2.996  -5.166  -1.937
  101   2HG2  VAL  12          2HG2      VAL  12   4.707  -5.561  -2.229
  102   3HG2  VAL  12          3HG2      VAL  12   3.761  -4.768  -3.487
  103    H    SER  13           H        SER  13   0.754  -8.941  -2.519
  104    HA   SER  13           HA       SER  13   1.811 -11.314  -3.988
  105   1HB   SER  13          2HB       SER  13  -0.333 -11.219  -1.825
  106   2HB   SER  13          3HB       SER  13  -0.094 -12.599  -2.915
  107    HG   SER  13           HG       SER  13   2.194 -11.650  -1.680
  108    H    GLY  14           H        GLY  14  -0.095 -12.284  -5.306
  109   1HA   GLY  14          2HA       GLY  14  -1.874 -12.025  -6.750
  110   2HA   GLY  14          3HA       GLY  14  -2.216 -10.426  -6.083
  111    H    MET  15           H        MET  15   0.397  -9.289  -6.514
  112    HA   MET  15           HA       MET  15   0.227  -8.098  -8.886
  113   1HB   MET  15          2HB       MET  15   2.615  -7.532  -8.754
  114   2HB   MET  15          3HB       MET  15   1.764  -7.378  -7.233
  115   1HG   MET  15          2HG       MET  15   3.753  -8.363  -6.573
  116   2HG   MET  15          3HG       MET  15   2.692  -9.764  -6.672
  117   1HE   MET  15          1HE       MET  15   6.200 -11.209  -7.622
  118   2HE   MET  15          2HE       MET  15   5.836  -9.961  -6.412
  119   3HE   MET  15          3HE       MET  15   4.775 -11.382  -6.574
  120    H    THR  16           H        THR  16   0.868  -8.168 -10.900
  121    HA   THR  16           HA       THR  16   2.420 -10.351 -12.109
  122    HB   THR  16           HB       THR  16   0.416 -10.434 -13.863
  123    HG1  THR  16           1HG      THR  16  -1.011 -10.017 -11.451
  124   1HG2  THR  16          1HG2      THR  16   0.170 -11.984 -11.249
  125   2HG2  THR  16          2HG2      THR  16  -0.525 -12.408 -12.821
  126   3HG2  THR  16          3HG2      THR  16   1.234 -12.408 -12.607
  127    H    CYS  17           H        CYS  17   0.070  -7.824 -12.986
  128    HA   CYS  17           HA       CYS  17   1.418  -6.820 -15.209
  129   1HB   CYS  17          2HB       CYS  17  -0.352  -5.187 -13.351
  130   2HB   CYS  17          3HB       CYS  17  -0.082  -4.918 -15.079
  131    H    ALA  18           H        ALA  18   2.071  -6.145 -11.858
  132    HA   ALA  18           HA       ALA  18   3.439  -4.797 -10.717
  133   1HB   ALA  18          1HB       ALA  18   5.382  -3.760 -11.676
  134   2HB   ALA  18          2HB       ALA  18   5.208  -5.396 -12.334
  135   3HB   ALA  18          3HB       ALA  18   4.786  -3.984 -13.325
  136    H    ALA  19           H        ALA  19   2.621  -3.041 -13.742
  137    HA   ALA  19           HA       ALA  19   2.373  -0.456 -12.742
  138   1HB   ALA  19          1HB       ALA  19   0.655  -1.805 -14.870
  139   2HB   ALA  19          2HB       ALA  19   0.860  -0.054 -14.649
  140   3HB   ALA  19          3HB       ALA  19   2.243  -1.055 -15.126
  141    H    CYS  20           H        CYS  20  -0.201  -2.972 -12.806
  142    HA   CYS  20           HA       CYS  20  -2.219  -1.448 -11.625
  143   1HB   CYS  20          2HB       CYS  20  -1.664  -4.437 -11.561
  144   2HB   CYS  20          3HB       CYS  20  -3.166  -3.715 -10.961
  145    H    ALA  21           H        ALA  21   0.570  -2.918 -10.045
  146    HA   ALA  21           HA       ALA  21  -0.512  -2.723  -7.383
  147   1HB   ALA  21          1HB       ALA  21   1.452  -4.175  -8.206
  148   2HB   ALA  21          2HB       ALA  21   2.430  -2.698  -8.073
  149   3HB   ALA  21          3HB       ALA  21   1.589  -3.366  -6.649
  150    H    ALA  22           H        ALA  22   0.628  -0.320  -9.698
  151    HA   ALA  22           HA       ALA  22   1.261   1.671  -7.645
  152   1HB   ALA  22          1HB       ALA  22   1.244   3.261  -9.431
  153   2HB   ALA  22          2HB       ALA  22   2.118   1.822  -9.997
  154   3HB   ALA  22          3HB       ALA  22   0.452   2.133 -10.541
  155    H    ARG  23           H        ARG  23  -1.539   0.659  -9.638
  156    HA   ARG  23           HA       ARG  23  -3.269   2.809  -8.927
  157   1HB   ARG  23          2HB       ARG  23  -3.900  -0.017  -9.847
  158   2HB   ARG  23          3HB       ARG  23  -5.111   1.250  -9.643
  159   1HG   ARG  23          2HG       ARG  23  -4.174   2.623 -11.361
  160   2HG   ARG  23          3HG       ARG  23  -2.652   1.733 -11.350
  161   1HD   ARG  23          2HD       ARG  23  -3.689   1.052 -13.313
  162   2HD   ARG  23          3HD       ARG  23  -3.874  -0.302 -12.181
  163    HE   ARG  23           HE       ARG  23  -6.190   1.347 -12.052
  164   1HH1  ARG  23          2HH2      ARG  23  -4.565  -1.113 -14.014
  165   2HH1  ARG  23          1HH2      ARG  23  -5.918  -1.437 -15.039
  166   1HH2  ARG  23          2HH1      ARG  23  -8.068   0.867 -13.362
  167   2HH2  ARG  23          1HH1      ARG  23  -7.977  -0.332 -14.610
  168    H    ILE  24           H        ILE  24  -2.691  -0.401  -7.368
  169    HA   ILE  24           HA       ILE  24  -4.657   0.051  -5.397
  170    HB   ILE  24           HB       ILE  24  -3.898  -1.617  -4.072
  171   1HG1  ILE  24          2HG1      ILE  24  -1.266  -1.258  -5.359
  172   2HG1  ILE  24          3HG1      ILE  24  -1.689  -1.162  -3.640
  173   1HG2  ILE  24          1HG2      ILE  24  -3.958  -3.403  -5.556
  174   2HG2  ILE  24          2HG2      ILE  24  -4.760  -2.118  -6.452
  175   3HG2  ILE  24          3HG2      ILE  24  -3.079  -2.544  -6.843
  176   1HD1  ILE  24          1HD1      ILE  24  -1.454  -3.641  -5.371
  177   2HD1  ILE  24          2HD1      ILE  24  -0.397  -3.169  -4.041
  178   3HD1  ILE  24          3HD1      ILE  24  -2.073  -3.650  -3.694
  179    H    GLU  25           H        GLU  25  -1.122   0.701  -5.001
  180    HA   GLU  25           HA       GLU  25  -1.213   2.159  -2.668
  181   1HB   GLU  25          2HB       GLU  25   0.523   2.195  -5.115
  182   2HB   GLU  25          3HB       GLU  25   0.699   3.550  -3.995
  183   1HG   GLU  25          2HG       GLU  25   2.246   1.590  -3.573
  184   2HG   GLU  25          3HG       GLU  25   1.310   2.122  -2.182
  185    H    LYS  26           H        LYS  26  -2.109   3.470  -5.879
  186    HA   LYS  26           HA       LYS  26  -2.409   6.167  -4.750
  187   1HB   LYS  26          2HB       LYS  26  -3.576   5.136  -7.345
  188   2HB   LYS  26          3HB       LYS  26  -3.365   6.818  -6.854
  189   1HG   LYS  26          2HG       LYS  26  -1.204   4.811  -7.523
  190   2HG   LYS  26          3HG       LYS  26  -1.686   6.203  -8.474
  191   1HD   LYS  26          2HD       LYS  26  -0.649   7.725  -6.904
  192   2HD   LYS  26          3HD       LYS  26  -0.499   6.472  -5.667
  193   1HE   LYS  26          2HE       LYS  26   1.670   6.909  -6.659
  194   2HE   LYS  26          3HE       LYS  26   1.145   5.237  -6.868
  195   1HZ   LYS  26          1HZ       LYS  26   2.118   6.129  -8.859
  196   2HZ   LYS  26          2HZ       LYS  26   0.542   5.754  -9.126
  197   3HZ   LYS  26          3HZ       LYS  26   0.998   7.328  -8.943
  198    H    GLY  27           H        GLY  27  -4.769   3.574  -5.580
  199   1HA   GLY  27          2HA       GLY  27  -7.077   5.038  -4.662
  200   2HA   GLY  27          3HA       GLY  27  -6.933   3.285  -4.841
  201    H    LEU  28           H        LEU  28  -4.584   3.147  -3.082
  202    HA   LEU  28           HA       LEU  28  -5.816   2.783  -0.493
  203   1HB   LEU  28          2HB       LEU  28  -4.096   1.397  -1.425
  204   2HB   LEU  28          3HB       LEU  28  -2.931   2.720  -1.389
  205    HG   LEU  28           HG       LEU  28  -4.316   1.791   1.131
  206   1HD1  LEU  28          1HD1      LEU  28  -3.464  -0.192   0.039
  207   2HD1  LEU  28          2HD1      LEU  28  -1.873   0.567  -0.186
  208   3HD1  LEU  28          3HD1      LEU  28  -2.461   0.180   1.443
  209   1HD2  LEU  28          1HD2      LEU  28  -2.192   2.632   2.144
  210   2HD2  LEU  28          2HD2      LEU  28  -1.588   3.046   0.530
  211   3HD2  LEU  28          3HD2      LEU  28  -2.990   3.890   1.220
  212    H    LYS  29           H        LYS  29  -3.327   5.086  -1.745
  213    HA   LYS  29           HA       LYS  29  -3.103   6.718   0.456
  214   1HB   LYS  29          2HB       LYS  29  -1.726   6.904  -1.572
  215   2HB   LYS  29          3HB       LYS  29  -3.104   7.570  -2.451
  216   1HG   LYS  29          2HG       LYS  29  -2.849   9.238  -0.137
  217   2HG   LYS  29          3HG       LYS  29  -1.228   8.857  -0.575
  218   1HD   LYS  29          2HD       LYS  29  -3.207   9.789  -2.708
  219   2HD   LYS  29          3HD       LYS  29  -2.477  10.949  -1.580
  220   1HE   LYS  29          2HE       LYS  29  -0.306  10.484  -2.205
  221   2HE   LYS  29          3HE       LYS  29  -0.695   9.014  -3.132
  222   1HZ   LYS  29          1HZ       LYS  29  -0.045  10.924  -4.340
  223   2HZ   LYS  29          2HZ       LYS  29  -1.613  10.542  -4.759
  224   3HZ   LYS  29          3HZ       LYS  29  -1.288  11.831  -3.765
  225    H    ARG  30           H        ARG  30  -5.796   6.691  -1.848
  226    HA   ARG  30           HA       ARG  30  -6.958   9.123  -1.087
  227   1HB   ARG  30          2HB       ARG  30  -7.729   6.787  -2.623
  228   2HB   ARG  30          3HB       ARG  30  -9.103   7.295  -1.658
  229   1HG   ARG  30          2HG       ARG  30  -7.447   9.122  -3.460
  230   2HG   ARG  30          3HG       ARG  30  -8.937   8.299  -3.950
  231   1HD   ARG  30          2HD       ARG  30 -10.191   9.453  -2.151
  232   2HD   ARG  30          3HD       ARG  30  -8.722  10.338  -1.687
  233    HE   ARG  30           HE       ARG  30  -9.181  10.709  -4.469
  234   1HH1  ARG  30          2HH2      ARG  30 -10.528  11.631  -1.353
  235   2HH1  ARG  30          1HH2      ARG  30 -11.237  13.120  -1.898
  236   1HH2  ARG  30          2HH1      ARG  30 -10.107  12.684  -5.258
  237   2HH2  ARG  30          1HH1      ARG  30 -10.981  13.729  -4.189
  238    H    MET  31           H        MET  31  -6.626   6.390   1.001
  239    HA   MET  31           HA       MET  31  -8.962   6.824   2.605
  240   1HB   MET  31          2HB       MET  31  -7.937   5.284   4.147
  241   2HB   MET  31          3HB       MET  31  -7.502   4.791   2.512
  242   1HG   MET  31          2HG       MET  31  -5.271   5.798   2.795
  243   2HG   MET  31          3HG       MET  31  -5.686   6.319   4.412
  244   1HE   MET  31          1HE       MET  31  -5.457   1.879   3.338
  245   2HE   MET  31          2HE       MET  31  -7.012   2.721   3.424
  246   3HE   MET  31          3HE       MET  31  -5.787   3.180   2.193
  247    HA   PRO  32           HA       PRO  32  -7.491  10.228   5.249
  248   1HB   PRO  32          2HB       PRO  32  -8.404   9.473   7.727
  249   2HB   PRO  32          3HB       PRO  32  -9.476  10.124   6.451
  250   1HG   PRO  32          2HG       PRO  32  -8.956   7.209   7.106
  251   2HG   PRO  32          3HG       PRO  32 -10.542   8.016   6.923
  252   1HD   PRO  32          2HD       PRO  32  -9.460   6.642   4.889
  253   2HD   PRO  32          3HD       PRO  32 -10.252   8.201   4.554
  254    H    GLY  33           H        GLY  33  -5.527  10.502   6.317
  255   1HA   GLY  33          2HA       GLY  33  -3.896  10.009   7.838
  256   2HA   GLY  33          3HA       GLY  33  -4.379   8.320   7.893
  257    H    VAL  34           H        VAL  34  -4.150   8.150   4.776
  258    HA   VAL  34           HA       VAL  34  -1.174   7.984   4.675
  259    HB   VAL  34           HB       VAL  34  -3.259   7.103   2.684
  260   1HG1  VAL  34          1HG1      VAL  34  -1.113   7.591   1.569
  261   2HG1  VAL  34          2HG1      VAL  34  -0.225   6.701   2.815
  262   3HG1  VAL  34          3HG1      VAL  34  -1.296   5.838   1.701
  263   1HG2  VAL  34          1HG2      VAL  34  -2.767   4.846   3.399
  264   2HG2  VAL  34          2HG2      VAL  34  -1.543   5.377   4.535
  265   3HG2  VAL  34          3HG2      VAL  34  -3.227   5.780   4.844
  266    H    THR  35           H        THR  35   0.093   9.376   3.489
  267    HA   THR  35           HA       THR  35  -1.377  11.584   2.107
  268    HB   THR  35           HB       THR  35   0.455  11.781   4.201
  269    HG1  THR  35           1HG      THR  35  -0.530  13.681   2.361
  270   1HG2  THR  35          1HG2      THR  35   1.690  12.917   1.647
  271   2HG2  THR  35          2HG2      THR  35   2.228  13.191   3.313
  272   3HG2  THR  35          3HG2      THR  35   2.365  11.573   2.603
  273    H    ASP  36           H        ASP  36   1.400   9.278   1.776
  274    HA   ASP  36           HA       ASP  36   0.829   9.268  -1.043
  275   1HB   ASP  36          2HB       ASP  36   3.232  10.681  -0.105
  276   2HB   ASP  36          3HB       ASP  36   3.611   9.342  -1.183
  277    H    ALA  37           H        ALA  37   2.103   7.627  -2.180
  278    HA   ALA  37           HA       ALA  37   3.017   5.431  -0.595
  279   1HB   ALA  37          1HB       ALA  37   0.447   5.315  -0.331
  280   2HB   ALA  37          2HB       ALA  37   0.392   4.927  -2.055
  281   3HB   ALA  37          3HB       ALA  37   1.243   3.854  -0.912
  282    H    ASN  38           H        ASN  38   3.942   3.690  -1.881
  283    HA   ASN  38           HA       ASN  38   4.372   4.304  -4.737
  284   1HB   ASN  38          2HB       ASN  38   6.997   4.253  -3.692
  285   2HB   ASN  38          3HB       ASN  38   6.147   5.608  -4.411
  286   1HD2  ASN  38          1HD2      ASN  38   5.892   4.013  -1.167
  287   2HD2  ASN  38          2HD2      ASN  38   6.224   5.503  -0.284
  288    H    VAL  39           H        VAL  39   4.449   2.331  -5.639
  289    HA   VAL  39           HA       VAL  39   5.064   0.023  -3.974
  290    HB   VAL  39           HB       VAL  39   3.052   0.211  -5.339
  291   1HG1  VAL  39          1HG1      VAL  39   4.020   1.255  -7.410
  292   2HG1  VAL  39          2HG1      VAL  39   4.755  -0.314  -7.811
  293   3HG1  VAL  39          3HG1      VAL  39   3.022  -0.173  -7.698
  294   1HG2  VAL  39          1HG2      VAL  39   4.470  -2.188  -6.380
  295   2HG2  VAL  39          2HG2      VAL  39   4.345  -1.984  -4.617
  296   3HG2  VAL  39          3HG2      VAL  39   2.886  -2.006  -5.598
  297    H    ASN  40           H        ASN  40   7.236  -0.379  -3.690
  298    HA   ASN  40           HA       ASN  40   9.123   0.193  -5.894
  299   1HB   ASN  40          2HB       ASN  40   9.573   0.837  -3.513
  300   2HB   ASN  40          3HB       ASN  40   9.663  -0.885  -3.103
  301   1HD2  ASN  40          1HD2      ASN  40  11.881   0.353  -2.469
  302   2HD2  ASN  40          2HD2      ASN  40  13.145   0.151  -3.674
  303    H    LEU  41           H        LEU  41   7.505  -1.520  -6.892
  304    HA   LEU  41           HA       LEU  41   7.919  -4.269  -6.186
  305   1HB   LEU  41          2HB       LEU  41   6.137  -2.801  -7.820
  306   2HB   LEU  41          3HB       LEU  41   6.955  -3.866  -8.939
  307    HG   LEU  41           HG       LEU  41   4.783  -4.655  -7.939
  308   1HD1  LEU  41          1HD1      LEU  41   5.516  -6.998  -7.700
  309   2HD1  LEU  41          2HD1      LEU  41   6.317  -6.207  -9.068
  310   3HD1  LEU  41          3HD1      LEU  41   7.202  -6.474  -7.551
  311   1HD2  LEU  41          1HD2      LEU  41   6.259  -5.560  -5.463
  312   2HD2  LEU  41          2HD2      LEU  41   5.489  -3.970  -5.502
  313   3HD2  LEU  41          3HD2      LEU  41   4.528  -5.433  -5.783
  314    H    ALA  42           H        ALA  42   9.719  -2.065  -8.104
  315    HA   ALA  42           HA       ALA  42  11.359  -3.677  -9.679
  316   1HB   ALA  42          1HB       ALA  42  12.170  -1.362  -7.875
  317   2HB   ALA  42          2HB       ALA  42  13.103  -2.002  -9.239
  318   3HB   ALA  42          3HB       ALA  42  11.536  -1.216  -9.535
  319    H    THR  43           H        THR  43  11.334  -3.372  -6.084
  320    HA   THR  43           HA       THR  43  13.330  -5.604  -6.027
  321    HB   THR  43           HB       THR  43  14.277  -3.553  -5.154
  322    HG1  THR  43           1HG      THR  43  13.756  -5.661  -3.352
  323   1HG2  THR  43          1HG2      THR  43  12.307  -3.804  -2.834
  324   2HG2  THR  43          2HG2      THR  43  13.562  -2.576  -3.063
  325   3HG2  THR  43          3HG2      THR  43  12.146  -2.614  -4.132
  326    H    GLU  44           H        GLU  44  10.329  -5.625  -6.293
  327    HA   GLU  44           HA       GLU  44   8.519  -6.590  -5.446
  328   1HB   GLU  44          2HB       GLU  44  10.557  -8.410  -5.510
  329   2HB   GLU  44          3HB       GLU  44  10.014  -8.586  -3.847
  330   1HG   GLU  44          2HG       GLU  44   7.618  -8.754  -4.869
  331   2HG   GLU  44          3HG       GLU  44   8.429  -8.915  -6.443
  332    H    THR  45           H        THR  45   9.000  -4.331  -3.940
  333    HA   THR  45           HA       THR  45   7.761  -5.156  -1.390
  334    HB   THR  45           HB       THR  45   9.971  -3.059  -1.676
  335    HG1  THR  45           1HG      THR  45  10.150  -5.842  -1.415
  336   1HG2  THR  45          1HG2      THR  45   8.531  -2.986   0.321
  337   2HG2  THR  45          2HG2      THR  45   8.887  -4.719   0.607
  338   3HG2  THR  45          3HG2      THR  45  10.187  -3.502   0.739
  339    H    VAL  46           H        VAL  46   6.448  -3.440  -0.439
  340    HA   VAL  46           HA       VAL  46   5.859  -1.156  -2.279
  341    HB   VAL  46           HB       VAL  46   3.981  -2.669  -2.341
  342   1HG1  VAL  46          1HG1      VAL  46   3.842  -2.372   0.674
  343   2HG1  VAL  46          2HG1      VAL  46   2.643  -3.192  -0.341
  344   3HG1  VAL  46          3HG1      VAL  46   4.262  -3.876  -0.191
  345   1HG2  VAL  46          1HG2      VAL  46   3.461  -0.275  -2.359
  346   2HG2  VAL  46          2HG2      VAL  46   2.220  -1.228  -1.516
  347   3HG2  VAL  46          3HG2      VAL  46   3.353  -0.254  -0.583
  348    H    ASN  47           H        ASN  47   5.647   0.888  -1.302
  349    HA   ASN  47           HA       ASN  47   6.290   1.019   1.582
  350   1HB   ASN  47          2HB       ASN  47   7.480   2.583  -0.753
  351   2HB   ASN  47          3HB       ASN  47   7.470   3.225   0.893
  352   1HD2  ASN  47          1HD2      ASN  47   8.340   1.603   2.630
  353   2HD2  ASN  47          2HD2      ASN  47   9.913   0.966   2.174
  354    H    VAL  48           H        VAL  48   5.164   2.724   2.689
  355    HA   VAL  48           HA       VAL  48   3.175   4.209   1.122
  356    HB   VAL  48           HB       VAL  48   2.024   2.174   1.534
  357   1HG1  VAL  48          1HG1      VAL  48   2.841   2.441   4.440
  358   2HG1  VAL  48          2HG1      VAL  48   1.584   1.338   3.847
  359   3HG1  VAL  48          3HG1      VAL  48   3.259   1.146   3.313
  360   1HG2  VAL  48          1HG2      VAL  48   0.771   4.267   1.741
  361   2HG2  VAL  48          2HG2      VAL  48   0.107   2.986   2.758
  362   3HG2  VAL  48          3HG2      VAL  48   1.055   4.296   3.485
  363    H    ILE  49           H        ILE  49   2.926   6.197   1.915
  364    HA   ILE  49           HA       ILE  49   4.737   6.919   4.113
  365    HB   ILE  49           HB       ILE  49   3.778   8.704   1.848
  366   1HG1  ILE  49          2HG1      ILE  49   4.913   6.902   0.734
  367   2HG1  ILE  49          3HG1      ILE  49   5.884   8.365   0.711
  368   1HG2  ILE  49          1HG2      ILE  49   4.619   9.909   3.758
  369   2HG2  ILE  49          2HG2      ILE  49   6.078   8.918   3.830
  370   3HG2  ILE  49          3HG2      ILE  49   5.802  10.008   2.452
  371   1HD1  ILE  49          1HD1      ILE  49   7.273   7.461   2.598
  372   2HD1  ILE  49          2HD1      ILE  49   6.337   5.950   2.507
  373   3HD1  ILE  49          3HD1      ILE  49   7.332   6.472   1.139
  374    H    TYR  50           H        TYR  50   3.271   6.847   5.871
  375    HA   TYR  50           HA       TYR  50   0.801   8.528   5.702
  376   1HB   TYR  50          2HB       TYR  50  -0.591   6.752   6.439
  377   2HB   TYR  50          3HB       TYR  50   0.345   6.164   5.075
  378    HD1  TYR  50           HD1      TYR  50   2.095   4.407   5.454
  379    HD2  TYR  50           HD2      TYR  50  -0.340   5.878   8.672
  380    HE1  TYR  50           HE1      TYR  50   2.298   2.227   6.614
  381    HE2  TYR  50           HE2      TYR  50   0.149   3.835   9.966
  382    HH   TYR  50           HH       TYR  50   1.675   0.984   8.463
  383    H    ASP  51           H        ASP  51  -0.357   8.514   7.777
  384    HA   ASP  51           HA       ASP  51   1.580   9.284   9.858
  385   1HB   ASP  51          2HB       ASP  51  -0.139  10.890   9.220
  386   2HB   ASP  51          3HB       ASP  51  -1.416   9.749   9.672
  387    HA   PRO  52           HA       PRO  52   0.425   5.287  11.646
  388   1HB   PRO  52          2HB       PRO  52   2.483   4.811  13.286
  389   2HB   PRO  52          3HB       PRO  52   2.643   4.722  11.515
  390   1HG   PRO  52          2HG       PRO  52   3.299   7.109  13.305
  391   2HG   PRO  52          3HG       PRO  52   4.370   6.359  12.085
  392   1HD   PRO  52          2HD       PRO  52   2.836   8.559  11.543
  393   2HD   PRO  52          3HD       PRO  52   3.137   7.292  10.315
  394    H    ALA  53           H        ALA  53   0.156   8.451  12.960
  395    HA   ALA  53           HA       ALA  53  -0.701   7.506  15.613
  396   1HB   ALA  53          1HB       ALA  53  -1.073  10.179  14.213
  397   2HB   ALA  53          2HB       ALA  53  -1.304   9.815  15.929
  398   3HB   ALA  53          3HB       ALA  53   0.332   9.780  15.233
  399    H    GLU  54           H        GLU  54  -1.850   7.956  12.277
  400    HA   GLU  54           HA       GLU  54  -4.611   8.139  13.283
  401   1HB   GLU  54          2HB       GLU  54  -3.509  10.059  11.884
  402   2HB   GLU  54          3HB       GLU  54  -3.879   9.022  10.497
  403   1HG   GLU  54          2HG       GLU  54  -6.278   8.903  11.366
  404   2HG   GLU  54          3HG       GLU  54  -5.815  10.072  12.614
  405    H    THR  55           H        THR  55  -2.677   6.836  10.608
  406    HA   THR  55           HA       THR  55  -4.409   4.460  10.520
  407    HB   THR  55           HB       THR  55  -2.812   3.976   8.339
  408    HG1  THR  55           1HG      THR  55  -3.294   6.738   8.518
  409   1HG2  THR  55          1HG2      THR  55  -4.764   4.715   7.061
  410   2HG2  THR  55          2HG2      THR  55  -5.223   3.726   8.464
  411   3HG2  THR  55          3HG2      THR  55  -5.452   5.514   8.503
  412    H    GLY  56           H        GLY  56  -3.075   2.612   9.749
  413   1HA   GLY  56          2HA       GLY  56  -0.589   2.027  11.040
  414   2HA   GLY  56          3HA       GLY  56  -1.990   1.283  11.845
  415    H    THR  57           H        THR  57  -2.160  -0.741  11.044
  416    HA   THR  57           HA       THR  57  -1.396  -1.581   8.353
  417    HB   THR  57           HB       THR  57  -1.966  -3.801   9.511
  418    HG1  THR  57           1HG      THR  57  -2.261  -3.591  11.784
  419   1HG2  THR  57          1HG2      THR  57   0.371  -2.867   9.455
  420   2HG2  THR  57          2HG2      THR  57   0.058  -1.941  10.930
  421   3HG2  THR  57          3HG2      THR  57   0.057  -3.713  10.981
  422    H    ALA  58           H        ALA  58  -4.113  -1.043  10.485
  423    HA   ALA  58           HA       ALA  58  -6.062  -2.534   9.532
  424   1HB   ALA  58          1HB       ALA  58  -6.401   0.304  10.541
  425   2HB   ALA  58          2HB       ALA  58  -7.674  -0.935  10.487
  426   3HB   ALA  58          3HB       ALA  58  -6.258  -1.162  11.532
  427    H    ALA  59           H        ALA  59  -5.605   0.723   8.317
  428    HA   ALA  59           HA       ALA  59  -8.060   0.437   6.662
  429   1HB   ALA  59          1HB       ALA  59  -7.603   2.715   5.915
  430   2HB   ALA  59          2HB       ALA  59  -7.481   2.615   7.683
  431   3HB   ALA  59          3HB       ALA  59  -6.005   2.656   6.691
  432    H    ILE  60           H        ILE  60  -4.607   0.373   6.341
  433    HA   ILE  60           HA       ILE  60  -4.267   0.123   3.536
  434    HB   ILE  60           HB       ILE  60  -2.709  -0.327   6.061
  435   1HG1  ILE  60          2HG1      ILE  60  -1.992   0.907   3.448
  436   2HG1  ILE  60          3HG1      ILE  60  -3.115   1.768   4.482
  437   1HG2  ILE  60          1HG2      ILE  60  -1.826  -1.445   3.371
  438   2HG2  ILE  60          2HG2      ILE  60  -0.772  -1.142   4.774
  439   3HG2  ILE  60          3HG2      ILE  60  -2.054  -2.347   4.890
  440   1HD1  ILE  60          1HD1      ILE  60  -0.805   2.593   4.835
  441   2HD1  ILE  60          2HD1      ILE  60  -1.555   1.955   6.293
  442   3HD1  ILE  60          3HD1      ILE  60  -0.327   0.992   5.441
  443    H    GLN  61           H        GLN  61  -4.612  -2.545   5.979
  444    HA   GLN  61           HA       GLN  61  -4.551  -4.510   3.889
  445   1HB   GLN  61          2HB       GLN  61  -5.055  -4.520   6.768
  446   2HB   GLN  61          3HB       GLN  61  -6.198  -5.534   5.880
  447   1HG   GLN  61          2HG       GLN  61  -4.645  -7.095   6.254
  448   2HG   GLN  61          3HG       GLN  61  -4.091  -6.539   4.681
  449   1HE2  GLN  61          1HE2      GLN  61  -2.924  -3.990   5.842
  450   2HE2  GLN  61          2HE2      GLN  61  -1.478  -4.533   6.683
  451    H    GLU  62           H        GLU  62  -7.297  -2.811   5.515
  452    HA   GLU  62           HA       GLU  62  -9.452  -3.984   4.195
  453   1HB   GLU  62          2HB       GLU  62  -8.886  -1.267   5.371
  454   2HB   GLU  62          3HB       GLU  62 -10.304  -1.426   4.351
  455   1HG   GLU  62          2HG       GLU  62 -11.114  -3.301   5.773
  456   2HG   GLU  62          3HG       GLU  62  -9.708  -3.073   6.834
  457    H    LYS  63           H        LYS  63  -7.708  -1.020   3.039
  458    HA   LYS  63           HA       LYS  63  -9.140  -0.934   0.589
  459   1HB   LYS  63          2HB       LYS  63  -6.659   0.329   1.754
  460   2HB   LYS  63          3HB       LYS  63  -7.030   0.520   0.073
  461   1HG   LYS  63          2HG       LYS  63  -8.877   1.331   2.360
  462   2HG   LYS  63          3HG       LYS  63  -7.821   2.386   1.414
  463   1HD   LYS  63          2HD       LYS  63  -9.589   2.900   0.283
  464   2HD   LYS  63          3HD       LYS  63  -9.171   1.477  -0.670
  465   1HE   LYS  63          2HE       LYS  63 -10.948   0.179   0.397
  466   2HE   LYS  63          3HE       LYS  63 -11.102   1.347   1.714
  467   1HZ   LYS  63          1HZ       LYS  63 -12.863   1.511   0.117
  468   2HZ   LYS  63          2HZ       LYS  63 -12.002   2.907   0.173
  469   3HZ   LYS  63          3HZ       LYS  63 -11.804   1.871  -1.092
  470    H    ILE  64           H        ILE  64  -6.042  -2.513   1.526
  471    HA   ILE  64           HA       ILE  64  -5.007  -3.090  -0.944
  472    HB   ILE  64           HB       ILE  64  -4.885  -4.149   1.784
  473   1HG1  ILE  64          2HG1      ILE  64  -3.398  -2.400   0.758
  474   2HG1  ILE  64          3HG1      ILE  64  -2.613  -3.744   1.579
  475   1HG2  ILE  64          1HG2      ILE  64  -3.459  -6.047   1.212
  476   2HG2  ILE  64          2HG2      ILE  64  -5.191  -6.265   0.976
  477   3HG2  ILE  64          3HG2      ILE  64  -4.141  -5.977  -0.438
  478   1HD1  ILE  64          1HD1      ILE  64  -2.936  -3.477  -1.434
  479   2HD1  ILE  64          2HD1      ILE  64  -1.448  -3.264  -0.482
  480   3HD1  ILE  64          3HD1      ILE  64  -2.216  -4.860  -0.598
  481    H    GLU  65           H        GLU  65  -7.269  -5.012   1.118
  482    HA   GLU  65           HA       GLU  65  -7.959  -7.038  -0.741
  483   1HB   GLU  65          2HB       GLU  65  -9.333  -5.838   1.693
  484   2HB   GLU  65          3HB       GLU  65 -10.087  -7.132   0.760
  485   1HG   GLU  65          2HG       GLU  65  -7.257  -7.429   1.780
  486   2HG   GLU  65          3HG       GLU  65  -8.647  -7.773   2.809
  487    H    LYS  66           H        LYS  66  -9.769  -4.025   0.077
  488    HA   LYS  66           HA       LYS  66 -11.829  -4.526  -1.745
  489   1HB   LYS  66          2HB       LYS  66 -11.005  -2.308  -0.061
  490   2HB   LYS  66          3HB       LYS  66 -11.545  -1.666  -1.608
  491   1HG   LYS  66          2HG       LYS  66 -13.124  -3.663   0.067
  492   2HG   LYS  66          3HG       LYS  66 -13.330  -1.910   0.161
  493   1HD   LYS  66          2HD       LYS  66 -13.916  -1.820  -2.254
  494   2HD   LYS  66          3HD       LYS  66 -13.739  -3.577  -2.374
  495   1HE   LYS  66          2HE       LYS  66 -15.526  -3.865  -0.640
  496   2HE   LYS  66          3HE       LYS  66 -15.745  -2.108  -0.593
  497   1HZ   LYS  66          1HZ       LYS  66 -17.349  -3.167  -2.008
  498   2HZ   LYS  66          2HZ       LYS  66 -16.380  -2.204  -2.920
  499   3HZ   LYS  66          3HZ       LYS  66 -16.177  -3.838  -2.944
  500    H    LEU  67           H        LEU  67  -8.730  -2.988  -2.391
  501    HA   LEU  67           HA       LEU  67  -9.343  -2.194  -5.113
  502   1HB   LEU  67          2HB       LEU  67  -6.812  -2.433  -3.459
  503   2HB   LEU  67          3HB       LEU  67  -6.763  -1.990  -5.165
  504    HG   LEU  67           HG       LEU  67  -8.653  -0.472  -3.355
  505   1HD1  LEU  67          1HD1      LEU  67  -5.655  -0.049  -3.489
  506   2HD1  LEU  67          2HD1      LEU  67  -6.808   1.195  -2.969
  507   3HD1  LEU  67          3HD1      LEU  67  -6.638  -0.309  -2.064
  508   1HD2  LEU  67          1HD2      LEU  67  -8.659  -0.143  -5.850
  509   2HD2  LEU  67          2HD2      LEU  67  -8.230   1.318  -4.955
  510   3HD2  LEU  67          3HD2      LEU  67  -6.966   0.367  -5.758
  511    H    GLY  68           H        GLY  68  -8.627  -5.233  -3.641
  512   1HA   GLY  68          2HA       GLY  68  -8.926  -7.246  -4.726
  513   2HA   GLY  68          3HA       GLY  68  -8.595  -6.510  -6.298
  514    H    TYR  69           H        TYR  69  -6.624  -6.306  -3.264
  515    HA   TYR  69           HA       TYR  69  -4.470  -7.924  -4.544
  516   1HB   TYR  69          2HB       TYR  69  -4.532  -5.051  -3.958
  517   2HB   TYR  69          3HB       TYR  69  -3.257  -5.849  -3.067
  518    HD1  TYR  69           HD1      TYR  69  -4.721  -5.576  -6.508
  519    HD2  TYR  69           HD2      TYR  69  -1.254  -6.542  -4.139
  520    HE1  TYR  69           HE1      TYR  69  -3.341  -5.470  -8.512
  521    HE2  TYR  69           HE2      TYR  69   0.151  -6.352  -6.131
  522    HH   TYR  69           HH       TYR  69  -1.182  -5.433  -9.337
  523    H    HIS  70           H        HIS  70  -2.684  -8.228  -2.799
  524    HA   HIS  70           HA       HIS  70  -3.702  -8.313  -0.059
  525   1HB   HIS  70          2HB       HIS  70  -4.341 -10.492  -1.025
  526   2HB   HIS  70          3HB       HIS  70  -2.663 -10.788  -1.484
  527    HD1  HIS  70           1HD      HIS  70  -2.731 -12.991   0.082
  528    HD2  HIS  70           2HD      HIS  70  -3.484  -9.343   2.040
  529    HE1  HIS  70           1HE      HIS  70  -2.665 -13.469   2.587
  530    H    VAL  71           H        VAL  71  -2.062  -7.820   1.336
  531    HA   VAL  71           HA       VAL  71   0.674  -7.441   0.239
  532    HB   VAL  71           HB       VAL  71  -0.706  -5.406   0.867
  533   1HG1  VAL  71          1HG1      VAL  71  -1.758  -6.299   2.959
  534   2HG1  VAL  71          2HG1      VAL  71  -0.162  -6.249   3.738
  535   3HG1  VAL  71          3HG1      VAL  71  -0.923  -4.753   3.179
  536   1HG2  VAL  71          1HG2      VAL  71   1.129  -4.236   1.917
  537   2HG2  VAL  71          2HG2      VAL  71   1.922  -5.790   2.293
  538   3HG2  VAL  71          3HG2      VAL  71   1.676  -5.277   0.602
  539    H    VAL  72           H        VAL  72   2.375  -8.291   1.506
  540    HA   VAL  72           HA       VAL  72   1.539 -10.192   3.659
  541    HB   VAL  72           HB       VAL  72   3.845 -10.359   1.816
  542   1HG1  VAL  72          1HG1      VAL  72   4.515 -11.288   3.945
  543   2HG1  VAL  72          2HG1      VAL  72   3.009 -12.226   4.055
  544   3HG1  VAL  72          3HG1      VAL  72   4.225 -12.611   2.819
  545   1HG2  VAL  72          1HG2      VAL  72   1.347 -12.104   2.064
  546   2HG2  VAL  72          2HG2      VAL  72   1.667 -10.970   0.736
  547   3HG2  VAL  72          3HG2      VAL  72   2.692 -12.398   0.944
  548    H    ILE  73           H        ILE  73   2.605 -10.160   5.482
  549    HA   ILE  73           HA       ILE  73   4.056  -7.636   6.141
  550    HB   ILE  73           HB       ILE  73   2.358  -9.400   7.916
  551   1HG1  ILE  73          2HG1      ILE  73   0.916  -8.338   6.272
  552   2HG1  ILE  73          3HG1      ILE  73   0.736  -7.584   7.848
  553   1HG2  ILE  73          1HG2      ILE  73   3.780  -6.745   8.368
  554   2HG2  ILE  73          2HG2      ILE  73   2.469  -7.350   9.412
  555   3HG2  ILE  73          3HG2      ILE  73   3.971  -8.253   9.269
  556   1HD1  ILE  73          1HD1      ILE  73   2.250  -6.410   5.483
  557   2HD1  ILE  73          2HD1      ILE  73   0.699  -5.881   6.146
  558   3HD1  ILE  73          3HD1      ILE  73   2.171  -5.675   7.104
  559    H    GLU  74           H        GLU  74   6.032  -8.801   5.310
  560    HA   GLU  74           HA       GLU  74   7.183 -10.798   6.900
  561   1HB   GLU  74          2HB       GLU  74   8.094  -8.969   4.696
  562   2HB   GLU  74          3HB       GLU  74   9.264  -9.917   5.605
  563   1HG   GLU  74          2HG       GLU  74   6.847 -11.283   4.382
  564   2HG   GLU  74          3HG       GLU  74   8.318 -10.976   3.445
  565    H    GLY  75           H        GLY  75   6.471  -7.880   7.866
  566   1HA   GLY  75          2HA       GLY  75   9.031  -7.131   9.224
  567   2HA   GLY  75          3HA       GLY  75   7.683  -6.066   8.783
  568    H    ARG  76           H        ARG  76   6.018  -8.499  10.006
  569    HA   ARG  76           HA       ARG  76   6.272  -8.156  12.841
  570   1HB   ARG  76          2HB       ARG  76   5.351  -5.872  11.878
  571   2HB   ARG  76          3HB       ARG  76   3.953  -6.821  11.434
  572   1HG   ARG  76          2HG       ARG  76   3.197  -6.053  13.414
  573   2HG   ARG  76          3HG       ARG  76   3.997  -7.473  14.068
  574   1HD   ARG  76          2HD       ARG  76   5.575  -4.861  13.861
  575   2HD   ARG  76          3HD       ARG  76   4.298  -5.010  15.050
  576    HE   ARG  76           HE       ARG  76   5.414  -6.513  16.290
  577   1HH1  ARG  76          2HH2      ARG  76   7.316  -6.233  13.234
  578   2HH1  ARG  76          1HH2      ARG  76   8.762  -6.731  13.987
  579   1HH2  ARG  76          2HH1      ARG  76   7.359  -7.271  17.196
  580   2HH2  ARG  76          1HH1      ARG  76   8.785  -7.422  16.223