*HEADER   PHOSHPHOTRANSFERASE                     23-MAR-96   1IBA    
*TITLE    GLUCOSE PERMEASE (DOMAIN IIB), NMR, 11 STRUCTURES           
*COMPND   MOL_ID: 1;                                                  
*COMPND  2 MOLECULE: GLUCOSE PERMEASE;                                
*COMPND  3 CHAIN: NULL;                                               
*COMPND  4 FRAGMENT: DOMAIN IIB;                                      
*COMPND  5 EC: 2.7.1.69;                                              
*COMPND  6 ENGINEERED: YES                                            
*SOURCE   MOL_ID: 1;                                                  
*SOURCE  2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI;                     
*SOURCE  3 STRAIN: K-12, W3110;                                       
*SOURCE  4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                       
*SOURCE  5 EXPRESSION_SYSTEM_PLASMID: PQBH;                           
*SOURCE  6 EXPRESSION_SYSTEM_GENE: PTSG                               
*KEYWDS   PHOSPHOTRANSFERASE SYSTEM, SUGAR TRANSPORT, TRANSFERASE,    
*KEYWDS  2 PHOSPHORYLATION, TRANSMEMBRANE, INNER MEMBRANE             
*EXPDTA   NMR, 11 STRUCTURES                                          
*AUTHOR   M.EBERSTADT,S.G.GRDADOLNIK,G.GEMMECKER,H.KESSLER,A.BUHR,    
*AUTHOR  2 B.ERNI                                                     
*REVDAT  1   14-OCT-96 1IBA    0                                      


# DIANA distance restraints, upper limits (.upl)
 15 MET  
         H      15 MET  HA      2.80  1.00E+01
         H      15 MET  QB      3.50
         H      15 MET  QG      3.70
         H      16 ALA  H       2.80  1.00E+01
         HA     16 ALA  H       3.50
         HA     18 ALA  H       3.50
         HA     18 ALA  QB      3.50
         QB     16 ALA  H       4.50
 16 ALA  
         H      16 ALA  HA      2.80  1.00E+01
         H      16 ALA  QB      3.50
         H      17 PRO  QD      4.50
         QB     17 PRO  QB      5.50
         QB     57 LEU  QQD     6.70
         QB     87 TYR  H       6.00
         QB     87 TYR  HA      6.00
         QB     87 TYR  QB      6.70
 17 PRO  
         QD     18 ALA  H       4.50
         QD     19 LEU  H       4.50
         QD     19 LEU  QB      6.00
         QD     20 VAL  QQG     7.50
 18 ALA  
         H      18 ALA  HA      2.80  1.00E+01
         H      18 ALA  QB      3.70
         H      19 LEU  H       2.80  1.00E+01
         H      20 VAL  H       4.50  1.00E+01
         H      20 VAL  QQG     6.70
         H      21 ALA  QB      6.00
         H      87 TYR  HA      6.00
         H      87 TYR  QB      6.70
         HA     19 LEU  H       3.50  1.00E+01
         HA     21 ALA  H       3.50  1.00E+01
         HA     21 ALA  QB      4.50  1.00E+01
         HA     22 ALA  H       4.50  1.00E+01
         QB     19 LEU  H       3.50
         QB     21 ALA  H       4.50
         O      22 ALA  N       3.30  1.00E+01
         O      22 ALA  H       2.30  1.00E+01
 19 LEU  
         H      19 LEU  QB      3.70
         H      19 LEU  QQD     6.70
         H      20 VAL  H       2.80  1.00E+01
         HA     20 VAL  H       3.50  1.00E+01
         HA     22 ALA  H       3.50  1.00E+01
         HA     22 ALA  QB      4.50  1.00E+01
         QB     20 VAL  H       4.50
         HG     20 VAL  H       5.00
         HG     54 LEU  QQD     6.70
         QQD    20 VAL  H       6.70
         QQD    22 ALA  H       6.70
         QQD    22 ALA  QB      6.70
         QQD    23 PHE  H       6.70
         QQD    51 GLN  QG      6.70
         QQD    54 LEU  QQD     6.70
         O      23 PHE  N       3.30  1.00E+01
         O      23 PHE  H       2.30  1.00E+01
 20 VAL  
         H      20 VAL  HA      2.80  1.00E+01
         H      20 VAL  HB      2.80
         H      21 ALA  H       2.80  1.00E+01
         HA     21 ALA  H       3.50  1.00E+01
         HA     23 PHE  H       3.50  1.00E+01
         HA     24 GLY  H       5.50
         HB     21 ALA  H       4.50
         QQG    21 ALA  H       5.50
         QQG    21 ALA  HA      4.50
         QQG    23 PHE  QB      6.70
         QQG    25 GLY  H       7.70
         QQG    84 MET  HA      6.70
         QQG    84 MET  QB      6.70
         QQG    87 TYR  QB      6.70
         O      24 GLY  N       3.30  1.00E+01
         O      24 GLY  H       2.30  1.00E+01
 21 ALA  
         H      21 ALA  HA      2.80  1.00E+01
         HA     22 ALA  H       3.50  1.00E+01
         HA     24 GLY  H       3.50  1.00E+01
         HA     25 GLY  H       4.50
         HA     25 GLY  QA      6.50
         QB     22 ALA  H       5.50
         QB     22 ALA  HA      5.50
         O      25 GLY  N       3.30  1.00E+01
         O      25 GLY  H       2.30  1.00E+01
 22 ALA  
         H      22 ALA  HA      2.80  1.00E+01
         H      22 ALA  QB      3.50
         H      23 PHE  H       2.80  1.00E+01
         HA     23 PHE  H       3.50  1.00E+01
         HA     24 GLY  H       4.50
         HA     50 ASP  H       5.50
         HA     50 ASP  QB      5.50
         QB     23 PHE  H       3.50
         QB     23 PHE  QB      5.50
         QB     50 ASP  QB      5.50
         QB     54 LEU  H       5.50
         QB     54 LEU  HA      5.50
         QB     54 LEU  QB      6.70
         QB     54 LEU  HG      5.50
         QB     54 LEU  QQD     6.70
 23 PHE  
         H      23 PHE  HA      2.80  1.00E+01
         H      23 PHE  QB      3.50
         H      24 GLY  H       2.80  1.00E+01
         H      49 VAL  QQG     6.70
         H      51 GLN  HA      5.50
         HA     23 PHE  QR      4.50
         HA     24 GLY  H       3.50
         HA     26 LYS  H       3.50
         HA     43 VAL  QQG     6.70
         HA     49 VAL  HA      5.50
         HA     49 VAL  QQG     6.70
         QR     45 ASP  H       6.70
         QR     49 VAL  QQG     6.70
         QR     51 GLN  QG      6.70
         QR     54 LEU  QQD     6.70
 24 GLY  
         H      25 GLY  H       2.80
         QA     26 LYS  QB      6.50
         QA     39 LEU  QB      6.50
 25 GLY  
         H      26 LYS  QG      4.50
         QA     26 LYS  H       3.50
         QA     26 LYS  QG      5.50
 26 LYS  
         H      26 LYS  HA      2.80
         H      26 LYS  QB      3.50
         H      26 LYS  HG2     3.50
         H      26 LYS  HG1     2.80
         H      26 LYS  HD1     2.80
         H      27 GLU  H       3.50  1.00E+01
         HA     26 LYS  HG2     3.50
         HA     26 LYS  HG1     3.50
         HA     26 LYS  HD1     4.50
         HA     27 GLU  H       3.50
         HA     28 ASN  H       4.50
         QB     27 GLU  H       5.50
         QG     27 GLU  H       5.50
         QD     27 GLU  H       5.50
         QE     45 ASP  QB      5.50
 27 GLU  
         H      27 GLU  HA      2.80
         H      27 GLU  QB      3.70
         H      27 GLU  QG      5.50
         H      28 ASN  H       2.80  1.00E+01
         HA     27 GLU  QG      3.50
         HA     28 ASN  H       3.50
         QB     28 ASN  H       4.00
         QG     28 ASN  QB      4.50
 28 ASN  
         H      28 ASN  HA      2.80
         H      28 ASN  QB      2.80
         H      29 ILE  H       2.80  1.00E+01
         HA     29 ILE  H       3.50
         QB     29 ILE  H       4.50
 29 ILE  
         H      29 ILE  HB      2.80
         H      29 ILE  HG12    4.50
         H      29 ILE  QD1     3.50
         H      43 VAL  HB      5.50
         H      43 VAL  QQG     6.70
         HA     29 ILE  HB      2.80
         HA     29 ILE  QG2     3.50
         HA     29 ILE  QD1     3.50
         HA     30 THR  H       2.50
         HA     31 ASN  H       4.50
         HA     41 VAL  QQG     6.70
         HA     43 VAL  HA      5.50
         HA     43 VAL  QQG     6.70
         HB     29 ILE  QD1     3.50
         QG2    30 THR  H       4.50
         QG2    31 ASN  H       4.50
         QG2    41 VAL  QQG     6.70
         QG1    31 ASN  H       5.50
         QD1    41 VAL  QQG     6.70
 30 THR  
         H      30 THR  HB      3.50
         H      30 THR  QG2     3.50
         H      31 ASN  H       2.80
         H      43 VAL  H       5.50
         H      43 VAL  HA      3.50  1.00E+01
         HA     30 THR  HB      2.50
         HA     30 THR  QG2     3.50
         HA     43 VAL  QQG     6.70
         HB     43 VAL  HB      5.50
         HB     43 VAL  QQG     6.70
 31 ASN  
         N      42 SER  O       3.30  1.00E+01
         H      31 ASN  HA      2.80
         H      32 LEU  QQD     6.70
         H      41 VAL  QQG     6.70
         H      42 SER  H       3.50  1.00E+01
         H      42 SER  QB      5.50
         H      42 SER  O       2.30  1.00E+01
         H      43 VAL  QQG     6.70
         HA     32 LEU  H       2.50  1.00E+01
         HA     32 LEU  QB      4.50
         QB     42 SER  H       5.50
         QB     42 SER  QB      5.50
         O      42 SER  N       3.30  1.00E+01
         O      42 SER  H       2.30  1.00E+01
 32 LEU  
         H      32 LEU  QB      3.50
         H      32 LEU  QQD     6.70
         HA     33 ASP  H       2.50  1.00E+01
         HA     41 VAL  HA      2.50  1.00E+01
         HA     41 VAL  QQG     6.70
         HA     42 SER  H       3.50  1.00E+01
         QB     33 ASP  H       5.00
         QB     33 ASP  HA      5.00
         QB     40 ARG  H       5.50
         HG     41 VAL  QQG     6.70
         QQD    33 ASP  H       6.70
         QQD    40 ARG  QB      6.70
         QQD    41 VAL  HA      6.70
         QQD    41 VAL  HB      6.70
         QQD    41 VAL  QQG     6.70
 33 ASP  
         N      40 ARG  O       3.30  1.00E+01
         H      33 ASP  HA      2.80
         H      33 ASP  QB      3.50
         H      40 ARG  H       3.50  1.00E+01
         H      40 ARG  O       2.30  1.00E+01
         H      41 VAL  HA      3.50  1.00E+01
         H      41 VAL  QQG     6.70
         HA     34 ALA  H       2.50  1.00E+01
         QB     34 ALA  H       4.50
         O      40 ARG  N       3.30  1.00E+01
         O      40 ARG  H       2.30  1.00E+01
 34 ALA  
         H      34 ALA  HA      2.80
         H      34 ALA  QB      3.50
         HA     35 CYS  H       2.50  1.00E+01
         HA     39 LEU  HA      2.50  1.00E+01
         HA     40 ARG  H       3.50  1.00E+01
         QB     35 CYS  H       3.50
         QB     39 LEU  HA      4.50
         QB     39 LEU  QB      5.50
         QB     40 ARG  H       5.50
 35 CYS  
         N      38 ARG  O       3.30  1.00E+01
         H      38 ARG  H       3.50  1.00E+01
         H      38 ARG  O       2.30  1.00E+01
         H      39 LEU  HA      3.50  1.00E+01
         HA     36 ILE  H       3.60
         QB     36 ILE  H       2.80
         QB     39 LEU  HA      4.50
         O      38 ARG  N       3.30  1.00E+01
         O      38 ARG  H       2.30  1.00E+01
 36 ILE  
         HA     36 ILE  QG2     3.50
         HA     36 ILE  QD1     4.00
         HB     38 ARG  H       5.00
         QG2    37 THR  H       4.50
         QG1    37 THR  H       5.50
         QG1    38 ARG  H       4.50
         QD1    38 ARG  QB      5.50
 37 THR  
         HA     39 LEU  HG      5.50
         O      73 PHE  N       3.30  1.00E+01
         O      73 PHE  H       2.30  1.00E+01
 38 ARG  
         H      39 LEU  H       4.50
         HA     39 LEU  H       2.50  1.00E+01
         HA     71 ALA  QB      5.50
         HA     72 ILE  HA      2.50  1.00E+01
         HA     72 ILE  QG1     5.50
         HA     73 PHE  H       3.50  1.00E+01
 39 LEU  
         N      71 ALA  O       3.30  1.00E+01
         H      39 LEU  QB      3.50
         H      39 LEU  HG      3.50
         H      39 LEU  QQD     6.70
         H      71 ALA  H       3.50  1.00E+01
         H      71 ALA  QB      5.50
         H      71 ALA  O       2.30  1.00E+01
         HA     39 LEU  HG      3.50
         HA     40 ARG  H       2.50  1.00E+01
         QB     41 VAL  QQG     6.70
         QB     71 ALA  H       5.50
         QB     71 ALA  QB      5.50
         HG     41 VAL  QQG     6.70
         QQD    40 ARG  H       6.70
         QQD    41 VAL  QQG     6.70
         QQD    71 ALA  QB      6.70
         QQD    72 ILE  HA      6.70
         O      71 ALA  N       3.30  1.00E+01
         O      71 ALA  H       2.30  1.00E+01
 40 ARG  
         H      40 ARG  QG      3.70
         HA     41 VAL  H       2.50  1.00E+01
         HA     70 GLN  HA      2.50  1.00E+01
         HA     71 ALA  H       3.50  1.00E+01
         HA     71 ALA  HA      2.50  1.00E+01
         HA     71 ALA  QB      5.50
 41 VAL  
         N      69 VAL  O       3.30  1.00E+01
         H      41 VAL  HB      2.80
         H      43 VAL  QQG     6.70
         H      69 VAL  H       3.50  1.00E+01
         H      69 VAL  QQG     6.70
         H      69 VAL  O       2.30  1.00E+01
         H      70 GLN  HA      3.50  1.00E+01
         HA     42 SER  H       2.50  1.00E+01
         HB     69 VAL  H       4.50
         HB     69 VAL  HB      4.50
         QQG    42 SER  H       6.70
         QQG    43 VAL  H       6.70
         QQG    43 VAL  HB      6.70
         O      69 VAL  N       3.30  1.00E+01
         O      69 VAL  H       2.30  1.00E+01
 42 SER  
         H      42 SER  QB      3.50
         H      43 VAL  QQG     5.50
         HA     43 VAL  H       2.50  1.00E+01
         HA     43 VAL  QQG     6.70
         HA     68 GLY  QA      4.00
         HA     69 VAL  H       3.50  1.00E+01
         QB     43 VAL  H       4.50
 43 VAL  
         H      43 VAL  QQG     3.80
         H      68 GLY  QA      4.50
         HA     43 VAL  HB      2.80
         HA     44 ALA  H       3.50
         HA     44 ALA  QB      5.50
         HB     44 ALA  H       2.80
         HB     45 ASP  H       5.50
         QQG    44 ALA  H       6.70
         QQG    45 ASP  H       6.70
         QQG    46 VAL  H       6.70
         QQG    46 VAL  HA      6.70
         QQG    46 VAL  HB      6.70
         QQG    68 GLY  QA      6.70
         QQG    69 VAL  H       6.70
 44 ALA  
         H      44 ALA  HA      2.80
         H      44 ALA  QB      3.50
         H      45 ASP  H       3.50
         H      45 ASP  QB      5.50
         HA     46 VAL  QQG     6.70
         QB     45 ASP  HA      4.50
         QB     45 ASP  QB      6.50
         QB     46 VAL  QQG     6.70
 45 ASP  
         H      45 ASP  HA      2.80
         H      45 ASP  QB      3.50
         HA     46 VAL  H       2.80
         HA     46 VAL  QQG     6.00
         HA     47 SER  H       4.50
         QB     46 VAL  HB      5.50
         QB     49 VAL  QQG     6.70
 46 VAL  
         H      46 VAL  HA      3.50
         H      46 VAL  HB      3.50
         H      47 SER  H       3.50
         HA     46 VAL  HB      2.80
         HA     47 SER  QB      5.50
         HA     49 VAL  H       5.00
         HA     49 VAL  HB      4.50
         HA     49 VAL  QQG     6.70
         QQG    47 SER  H       6.70
         QQG    47 SER  HA      6.70
         QQG    47 SER  QB      6.70
 47 SER  
         H      47 SER  HA      2.80
         H      47 SER  QB      3.70
         H      48 LYS  H       3.50
 48 LYS  
         H      48 LYS  HA      2.80
         H      48 LYS  QG      4.50
         H      48 LYS  QD      3.50
         H      49 VAL  H       2.80
         H      49 VAL  QQG     6.70
         HA     48 LYS  QD      3.50
         QB     49 VAL  H       5.50
         QB     49 VAL  HA      5.50
         QG     50 ASP  H       6.00
         QD     49 VAL  H       6.00
         QD     49 VAL  HA      5.50
 49 VAL  
         H      49 VAL  HA      2.80
         H      49 VAL  HB      2.80
         HA     49 VAL  HB      2.80
         HA     50 ASP  H       2.80
         QQG    48 LYS  H       6.70
         QQG    50 ASP  H       6.70
         QQG    50 ASP  HA      6.70
         QQG    51 GLN  H       6.70
         QQG    51 GLN  HA      6.70
         QQG    51 GLN  QG      6.70
         QQG    53 GLY  H       6.70
         QQG    54 LEU  QQD     6.70
         QQG    64 VAL  QQG     6.70
 50 ASP  
         H      50 ASP  QB      2.80
         HA     51 GLN  H       2.80
         HA     51 GLN  HG1     4.50
         HA     52 ALA  QB      5.50
 51 GLN  
         H      51 GLN  HA      2.80
         H      51 GLN  QB      2.80
         H      51 GLN  QG      3.50
         HA     51 GLN  QG      3.50
         HA     52 ALA  H       3.50
         HA     52 ALA  QB      5.50
         HA     54 LEU  HG      5.00
         QB     52 ALA  H       3.50
         QB     55 LYS  QD      6.00
         HG1    54 LEU  H       5.50
         QG     54 LEU  H       5.50
 52 ALA  
         H      52 ALA  HA      2.80
         H      52 ALA  QB      3.50
         H      53 GLY  H       2.80
         HA     54 LEU  H       4.50
         HA     55 LYS  H       4.50
         HA     55 LYS  QB      4.50
         HA     55 LYS  QD      4.50
         HA     56 LYS  H       4.50
         HA     56 LYS  QD      5.50
         HA     64 VAL  QQG     6.70
         QB     53 GLY  QA      5.50
 53 GLY  
         H      54 LEU  H       2.80
         QA     54 LEU  HA      4.50
         QA     54 LEU  QB      5.50
         QA     56 LYS  H       4.50
         QA     56 LYS  QB      6.00
         O      57 LEU  N       3.30
         O      57 LEU  H       2.30
 54 LEU  
         H      54 LEU  HA      2.80
         H      54 LEU  QB      2.80
         H      54 LEU  HG      4.00
         H      54 LEU  QQD     6.70
         H      55 LYS  H       2.80
         HA     54 LEU  HG      2.80
         HA     55 LYS  H       3.50
         HA     57 LEU  H       3.50
         HA     57 LEU  QB      4.50
         HA     57 LEU  QQD     6.70
         QB     55 LYS  H       4.50
         QB     58 GLY  QA      4.50
         HG     57 LEU  QB      5.50
         HG     57 LEU  QQD     6.70
         HG     58 GLY  QA      3.50
         QQD    55 LYS  H       6.70
         QQD    57 LEU  QQD     7.20
         QQD    58 GLY  QA      7.20
         QQD    62 VAL  QQG     7.20
         QQD    71 ALA  QB      7.20
         O      58 GLY  N       3.30
         O      58 GLY  H       2.30
 55 LYS  
         H      55 LYS  HA      2.80
         H      55 LYS  QB      3.50
         H      55 LYS  QG      4.50
         H      56 LYS  H       2.80
         HA     55 LYS  QG      3.50
         HA     56 LYS  H       3.50
         HA     58 GLY  H       3.50
         HA     59 ALA  QB      6.00
         QB     56 LYS  H       5.50
         QB     59 ALA  QB      6.50
         HG1    56 LYS  H       4.50
         QD     56 LYS  QG      5.50
         O      59 ALA  N       3.30
         O      59 ALA  H       2.30
 56 LYS  
         H      56 LYS  HA      2.80
         H      56 LYS  QB      3.50
         H      56 LYS  HG2     3.50
         H      56 LYS  QD      5.50
         H      57 LEU  H       2.80
         HA     56 LYS  QG      3.80
         HA     57 LEU  H       3.50
         HA     58 GLY  H       4.50
         HA     59 ALA  H       4.50
         QB     56 LYS  QE      3.50
         QB     57 LEU  H       4.50
         HG2    57 LEU  QB      4.00
 57 LEU  
         H      57 LEU  HA      2.80
         H      57 LEU  QB      2.80
         H      57 LEU  QQD     6.70
         H      58 GLY  H       2.80
         HA     57 LEU  HG      3.50
         HA     58 GLY  H       3.50
         HA     59 ALA  H       5.50
         QQD    80 LEU  HA      6.70
         QQD    84 MET  QG      7.20
 58 GLY  
         H      59 ALA  H       2.80
         QA     62 VAL  QQG     6.70
         QA     84 MET  QG      5.50
 59 ALA  
         H      59 ALA  HA      2.80
         H      59 ALA  QB      3.50
         H      61 GLY  H       4.50
         HA     60 ALA  H       3.50
         HA     60 ALA  QB      4.50
         HA     61 GLY  H       4.50
         HA     73 PHE  HA      4.50
         QB     60 ALA  H       3.50
         QB     60 ALA  HA      4.50
         QB     61 GLY  H       3.50
         QB     62 VAL  HB      4.50
         QB     62 VAL  QQG     5.06
         QB     72 ILE  H       5.50
         QB     73 PHE  H       6.40
         QB     73 PHE  HA      5.40
 60 ALA  
         H      60 ALA  HA      2.80
         H      60 ALA  QB      3.50
         H      61 GLY  H       3.50
         H      61 GLY  QA      5.50
         H      72 ILE  HB      5.50
         H      72 ILE  QG2     5.50
         H      73 PHE  HA      5.50
         H      73 PHE  QB      5.50
         H      80 LEU  QQD     6.70
         HA     61 GLY  H       2.50  1.00E+01
         HA     73 PHE  HA      2.50  1.00E+01
         QB     61 GLY  H       4.50
         QB     72 ILE  H       5.50
         QB     72 ILE  QG2     5.50
 61 GLY  
         N      72 ILE  O       3.30  1.00E+01
         H      62 VAL  QQG     6.70
         H      71 ALA  QB      6.70
         H      72 ILE  H       3.50  1.00E+01
         H      72 ILE  HB      4.50
         H      72 ILE  O       2.30  1.00E+01
         H      73 PHE  HA      3.50  1.00E+01
         QA     62 VAL  H       3.50
         QA     62 VAL  QQG     5.50
         QA     72 ILE  QG2     5.50
         QA     72 ILE  QD1     6.70
         O      72 ILE  N       3.30  1.00E+01
         O      72 ILE  H       2.30  1.00E+01
 62 VAL  
         HA     62 VAL  HB      2.80
         HA     63 VAL  H       2.50  1.00E+01
         HA     63 VAL  QQG     6.70
         HA     71 ALA  HA      2.50
         HA     72 ILE  H       3.50  1.00E+01
         HB     64 VAL  QQG     6.70
         HB     70 GLN  QG      5.50
         HB     72 ILE  QD1     6.70
         QG1    71 ALA  QB      5.50
         QQG    63 VAL  H       6.70
         QQG    63 VAL  QQG     6.70
         QQG    69 VAL  QQG     6.70
         QQG    70 GLN  QG      7.20
         QQG    71 ALA  HA      6.70
         QQG    71 ALA  QB      6.70
         QQG    72 ILE  HB      6.70
 63 VAL  
         N      70 GLN  O       3.30  1.00E+01
         H      63 VAL  HB      3.50
         H      63 VAL  QQG     4.00
         H      70 GLN  H       3.50  1.00E+01
         H      70 GLN  QB      5.50
         H      70 GLN  O       2.30  1.00E+01
         H      71 ALA  HA      3.50  1.00E+01
         HA     63 VAL  HB      2.50
         HA     64 VAL  H       2.50
         HA     64 VAL  HB      4.50
         HB     70 GLN  QB      5.50
         QQG    64 VAL  H       6.70
         QQG    64 VAL  HA      6.70
         QQG    65 ALA  HA      6.70
         QQG    65 ALA  QB      6.70
         O      70 GLN  N       3.30  1.00E+01
         O      70 GLN  H       2.30  1.00E+01
 64 VAL  
         H      64 VAL  HB      3.50
         HA     65 ALA  H       2.50  1.00E+01
         HA     69 VAL  HA      2.50  1.00E+01
         HA     70 GLN  H       3.50  1.00E+01
         QQG    65 ALA  H       6.70
         QQG    65 ALA  HA      6.70
         QQG    66 GLY  QA      6.70
         QQG    69 VAL  HA      6.70
         QQG    69 VAL  QQG     6.70
 65 ALA  
         N      68 GLY  O       3.30  1.00E+01
         H      65 ALA  HA      2.80
         H      65 ALA  QB      3.50
         H      68 GLY  H       3.50
         H      68 GLY  O       2.30  1.00E+01
         H      69 VAL  HA      3.50  1.00E+01
         O      68 GLY  N       3.30  1.00E+01
         O      68 GLY  H       2.30  1.00E+01
 66 GLY  
         QA     67 SER  HA      4.50
 67 SER  
         H      68 GLY  H       4.50
         H      69 VAL  HA      5.50
         HA     68 GLY  H       3.50
         HA     68 GLY  QA      4.50
 68 GLY  
         QA     69 VAL  H       3.00
 69 VAL  
         H      69 VAL  HA      2.80
         H      69 VAL  HB      2.80
         HA     69 VAL  HB      2.80
         HA     70 GLN  H       2.50  1.00E+01
         HB     71 ALA  QB      5.50
         QQG    70 GLN  H       6.70
 70 GLN  
         H      70 GLN  QG      4.40
         HA     71 ALA  H       2.50  1.00E+01
         HA     71 ALA  QB      4.50
 71 ALA  
         H      71 ALA  QB      3.50
         H      72 ILE  HB      5.50
         HA     72 ILE  H       2.50  1.00E+01
         QB     72 ILE  HA      4.50
 72 ILE  
         H      72 ILE  HB      3.50
         H      72 ILE  QD1     4.50
         HA     72 ILE  QD1     4.50
         HA     73 PHE  H       2.50  1.00E+01
         HB     72 ILE  QD1     3.50
         QG2    72 ILE  QD1     4.50
         QG2    73 PHE  H       4.50
         QG2    74 GLY  H       5.50
         QG1    73 PHE  H       4.50
         QG1    74 GLY  H       4.50
 73 PHE  
         H      73 PHE  QB      3.50
         H      74 GLY  H       2.80
         QB     80 LEU  H       6.50
         QB     81 LYS  QB      6.70
 74 GLY  
         QA     76 LYS  H       5.50
 76 LYS  
         H      76 LYS  HA      2.80  1.00E+01
         H      76 LYS  QD      4.50
         H      77 SER  H       3.50  1.00E+01
         HA     79 ASN  H       3.50  1.00E+01
         HA     79 ASN  QB      3.50  1.00E+01
         QB     79 ASN  QB      6.70
         QG     77 SER  H       5.50
         QG     78 ASP  H       6.50
         O      80 LEU  N       3.30  1.00E+01
         O      80 LEU  H       2.30  1.00E+01
 77 SER  
         H      77 SER  HA      2.80  1.00E+01
         H      77 SER  QB      3.70
         H      78 ASP  H       4.50  1.00E+01
         HA     78 ASP  H       3.50  1.00E+01
         HA     80 LEU  H       3.50  1.00E+01
         HA     80 LEU  QB      3.50  1.00E+01
         O      81 LYS  N       3.30  1.00E+01
         O      81 LYS  H       2.30  1.00E+01
 78 ASP  
         H      78 ASP  HA      2.80  1.00E+01
         H      78 ASP  QB      3.50
         H      79 ASN  H       2.80  1.00E+01
         HA     79 ASN  H       3.50  1.00E+01
         HA     81 LYS  H       3.50  1.00E+01
         HA     81 LYS  QB      3.50  1.00E+01
         QB     79 ASN  H       3.50
         O      82 THR  N       3.30  1.00E+01
         O      82 THR  H       2.30  1.00E+01
 79 ASN  
         H      79 ASN  HA      2.80  1.00E+01
         H      79 ASN  QB      3.70
         H      80 LEU  H       3.50  1.00E+01
         HA     80 LEU  H       3.50  1.00E+01
         HA     82 THR  H       4.50  1.00E+01
         HA     82 THR  HB      4.50  1.00E+01
         QB     80 LEU  H       4.50
         O      83 GLU  N       3.30  1.00E+01
         O      83 GLU  H       2.30  1.00E+01
 80 LEU  
         H      80 LEU  HA      2.80  1.00E+01
         H      80 LEU  HG      3.50
         H      80 LEU  QQD     6.70
         H      81 LYS  H       2.80  1.00E+01
         HA     81 LYS  H       3.50  1.00E+01
         HA     83 GLU  H       4.50  1.00E+01
         HA     83 GLU  QB      5.50  1.00E+01
         QB     81 LYS  H       4.00
         QQD    84 MET  QG      6.70
         O      84 MET  N       3.30  1.00E+01
         O      84 MET  H       2.30  1.00E+01
 81 LYS  
         H      81 LYS  HA      2.80  1.00E+01
         H      81 LYS  QB      3.50
         H      82 THR  H       2.80  1.00E+01
         HA     81 LYS  QG      3.50
         HA     82 THR  H       3.50  1.00E+01
         HA     84 MET  H       3.50  1.00E+01
         HA     84 MET  QB      4.50  1.00E+01
         QB     82 THR  H       4.50
         QB     85 ASP  QB      6.00
         QE     82 THR  H       5.50
         O      85 ASP  N       3.30  1.00E+01
         O      85 ASP  H       2.30  1.00E+01
 82 THR  
         H      82 THR  HA      2.80  1.00E+01
         H      82 THR  HB      3.50
         H      82 THR  QG2     4.50
         H      83 GLU  H       2.80  1.00E+01
         HA     82 THR  QG2     3.50
         HA     83 GLU  H       3.50  1.00E+01
         HA     85 ASP  H       3.50  1.00E+01
         HA     85 ASP  QB      4.50  1.00E+01
         HB     83 GLU  H       3.50
         QG2    83 GLU  H       4.50
         QG2    83 GLU  QB      6.70
         QG2    84 MET  H       6.00
         QG2    85 ASP  QB      6.70
         O      86 GLU  N       3.30  1.00E+01
         O      86 GLU  H       2.30  1.00E+01
 83 GLU  
         H      83 GLU  HA      2.80  1.00E+01
         H      83 GLU  QB      3.50
         H      83 GLU  HG2     3.50
         H      84 MET  H       2.80  1.00E+01
         HA     83 GLU  QG      4.00
         HA     84 MET  H       3.50  1.00E+01
         HA     84 MET  QG      5.50
         HA     86 GLU  H       4.50  1.00E+01
         HA     86 GLU  QB      4.50  1.00E+01
         QB     87 TYR  H       5.50
         O      87 TYR  N       3.30  1.00E+01
         O      87 TYR  H       2.30  1.00E+01
 84 MET  
         H      84 MET  HA      2.80  1.00E+01
         H      84 MET  QB      3.70
         H      85 ASP  H       2.80  1.00E+01
         H      85 ASP  QB      5.00
         HA     85 ASP  H       3.50  1.00E+01
         HA     85 ASP  QB      6.00
         HA     87 TYR  H       3.50  1.00E+01
         HA     87 TYR  QB      4.50  1.00E+01
         HA     88 ILE  QD1     4.50
         QB     85 ASP  H       4.50
         O      88 ILE  N       3.30  1.00E+01
         O      88 ILE  H       2.30  1.00E+01
 85 ASP  
         H      85 ASP  HA      2.80  1.00E+01
         H      85 ASP  QB      3.70
         H      86 GLU  H       2.80  1.00E+01
         H      88 ILE  QD1     6.70
         HA     86 GLU  H       3.50  1.00E+01
         HA     86 GLU  QB      6.50
         HA     88 ILE  H       3.50  1.00E+01
         HA     88 ILE  HB      3.50  1.00E+01
         HA     88 ILE  QD1     6.70
         QB     86 GLU  H       4.50
         QB     88 ILE  QD1     6.70
         O      89 ARG  N       3.30  1.00E+01
         O      89 ARG  H       2.30  1.00E+01
 86 GLU  
         H      86 GLU  HA      2.80  1.00E+01
         H      86 GLU  QG      3.50
         H      87 TYR  H       2.80  1.00E+01
         H      88 ILE  QD1     4.50
         HA     87 TYR  H       3.50
         HA     89 ARG  H       3.50  1.00E+01
         HA     89 ARG  QB      3.50  1.00E+01
         QB     89 ARG  QB      6.00
         O      90 ASN  N       3.30  1.00E+01
         O      90 ASN  H       2.30  1.00E+01
 87 TYR  
         H      87 TYR  HA      2.80  1.00E+01
         H      87 TYR  QB      3.50
         H      88 ILE  H       2.80  1.00E+01
         H      89 ARG  H       4.50  1.00E+01
         HA     88 ILE  QD1     6.50
         HA     90 ASN  H       3.50  1.00E+01
         HA     90 ASN  QB      4.50  1.00E+01
         HA     91 PHE  H       4.50  1.00E+01
         QB     88 ILE  H       3.50
         QB     91 PHE  QB      6.70
         O      91 PHE  N       3.30  1.00E+01
         O      91 PHE  H       2.30  1.00E+01
 88 ILE  
         H      88 ILE  HA      2.80  1.00E+01
         H      88 ILE  HB      3.50
         H      88 ILE  QD1     5.50
         H      89 ARG  H       3.50  1.00E+01
         HA     88 ILE  QD1     4.50
         HA     91 PHE  H       3.50  1.00E+01
         HA     91 PHE  QB      3.50  1.00E+01
         HB     88 ILE  QD1     3.50
         HB     89 ARG  H       3.50
         HB     89 ARG  QD      5.50
         QG2    89 ARG  QG      5.50
         QD1    89 ARG  H       5.50
         QD1    89 ARG  HA      6.00
         QD1    89 ARG  QB      6.50
         O      92 GLY  N       3.30  1.00E+01
         O      92 GLY  H       2.30  1.00E+01
 89 ARG  
         H      89 ARG  HA      2.80
         H      89 ARG  QB      3.50
         H      90 ASN  H       3.50  1.00E+01
         HA     89 ARG  QG      3.50
         HA     89 ARG  QD      4.50
         HA     90 ASN  H       3.50
         QB     90 ASN  H       4.50
 90 ASN  
         H      90 ASN  HA      2.80
         H      90 ASN  QB      2.80
 91 PHE  
         H      91 PHE  HA      2.80
         HA     92 GLY  H       2.80

# DIANA distance restraints, lower limits (.lol)
 15 MET  
         H      15 MET  QG      1.80
         H      16 ALA  H       1.80
         H      91 PHE  HA      1.80
         HA     18 ALA  H       1.80
         QB     16 ALA  H       1.80
         QB     19 LEU  QD2     1.80
         QB     91 PHE  QB      1.80
 16 ALA  
         H      17 PRO  HD1     1.80
         H      17 PRO  HD2     1.80
         H      88 ILE  HB      1.80
         HA     19 LEU  QB      1.80
         HA     19 LEU  QQD     1.80
         QB     17 PRO  HD1     1.80
         QB     17 PRO  HD2     1.80
         QB     17 PRO  QD      1.80
         QB     18 ALA  H       1.80
         QB     19 LEU  HB1     1.80
         QB     83 GLU  HG1     1.80
         QB     84 MET  HA      1.80
         QB     86 GLU  HG1     1.80
         QB     87 TYR  H       1.80
         QB     87 TYR  HA      1.80
         QB     87 TYR  HB2     1.80
         QB     87 TYR  HB1     1.80
         QB     87 TYR  QB      1.80
         QB     90 ASN  HB2     1.80
 17 PRO  
         HA     19 LEU  HB1     1.80
         HD1    19 LEU  H       1.80
         HD1    90 ASN  HB2     1.80
         HD2    19 LEU  HB1     1.80
         QD     19 LEU  H       1.80
 18 ALA  
         H      19 LEU  H       1.80
         H      20 VAL  H       1.80
         H      20 VAL  QG2     1.80
         H      20 VAL  QG1     1.80
         H      21 ALA  QB      1.80
         H      51 GLN  HB1     1.80
         H      87 TYR  HA      1.80
         H      87 TYR  HB2     1.80
         H      87 TYR  QB      1.80
         H      91 PHE  QB      1.80
         HA     21 ALA  H       1.80
         HA     21 ALA  QB      1.80
         HA     22 ALA  H       1.80
         QB     19 LEU  HG      1.80
         QB     21 ALA  H       1.80
         QB     22 ALA  H       1.80
         O      22 ALA  N       2.70
         O      22 ALA  H       1.80
 19 LEU  
         H      19 LEU  QQD     1.80
         H      20 VAL  H       1.80
         H      21 ALA  QB      1.80
         HA     22 ALA  H       1.80
         HA     22 ALA  QB      1.80
         HA     87 TYR  HA      1.80
         HB2    20 VAL  H       1.80
         HB2    21 ALA  QB      1.80
         HB2    84 MET  HA      1.80
         HG     20 VAL  H       1.80
         HG     54 LEU  QD2     1.80
         QD1    51 GLN  QG      1.80
         QD1    54 LEU  QD2     1.80
         QD2    22 ALA  QB      1.80
         QQD    20 VAL  H       1.80
         QQD    22 ALA  H       1.80
         QQD    23 PHE  H       1.80
         O      23 PHE  N       2.70
         O      23 PHE  H       1.80
 20 VAL  
         H      21 ALA  H       1.80
         HA     24 GLY  H       1.80
         HA     29 ILE  HB      1.80
         HA     41 VAL  QG2     1.80
         HB     21 ALA  H       1.80
         QG2    21 ALA  H       1.80
         QG2    21 ALA  HA      1.80
         QG2    49 VAL  H       1.80
         QG2    54 LEU  QD2     1.80
         QG2    57 LEU  HB1     1.80
         QG2    57 LEU  QD2     1.80
         QG1    21 ALA  H       1.80
         QG1    25 GLY  H       1.80
         QG1    25 GLY  HA2     1.80
         QG1    57 LEU  HB1     1.80
         QG1    84 MET  HA      1.80
         QG1    84 MET  QB      1.80
         QG1    87 TYR  HB2     1.80
         QG1    87 TYR  QB      1.80
         O      24 GLY  N       2.70
         O      24 GLY  H       1.80
 21 ALA  
         H      22 ALA  H       1.80
         HA     24 GLY  H       1.80
         HA     25 GLY  H       1.80
         HA     25 GLY  QA      1.80
         QB     22 ALA  HA      1.80
         QB     22 ALA  QB      1.80
         QB     57 LEU  QD1     1.80
         QB     57 LEU  QD2     1.80
         O      25 GLY  N       2.70
         O      25 GLY  H       1.80
 22 ALA  
         H      23 PHE  H       1.80
         H      57 LEU  QD2     1.80
         HA     24 GLY  H       1.80
         HA     26 LYS  HG2     1.80
         HA     50 ASP  H       1.80
         HA     50 ASP  HB2     1.80
         HA     50 ASP  HB1     1.80
         HA     50 ASP  QB      1.80
         QB     23 PHE  HB1     1.80
         QB     50 ASP  HB2     1.80
         QB     50 ASP  HB1     1.80
         QB     50 ASP  QB      1.80
         QB     54 LEU  H       1.80
         QB     54 LEU  HA      1.80
         QB     54 LEU  HB1     1.80
         QB     54 LEU  QB      1.80
         QB     54 LEU  HG      1.80
         QB     54 LEU  QD1     1.80
         QB     54 LEU  QQD     1.80
         QB     57 LEU  QD2     1.80
 23 PHE  
         H      24 GLY  H       1.80
         HA     26 LYS  H       1.80
         HA     29 ILE  QD1     1.80
         HA     41 VAL  QG2     1.80
         HA     43 VAL  QG1     1.80
         HA     49 VAL  H       1.80
         HA     49 VAL  HA      1.80
         HA     49 VAL  QG2     1.80
         HA     49 VAL  QG1     1.80
         HB2    29 ILE  QD1     1.80
         HB2    57 LEU  QD1     1.80
         HB1    29 ILE  QD1     1.80
         HB1    54 LEU  HB1     1.80
         QB     29 ILE  QD1     1.80
         QR     45 ASP  H       1.80
 24 GLY  
         H      25 GLY  H       1.80
         QA     28 ASN  H       1.80
         QA     39 LEU  H       1.80
         QA     39 LEU  HB2     1.80
         QA     39 LEU  HB1     1.80
 25 GLY  
         H      26 LYS  HG1     1.80
         H      34 ALA  QB      1.80
         HA1    26 LYS  HG1     1.80
         HA2    26 LYS  HG1     1.80
         QA     39 LEU  QQD     1.80
 26 LYS  
         H      26 LYS  HG2     1.80
         H      26 LYS  HG1     1.80
         H      26 LYS  HD1     1.80
         H      27 GLU  H       1.80
         HA     26 LYS  HD1     1.80
         HA     28 ASN  H       1.80
         HA     29 ILE  H       1.80
         HG2    27 GLU  H       1.80
         HD1    27 GLU  H       1.80
         HD1    33 ASP  HA      1.80
 27 GLU  
         H      27 GLU  HG2     1.80
         H      27 GLU  HG1     1.80
         H      28 ASN  H       1.80
         QB     28 ASN  H       1.80
         QB     29 ILE  QD1     1.80
         HG2    28 ASN  HB2     1.80
 28 ASN  
         H      29 ILE  H       1.80
         HB2    29 ILE  H       1.80
         HB2    64 VAL  H       1.80
         HB1    56 LYS  QB      1.80
         HB1    64 VAL  H       1.80
 29 ILE  
         H      29 ILE  HG12    1.80
         H      29 ILE  QD1     1.80
         H      43 VAL  HB      1.80
         H      43 VAL  QG1     1.80
         HA     31 ASN  H       1.80
         HA     41 VAL  QG2     1.80
         HA     43 VAL  HA      1.80
         HA     43 VAL  QG2     1.80
         HA     43 VAL  QG1     1.80
         QG2    30 THR  H       1.80
         QG2    31 ASN  H       1.80
         QG2    32 LEU  HA      1.80
         QG2    41 VAL  QG2     1.80
         QG2    41 VAL  QG1     1.80
         QG1    31 ASN  H       1.80
         QD1    41 VAL  QG2     1.80
 30 THR  
         H      31 ASN  H       1.80
         H      43 VAL  H       1.80
         H      43 VAL  HA      1.80
         H      46 VAL  QG1     1.80
         HA     43 VAL  QG2     1.80
         HB     41 VAL  QG1     1.80
         HB     43 VAL  HB      1.80
         HB     43 VAL  QG2     1.80
 31 ASN  
         N      42 SER  O       2.70
         H      32 LEU  QQD     1.80
         H      41 VAL  QG2     1.80
         H      41 VAL  QG1     1.80
         H      42 SER  H       1.80
         H      42 SER  HB1     1.80
         H      42 SER  O       1.80
         H      43 VAL  QG2     1.80
         HA     32 LEU  HB1     1.80
         HA     43 VAL  QG2     1.80
         HB2    42 SER  HB1     1.80
         HB1    42 SER  H       1.80
         HB1    42 SER  HB2     1.80
         HB1    42 SER  HB1     1.80
         O      42 SER  N       2.70
         O      42 SER  H       1.80
 32 LEU  
         H      32 LEU  QQD     1.80
         H      34 ALA  QB      1.80
         HA     41 VAL  HA      1.80
         HA     41 VAL  QG2     1.80
         HA     42 SER  H       1.80
         HB2    33 ASP  H       1.80
         HB2    40 ARG  H       1.80
         HB1    33 ASP  H       1.80
         HB1    33 ASP  HA      1.80
         HG     41 VAL  QG1     1.80
         QQD    33 ASP  H       1.80
         QQD    40 ARG  QB      1.80
         QQD    41 VAL  HA      1.80
         QQD    41 VAL  HB      1.80
         QQD    41 VAL  QG2     1.80
         QQD    41 VAL  QG1     1.80
 33 ASP  
         N      40 ARG  O       2.70
         H      40 ARG  H       1.80
         H      40 ARG  O       1.80
         H      41 VAL  HA      1.80
         H      41 VAL  QG2     1.80
         QB     34 ALA  H       1.80
         O      40 ARG  N       2.70
         O      40 ARG  H       1.80
 34 ALA  
         HA     39 LEU  HA      1.80
         HA     40 ARG  H       1.80
         QB     39 LEU  HA      1.80
         QB     39 LEU  QB      1.80
         QB     40 ARG  H       1.80
         QB     41 VAL  QG2     1.80
         QB     78 ASP  HA      1.80
         QB     78 ASP  QB      1.80
 35 CYS  
         N      38 ARG  O       2.70
         H      38 ARG  H       1.80
         H      38 ARG  O       1.80
         H      39 LEU  HA      1.80
         HB2    36 ILE  H       1.80
         HB1    39 LEU  HA      1.80
         O      38 ARG  N       2.70
         O      38 ARG  H       1.80
 36 ILE  
         HA     74 GLY  HA2     1.80
         HB     38 ARG  H       1.80
         QG2    37 THR  H       1.80
         QG2    58 GLY  H       1.80
         QG2    72 ILE  QG1     1.80
         QG1    37 THR  H       1.80
         QG1    38 ARG  H       1.80
         QD1    38 ARG  QB      1.80
 37 THR  
         HA     39 LEU  HG      1.80
         O      73 PHE  N       2.70
         O      73 PHE  H       1.80
 38 ARG  
         H      39 LEU  H       1.80
         HA     71 ALA  QB      1.80
         HA     72 ILE  HA      1.80
         HA     72 ILE  QG1     1.80
         HA     73 PHE  H       1.80
 39 LEU  
         N      71 ALA  O       2.70
         H      39 LEU  HG      1.80
         H      39 LEU  QQD     1.80
         H      71 ALA  H       1.80
         H      71 ALA  QB      1.80
         H      71 ALA  O       1.80
         QB     41 VAL  QG1     1.80
         QB     71 ALA  H       1.80
         HG     41 VAL  QG1     1.80
         QQD    40 ARG  H       1.80
         QQD    41 VAL  QG1     1.80
         QQD    71 ALA  QB      1.80
         QQD    72 ILE  HA      1.80
         O      71 ALA  N       2.70
         O      71 ALA  H       1.80
 40 ARG  
         H      40 ARG  QG      1.80
         HA     70 GLN  HA      1.80
         HA     71 ALA  H       1.80
         HA     71 ALA  HA      1.80
         HA     71 ALA  QB      1.80
 41 VAL  
         N      69 VAL  O       2.70
         H      43 VAL  HB      1.80
         H      43 VAL  QG2     1.80
         H      49 VAL  QG2     1.80
         H      69 VAL  H       1.80
         H      69 VAL  QG1     1.80
         H      69 VAL  O       1.80
         H      70 GLN  HA      1.80
         HB     69 VAL  H       1.80
         HB     69 VAL  HB      1.80
         QG2    42 SER  H       1.80
         QG2    43 VAL  H       1.80
         QG2    43 VAL  HB      1.80
         QG1    42 SER  H       1.80
         QG1    44 ALA  H       1.80
         O      69 VAL  N       2.70
         O      69 VAL  H       1.80
 42 SER  
         H      43 VAL  QG2     1.80
         H      43 VAL  QG1     1.80
         HA     43 VAL  QG2     1.80
         HA     59 ALA  QB      1.80
         HA     68 GLY  HA1     1.80
         HA     68 GLY  HA2     1.80
         HA     69 VAL  H       1.80
         HB2    43 VAL  H       1.80
 43 VAL  
         H      68 GLY  QA      1.80
         HA     44 ALA  QB      1.80
         HB     44 ALA  H       1.80
         HB     44 ALA  QB      1.80
         HB     45 ASP  H       1.80
         QG2    44 ALA  H       1.80
         QG2    46 VAL  H       1.80
         QG1    44 ALA  H       1.80
         QG1    45 ASP  H       1.80
         QG1    46 VAL  HA      1.80
         QG1    46 VAL  HB      1.80
         QG1    49 VAL  QG2     1.80
         QQG    69 VAL  H       1.80
 44 ALA  
         H      45 ASP  H       1.80
         HA     46 VAL  QG1     1.80
         QB     45 ASP  HA      1.80
         QB     45 ASP  HB2     1.80
         QB     45 ASP  HB1     1.80
         QB     45 ASP  QB      1.80
         QB     46 VAL  QG1     1.80
 45 ASP  
         HA     46 VAL  QG2     1.80
         HA     46 VAL  QG1     1.80
         HA     47 SER  H       1.80
         HB2    46 VAL  HB      1.80
         HB2    49 VAL  QG2     1.80
 46 VAL  
         H      47 SER  H       1.80
         HA     49 VAL  HB      1.80
         HA     49 VAL  QG2     1.80
         QG2    47 SER  H       1.80
         QG2    47 SER  QB      1.80
         QG1    47 SER  H       1.80
         QG1    47 SER  HA      1.80
 47 SER  
         H      48 LYS  H       1.80
 48 LYS  
         H      48 LYS  QG      1.80
         H      48 LYS  QD      1.80
         H      49 VAL  H       1.80
         H      49 VAL  QG2     1.80
         H      49 VAL  QG1     1.80
         HA     48 LYS  QD      1.80
         QB     49 VAL  HA      1.80
         QG     50 ASP  H       1.80
         QD     49 VAL  H       1.80
         QD     49 VAL  HA      1.80
 49 VAL  
         QG2    50 ASP  H       1.80
         QG2    50 ASP  HA      1.80
         QG2    51 GLN  H       1.80
         QG2    51 GLN  HA      1.80
         QG2    51 GLN  QG      1.80
         QG2    54 LEU  HG      1.80
         QG1    50 ASP  H       1.80
         QG1    51 GLN  HA      1.80
         QG1    51 GLN  HG2     1.80
         QG1    53 GLY  H       1.80
         QG1    54 LEU  QD1     1.80
 50 ASP  
         HA     51 GLN  HG1     1.80
         HA     52 ALA  QB      1.80
 51 GLN  
         H      51 GLN  HG2     1.80
         H      51 GLN  HG1     1.80
         HA     52 ALA  QB      1.80
         HA     54 LEU  HG      1.80
         HA     54 LEU  QD1     1.80
         HA     54 LEU  QD2     1.80
         HB2    52 ALA  H       1.80
         HB1    52 ALA  H       1.80
         HG1    54 LEU  H       1.80
         QG     54 LEU  H       1.80
 52 ALA  
         H      53 GLY  H       1.80
         H      53 GLY  HA1     1.80
         HA     54 LEU  H       1.80
         HA     55 LYS  H       1.80
         HA     55 LYS  QB      1.80
         HA     55 LYS  QD      1.80
         HA     56 LYS  H       1.80
         HA     56 LYS  QD      1.80
         HA     64 VAL  QQG     1.80
         QB     53 GLY  QA      1.80
 53 GLY  
         H      54 LEU  H       1.80
         HA1    54 LEU  HB2     1.80
         HA2    54 LEU  HB2     1.80
         HA2    56 LYS  QB      1.80
         QA     54 LEU  HA      1.80
         QA     54 LEU  QB      1.80
         QA     56 LYS  H       1.80
         QA     58 GLY  H       1.80
         O      57 LEU  N       2.70
         O      57 LEU  H       1.80
 54 LEU  
         H      54 LEU  HG      1.80
         H      54 LEU  QD1     1.80
         H      55 LYS  H       1.80
         H      55 LYS  HA      1.80
         HA     57 LEU  H       1.80
         HA     57 LEU  HB2     1.80
         HA     57 LEU  QB      1.80
         HA     57 LEU  QD2     1.80
         HB2    55 LYS  H       1.80
         HB1    55 LYS  H       1.80
         HG     57 LEU  QB      1.80
         HG     57 LEU  QD1     1.80
         HG     57 LEU  QD2     1.80
         HG     58 GLY  QA      1.80
         QD1    55 LYS  H       1.80
         QD1    59 ALA  HA      1.80
         QD1    71 ALA  QB      1.80
         QD2    58 GLY  HA2     1.80
         QD2    62 VAL  QQG     1.80
         O      58 GLY  N       2.70
         O      58 GLY  H       1.80
 55 LYS  
         H      55 LYS  HG2     1.80
         H      55 LYS  HG1     1.80
         H      56 LYS  H       1.80
         H      56 LYS  HA      1.80
         HA     58 GLY  H       1.80
         HA     59 ALA  QB      1.80
         QB     59 ALA  QB      1.80
         HG1    56 LYS  H       1.80
         QD     56 LYS  HG1     1.80
         O      59 ALA  N       2.70
         O      59 ALA  H       1.80
 56 LYS  
         H      56 LYS  HG2     1.80
         H      56 LYS  QD      1.80
         H      57 LEU  H       1.80
         HA     58 GLY  H       1.80
         HA     59 ALA  H       1.80
         QB     56 LYS  QE      1.80
         HG2    57 LEU  HB2     1.80
 57 LEU  
         H      57 LEU  QD1     1.80
         H      57 LEU  QD2     1.80
         H      58 GLY  H       1.80
         HA     59 ALA  H       1.80
 58 GLY  
         H      59 ALA  H       1.80
         HA2    62 VAL  QQG     1.80
         HA2    73 PHE  HB1     1.80
 59 ALA  
         H      61 GLY  H       1.80
         HA     60 ALA  QB      1.80
         HA     61 GLY  H       1.80
         HA     73 PHE  HA      1.80
         QB     60 ALA  HA      1.80
         QB     61 GLY  H       1.80
         QB     62 VAL  HB      1.80
         QB     62 VAL  QQG     1.80
         QB     71 ALA  HA      1.80
         QB     71 ALA  QB      1.80
         QB     72 ILE  H       1.80
         QB     73 PHE  H       1.80
         QB     73 PHE  HA      1.80
 60 ALA  
         H      61 GLY  H       1.80
         H      61 GLY  QA      1.80
         H      72 ILE  HB      1.80
         H      72 ILE  QG2     1.80
         H      73 PHE  HA      1.80
         QB     72 ILE  H       1.80
         QB     72 ILE  QG2     1.80
 61 GLY  
         N      72 ILE  O       2.70
         H      62 VAL  QQG     1.80
         H      71 ALA  QB      1.80
         H      72 ILE  H       1.80
         H      72 ILE  HB      1.80
         H      72 ILE  O       1.80
         QA     62 VAL  QQG     1.80
         QA     72 ILE  QG2     1.80
         QA     72 ILE  QD1     1.80
         O      72 ILE  N       2.70
         O      72 ILE  H       1.80
 62 VAL  
         HA     63 VAL  QQG     1.80
         HA     64 VAL  HA      1.80
         HA     69 VAL  HB      1.80
         HA     69 VAL  QG2     1.80
         HA     71 ALA  HA      1.80
         HA     72 ILE  H       1.80
         HB     64 VAL  QQG     1.80
         HB     70 GLN  QG      1.80
         HB     72 ILE  QD1     1.80
         QG1    71 ALA  QB      1.80
         QQG    63 VAL  H       1.80
         QQG    63 VAL  QQG     1.80
         QQG    69 VAL  QG2     1.80
         QQG    70 GLN  QG      1.80
         QQG    71 ALA  HA      1.80
         QQG    71 ALA  QB      1.80
         QQG    72 ILE  HB      1.80
         QQG    73 PHE  QB      1.80
 63 VAL  
         N      70 GLN  O       2.70
         H      70 GLN  H       1.80
         H      70 GLN  QB      1.80
         H      70 GLN  O       1.80
         H      71 ALA  HA      1.80
         HA     64 VAL  HB      1.80
         HB     70 GLN  QB      1.80
         QQG    64 VAL  H       1.80
         QQG    64 VAL  HA      1.80
         QQG    65 ALA  HA      1.80
         QQG    65 ALA  QB      1.80
         O      70 GLN  N       2.70
         O      70 GLN  H       1.80
 64 VAL  
         HA     69 VAL  HA      1.80
         HA     70 GLN  H       1.80
         QQG    65 ALA  H       1.80
         QQG    65 ALA  HA      1.80
         QQG    66 GLY  HA2     1.80
         QQG    69 VAL  HA      1.80
         QQG    69 VAL  QG2     1.80
 65 ALA  
         N      68 GLY  O       2.70
         H      68 GLY  H       1.80
         H      68 GLY  O       1.80
         H      69 VAL  HA      1.80
         O      68 GLY  N       2.70
         O      68 GLY  H       1.80
 66 GLY  
         HA1    67 SER  HA      1.80
 67 SER  
         H      68 GLY  H       1.80
         H      69 VAL  HA      1.80
         HA     68 GLY  HA1     1.80
 69 VAL  
         HB     71 ALA  QB      1.80
         QG2    70 GLN  H       1.80
         QG1    70 GLN  H       1.80
 70 GLN  
         H      70 GLN  QG      1.80
         H      71 ALA  HA      1.80
         HA     71 ALA  QB      1.80
         HA     72 ILE  HB      1.80
 71 ALA  
         H      72 ILE  HB      1.80
         QB     72 ILE  HA      1.80
 72 ILE  
         H      72 ILE  QD1     1.80
         QG2    73 PHE  H       1.80
         QG2    74 GLY  H       1.80
         QG1    73 PHE  H       1.80
         QG1    74 GLY  H       1.80
         QD1    74 GLY  QA      1.80
 73 PHE  
         H      74 GLY  H       1.80
         H      76 LYS  QB      1.80
         QB     74 GLY  H       1.80
 74 GLY  
         QA     76 LYS  H       1.80
 76 LYS  
         H      76 LYS  QD      1.80
         H      77 SER  H       1.80
         HA     79 ASN  H       1.80
         QB     79 ASN  QB      1.80
         QG     77 SER  H       1.80
         QG     78 ASP  H       1.80
         O      80 LEU  N       2.70
         O      80 LEU  H       1.80
 77 SER  
         H      78 ASP  H       1.80
         QB     78 ASP  H       1.80
         O      81 LYS  N       2.70
         O      81 LYS  H       1.80
 78 ASP  
         H      79 ASN  H       1.80
         HA     81 LYS  H       1.80
         HA     81 LYS  HB2     1.80
         HA     81 LYS  HB1     1.80
         QB     79 ASN  H       1.80
         O      82 THR  N       2.70
         O      82 THR  H       1.80
 79 ASN  
         H      80 LEU  H       1.80
         HA     82 THR  H       1.80
         QB     80 LEU  H       1.80
         O      83 GLU  N       2.70
         O      83 GLU  H       1.80
 80 LEU  
         H      80 LEU  HG      1.80
         H      80 LEU  QD2     1.80
         H      81 LYS  H       1.80
         HA     83 GLU  H       1.80
         HA     83 GLU  QB      1.80
         HB1    81 LYS  H       1.80
         QD2    83 GLU  HG2     1.80
         O      84 MET  N       2.70
         O      84 MET  H       1.80
 81 LYS  
         H      82 THR  H       1.80
         HA     84 MET  H       1.80
         HA     84 MET  QB      1.80
         HB2    82 THR  H       1.80
         HB2    85 ASP  QB      1.80
         HB1    82 THR  H       1.80
         QE     82 THR  H       1.80
         O      85 ASP  N       2.70
         O      85 ASP  H       1.80
 82 THR  
         H      83 GLU  H       1.80
         HA     85 ASP  H       1.80
         HA     85 ASP  QB      1.80
         HB     83 GLU  H       1.80
         QG2    83 GLU  H       1.80
         QG2    83 GLU  QB      1.80
         QG2    84 MET  H       1.80
         QG2    84 MET  QB      1.80
         QG2    85 ASP  QB      1.80
         QG2    87 TYR  H       1.80
         QG2    87 TYR  QB      1.80
         O      86 GLU  N       2.70
         O      86 GLU  H       1.80
 83 GLU  
         H      83 GLU  HG2     1.80
         H      84 MET  H       1.80
         HA     84 MET  QG      1.80
         HA     86 GLU  H       1.80
         QB     84 MET  H       1.80
         QB     87 TYR  H       1.80
         O      87 TYR  N       2.70
         O      87 TYR  H       1.80
 84 MET  
         H      85 ASP  H       1.80
         H      85 ASP  QB      1.80
         HA     85 ASP  QB      1.80
         HA     87 TYR  H       1.80
         HA     87 TYR  HB2     1.80
         HA     87 TYR  HB1     1.80
         HA     87 TYR  QB      1.80
         HA     88 ILE  QD1     1.80
         QB     85 ASP  H       1.80
         O      88 ILE  N       2.70
         O      88 ILE  H       1.80
 85 ASP  
         H      86 GLU  H       1.80
         H      88 ILE  QD1     1.80
         HA     86 GLU  QB      1.80
         HA     88 ILE  H       1.80
         HA     88 ILE  HB      1.80
         HA     88 ILE  QD1     1.80
         QB     86 GLU  H       1.80
         QB     88 ILE  QD1     1.80
         O      89 ARG  N       2.70
         O      89 ARG  H       1.80
 86 GLU  
         H      86 GLU  HG2     1.80
         H      86 GLU  HG1     1.80
         H      87 TYR  H       1.80
         H      88 ILE  QD1     1.80
         H      89 ARG  H       1.80
         HA     89 ARG  QB      1.80
         QB     87 TYR  H       1.80
         QB     89 ARG  QB      1.80
         O      90 ASN  N       2.70
         O      90 ASN  H       1.80
 87 TYR  
         H      88 ILE  H       1.80
         H      89 ARG  H       1.80
         HA     88 ILE  QD1     1.80
         HA     91 PHE  H       1.80
         HB2    88 ILE  H       1.80
         HB1    88 ILE  H       1.80
         HB1    91 PHE  QB      1.80
         O      91 PHE  N       2.70
         O      91 PHE  H       1.80
 88 ILE  
         H      88 ILE  QD1     1.80
         H      89 ARG  H       1.80
         HB     89 ARG  H       1.80
         HB     89 ARG  QD      1.80
         QG2    89 ARG  QG      1.80
         QD1    89 ARG  H       1.80
         QD1    89 ARG  HA      1.80
         QD1    89 ARG  QB      1.80
         O      92 GLY  N       2.70
         O      92 GLY  H       1.80
 89 ARG  
         H      90 ASN  H       1.80
         HA     89 ARG  QD      1.80
         HB2    90 ASN  H       1.80
         HB1    90 ASN  H       1.80


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    MET  15           H        MET  15  -0.877   7.805  11.991
    2    HA   MET  15           HA       MET  15  -0.277   9.164   9.431
    3   1HB   MET  15           HB2      MET  15   1.494   6.871  10.454
    4   2HB   MET  15           HB1      MET  15   1.881   8.221   9.347
    5   1HG   MET  15           HG2      MET  15   1.464   9.793  11.424
    6   2HG   MET  15           HG1      MET  15   1.474   8.289  12.406
    7   1HE   MET  15           HE2      MET  15   3.216  10.016  13.545
    8   2HE   MET  15           HE3      MET  15   3.736   8.325  13.859
    9   3HE   MET  15           HE1      MET  15   4.944   9.564  13.383
   10    H    ALA  16           H        ALA  16  -1.039   5.841  10.803
   11    HA   ALA  16           HA       ALA  16  -1.063   4.455   8.455
   12   1HB   ALA  16           HB1      ALA  16  -1.526   3.454  10.679
   13   2HB   ALA  16           HB2      ALA  16  -3.202   4.068  10.615
   14   3HB   ALA  16           HB3      ALA  16  -2.626   2.907   9.384
   15    HA   PRO  17           HA       PRO  17  -5.360   5.855   7.087
   16   1HB   PRO  17           HB2      PRO  17  -6.485   8.226   7.973
   17   2HB   PRO  17           HB1      PRO  17  -6.665   6.664   8.829
   18   1HG   PRO  17           HG1      PRO  17  -4.819   8.922   9.570
   19   2HG   PRO  17           HG2      PRO  17  -5.802   7.873  10.646
   20   1HD   PRO  17           HD1      PRO  17  -3.071   7.525  10.123
   21   2HD   PRO  17           HD2      PRO  17  -4.132   6.174  10.656
   22    H    ALA  18           H        ALA  18  -2.660   8.151   7.535
   23    HA   ALA  18           HA       ALA  18  -3.153   9.107   4.734
   24   1HB   ALA  18           HB1      ALA  18  -2.554  10.785   6.511
   25   2HB   ALA  18           HB2      ALA  18  -1.006   9.914   6.772
   26   3HB   ALA  18           HB3      ALA  18  -1.332  10.712   5.201
   27    H    LEU  19           H        LEU  19  -1.533   6.388   6.273
   28    HA   LEU  19           HA       LEU  19   0.912   6.756   4.779
   29   1HB   LEU  19           HB2      LEU  19   0.593   5.460   7.035
   30   2HB   LEU  19           HB1      LEU  19   0.198   4.078   5.986
   31    HG   LEU  19           HG       LEU  19   2.500   3.869   6.510
   32   1HD1  LEU  19           HD12     LEU  19   2.042   3.665   4.071
   33   2HD1  LEU  19           HD13     LEU  19   2.581   5.352   3.796
   34   3HD1  LEU  19           HD11     LEU  19   3.729   4.150   4.415
   35   1HD2  LEU  19           HD23     LEU  19   2.928   6.096   7.548
   36   2HD2  LEU  19           HD21     LEU  19   4.231   5.619   6.433
   37   3HD2  LEU  19           HD22     LEU  19   3.029   6.835   5.920
   38    H    VAL  20           H        VAL  20  -1.672   4.035   4.576
   39    HA   VAL  20           HA       VAL  20  -1.216   3.217   2.072
   40    HB   VAL  20           HB       VAL  20  -3.066   2.293   3.262
   41   1HG1  VAL  20           HG13     VAL  20  -4.576   4.957   2.743
   42   2HG1  VAL  20           HG11     VAL  20  -5.292   3.458   3.341
   43   3HG1  VAL  20           HG12     VAL  20  -4.067   4.319   4.334
   44   1HG2  VAL  20           HG23     VAL  20  -3.039   2.117   0.705
   45   2HG2  VAL  20           HG21     VAL  20  -4.667   1.971   1.423
   46   3HG2  VAL  20           HG22     VAL  20  -4.176   3.499   0.649
   47    H    ALA  21           H        ALA  21  -2.674   6.472   2.839
   48    HA   ALA  21           HA       ALA  21  -3.433   6.931   0.167
   49   1HB   ALA  21           HB1      ALA  21  -4.323   8.327   2.031
   50   2HB   ALA  21           HB2      ALA  21  -2.700   9.063   2.238
   51   3HB   ALA  21           HB3      ALA  21  -3.619   9.331   0.725
   52    H    ALA  22           H        ALA  22  -0.385   7.601   2.006
   53    HA   ALA  22           HA       ALA  22   0.967   9.200   0.291
   54   1HB   ALA  22           HB1      ALA  22   1.884   8.360   2.503
   55   2HB   ALA  22           HB2      ALA  22   2.247   6.799   1.707
   56   3HB   ALA  22           HB3      ALA  22   3.077   8.290   1.179
   57    H    PHE  23           H        PHE  23   0.168   5.848  -0.608
   58    HA   PHE  23           HA       PHE  23   1.788   6.263  -3.080
   59   1HB   PHE  23           HB2      PHE  23   3.051   4.916  -1.336
   60   2HB   PHE  23           HB1      PHE  23   1.811   3.627  -1.652
   61    HD1  PHE  23           HD1      PHE  23   3.528   5.774  -4.341
   62    HD2  PHE  23           HD2      PHE  23   3.369   1.973  -2.266
   63    HE1  PHE  23           HE1      PHE  23   5.383   4.913  -5.674
   64    HE2  PHE  23           HE2      PHE  23   4.919   1.035  -3.906
   65    HZ   PHE  23           HZ       PHE  23   5.774   2.453  -5.788
   66    H    GLY  24           H        GLY  24  -0.626   3.891  -1.515
   67   1HA   GLY  24           HA2      GLY  24  -1.820   3.299  -4.047
   68   2HA   GLY  24           HA1      GLY  24  -2.565   3.054  -2.444
   69    H    GLY  25           H        GLY  25  -2.272   6.062  -1.748
   70   1HA   GLY  25           HA2      GLY  25  -4.748   6.885  -3.174
   71   2HA   GLY  25           HA1      GLY  25  -3.968   7.767  -1.856
   72    H    LYS  26           H        LYS  26  -1.519   6.933  -4.155
   73    HA   LYS  26           HA       LYS  26  -1.593   9.734  -5.179
   74   1HB   LYS  26           HB2      LYS  26   0.402   7.480  -5.608
   75   2HB   LYS  26           HB1      LYS  26   0.620   9.197  -6.088
   76   1HG   LYS  26           HG2      LYS  26   0.405   8.049  -3.244
   77   2HG   LYS  26           HG1      LYS  26   1.923   8.440  -4.103
   78   1HD   LYS  26           HD2      LYS  26   0.266  10.839  -4.061
   79   2HD   LYS  26           HD1      LYS  26   0.188  10.125  -2.442
   80   1HE   LYS  26           HE2      LYS  26   2.980  10.034  -2.896
   81   2HE   LYS  26           HE1      LYS  26   2.497  11.490  -3.781
   82   1HZ   LYS  26           HZ2      LYS  26   1.249  12.131  -1.598
   83   2HZ   LYS  26           HZ3      LYS  26   2.136  10.815  -0.861
   84   3HZ   LYS  26           HZ1      LYS  26   2.963  12.162  -1.513
   85    H    GLU  27           H        GLU  27  -3.796   9.095  -6.248
   86    HA   GLU  27           HA       GLU  27  -3.935   6.820  -7.894
   87   1HB   GLU  27           HB2      GLU  27  -6.020   7.515  -8.643
   88   2HB   GLU  27           HB1      GLU  27  -5.867   8.504  -7.172
   89   1HG   GLU  27           HG2      GLU  27  -4.982  10.405  -8.718
   90   2HG   GLU  27           HG1      GLU  27  -5.392   9.357 -10.109
   91    H    ASN  28           H        ASN  28  -2.485  10.029  -8.537
   92    HA   ASN  28           HA       ASN  28  -2.216  10.080 -11.257
   93   1HB   ASN  28           HB2      ASN  28  -1.179  11.770  -9.743
   94   2HB   ASN  28           HB1      ASN  28  -0.060  10.539  -9.098
   95   1HD2  ASN  28           HD21     ASN  28   0.582  11.960 -12.983
   96   2HD2  ASN  28           HD22     ASN  28  -1.044  11.857 -12.410
   97    H    ILE  29           H        ILE  29  -0.666   7.707  -9.077
   98    HA   ILE  29           HA       ILE  29   1.460   6.780 -10.320
   99    HB   ILE  29           HB       ILE  29  -0.946   5.364  -9.147
  100   1HG1  ILE  29           HG12     ILE  29   0.192   5.321  -7.179
  101   2HG1  ILE  29           HG11     ILE  29   1.591   4.558  -7.909
  102   1HG2  ILE  29           HG23     ILE  29   1.246   3.726 -10.440
  103   2HG2  ILE  29           HG21     ILE  29   0.146   3.111  -9.208
  104   3HG2  ILE  29           HG22     ILE  29  -0.491   3.698 -10.771
  105   1HD1  ILE  29           HD13     ILE  29   1.226   7.586  -7.812
  106   2HD1  ILE  29           HD11     ILE  29   2.224   6.577  -6.718
  107   3HD1  ILE  29           HD12     ILE  29   2.674   6.778  -8.400
  108    H    THR  30           H        THR  30   2.280   5.732 -12.159
  109    HA   THR  30           HA       THR  30   0.542   5.848 -14.447
  110    HB   THR  30           HB       THR  30   2.958   6.476 -14.573
  111    HG1  THR  30           HG1      THR  30   1.789   5.849 -16.517
  112   1HG2  THR  30           HG21     THR  30   3.522   3.442 -14.510
  113   2HG2  THR  30           HG22     THR  30   4.665   4.742 -14.945
  114   3HG2  THR  30           HG23     THR  30   4.062   4.629 -13.280
  115    H    ASN  31           H        ASN  31   1.989   3.053 -12.531
  116    HA   ASN  31           HA       ASN  31  -0.073   1.343 -13.876
  117   1HB   ASN  31           HB2      ASN  31   2.922   0.934 -13.537
  118   2HB   ASN  31           HB1      ASN  31   1.835  -0.477 -13.612
  119   1HD2  ASN  31           HD21     ASN  31   0.905   0.037 -17.080
  120   2HD2  ASN  31           HD22     ASN  31   0.260  -0.522 -15.581
  121    H    LEU  32           H        LEU  32  -1.141  -0.155 -12.499
  122    HA   LEU  32           HA       LEU  32  -0.013  -0.626  -9.825
  123   1HB   LEU  32           HB2      LEU  32  -1.606   1.566 -10.099
  124   2HB   LEU  32           HB1      LEU  32  -2.912   0.381  -9.951
  125    HG   LEU  32           HG       LEU  32  -0.639   0.740  -7.909
  126   1HD1  LEU  32           HD12     LEU  32  -1.905   2.883  -8.023
  127   2HD1  LEU  32           HD13     LEU  32  -3.437   2.012  -7.780
  128   3HD1  LEU  32           HD11     LEU  32  -2.203   2.036  -6.488
  129   1HD2  LEU  32           HD23     LEU  32  -2.059  -1.467  -7.905
  130   2HD2  LEU  32           HD21     LEU  32  -2.014  -0.561  -6.362
  131   3HD2  LEU  32           HD22     LEU  32  -3.441  -0.460  -7.436
  132    H    ASP  33           H        ASP  33  -0.552  -2.905  -9.296
  133    HA   ASP  33           HA       ASP  33  -2.541  -4.177 -11.168
  134   1HB   ASP  33           HB2      ASP  33  -0.192  -5.514  -9.771
  135   2HB   ASP  33           HB1      ASP  33  -1.346  -6.284 -10.850
  136    H    ALA  34           H        ALA  34  -4.021  -3.132  -9.313
  137    HA   ALA  34           HA       ALA  34  -3.972  -4.305  -6.740
  138   1HB   ALA  34           HB1      ALA  34  -5.336  -2.317  -7.229
  139   2HB   ALA  34           HB2      ALA  34  -6.413  -3.296  -8.274
  140   3HB   ALA  34           HB3      ALA  34  -6.338  -3.616  -6.511
  141    H    CYS  35           H        CYS  35  -5.014  -6.265  -5.838
  142    HA   CYS  35           HA       CYS  35  -6.741  -7.833  -7.584
  143   1HB   CYS  35           HB2      CYS  35  -4.164  -8.257  -8.316
  144   2HB   CYS  35           HB1      CYS  35  -4.165  -9.245  -6.813
  145    H    ILE  36           H        ILE  36  -7.271 -10.056  -6.492
  146    HA   ILE  36           HA       ILE  36  -8.552  -9.787  -4.301
  147    HB   ILE  36           HB       ILE  36  -8.348 -12.074  -3.565
  148   1HG1  ILE  36           HG12     ILE  36  -6.065 -12.775  -3.671
  149   2HG1  ILE  36           HG11     ILE  36  -6.970 -13.789  -4.771
  150   1HG2  ILE  36           HG22     ILE  36  -9.748 -11.471  -5.574
  151   2HG2  ILE  36           HG23     ILE  36  -8.442 -12.050  -6.644
  152   3HG2  ILE  36           HG21     ILE  36  -9.232 -13.173  -5.521
  153   1HD1  ILE  36           HD13     ILE  36  -5.247 -11.422  -5.782
  154   2HD1  ILE  36           HD11     ILE  36  -4.742 -13.119  -5.670
  155   3HD1  ILE  36           HD12     ILE  36  -6.080 -12.655  -6.758
  156    H    THR  37           H        THR  37  -5.030 -10.788  -3.637
  157    HA   THR  37           HA       THR  37  -5.246  -9.024  -1.282
  158    HB   THR  37           HB       THR  37  -5.934 -11.422  -0.707
  159    HG1  THR  37           HG1      THR  37  -4.733 -11.222   1.221
  160   1HG2  THR  37           HG21     THR  37  -2.936 -12.016  -1.249
  161   2HG2  THR  37           HG22     THR  37  -4.039 -13.044  -0.307
  162   3HG2  THR  37           HG23     THR  37  -4.341 -12.775  -2.043
  163    H    ARG  38           H        ARG  38  -4.088  -8.664  -3.964
  164    HA   ARG  38           HA       ARG  38  -1.287  -8.339  -3.151
  165   1HB   ARG  38           HB2      ARG  38  -1.117 -10.467  -4.146
  166   2HB   ARG  38           HB1      ARG  38  -2.341 -10.131  -5.373
  167   1HG   ARG  38           HG2      ARG  38   0.286  -8.553  -5.377
  168   2HG   ARG  38           HG1      ARG  38   0.260 -10.218  -5.996
  169   1HD   ARG  38           HD2      ARG  38  -1.948  -8.832  -7.354
  170   2HD   ARG  38           HD1      ARG  38  -0.583  -7.772  -7.345
  171    HE   ARG  38           HE       ARG  38   0.628  -9.155  -8.742
  172   1HH1  ARG  38           HH12     ARG  38  -2.233 -11.010  -7.545
  173   2HH1  ARG  38           HH11     ARG  38  -1.943 -12.309  -8.680
  174   1HH2  ARG  38           HH22     ARG  38   0.929 -10.901 -10.112
  175   2HH2  ARG  38           HH21     ARG  38  -0.185 -12.262 -10.096
  176    H    LEU  39           H        LEU  39  -0.724  -6.179  -3.636
  177    HA   LEU  39           HA       LEU  39  -1.955  -5.119  -6.115
  178   1HB   LEU  39           HB2      LEU  39  -2.482  -2.968  -5.095
  179   2HB   LEU  39           HB1      LEU  39  -3.278  -4.316  -4.272
  180    HG   LEU  39           HG       LEU  39  -1.159  -4.065  -2.579
  181   1HD1  LEU  39           HD12     LEU  39  -0.271  -2.044  -3.956
  182   2HD1  LEU  39           HD13     LEU  39  -1.722  -1.154  -3.458
  183   3HD1  LEU  39           HD11     LEU  39  -0.559  -1.704  -2.219
  184   1HD2  LEU  39           HD22     LEU  39  -3.697  -2.296  -2.465
  185   2HD2  LEU  39           HD23     LEU  39  -3.576  -3.964  -1.876
  186   3HD2  LEU  39           HD21     LEU  39  -2.631  -2.690  -1.088
  187    H    ARG  40           H        ARG  40  -0.624  -3.053  -6.858
  188    HA   ARG  40           HA       ARG  40   2.213  -3.421  -6.228
  189   1HB   ARG  40           HB2      ARG  40   1.405  -3.969  -9.132
  190   2HB   ARG  40           HB1      ARG  40   3.049  -3.937  -8.531
  191   1HG   ARG  40           HG2      ARG  40   2.557  -5.997  -7.130
  192   2HG   ARG  40           HG1      ARG  40   0.944  -6.055  -7.816
  193   1HD   ARG  40           HD2      ARG  40   1.902  -6.554 -10.005
  194   2HD   ARG  40           HD1      ARG  40   3.560  -6.150  -9.481
  195    HE   ARG  40           HE       ARG  40   2.826  -8.184  -7.720
  196   1HH1  ARG  40           HH12     ARG  40   3.120  -7.910 -11.293
  197   2HH1  ARG  40           HH11     ARG  40   3.488  -9.621 -11.460
  198   1HH2  ARG  40           HH22     ARG  40   3.368 -10.335  -8.018
  199   2HH2  ARG  40           HH21     ARG  40   3.649 -10.969  -9.641
  200    H    VAL  41           H        VAL  41   3.592  -1.643  -7.406
  201    HA   VAL  41           HA       VAL  41   1.773   0.561  -8.260
  202    HB   VAL  41           HB       VAL  41   3.643   0.745  -5.877
  203   1HG1  VAL  41           HG12     VAL  41   2.991   2.932  -6.983
  204   2HG1  VAL  41           HG13     VAL  41   1.260   2.475  -6.825
  205   3HG1  VAL  41           HG11     VAL  41   2.214   2.854  -5.383
  206   1HG2  VAL  41           HG22     VAL  41   0.643   0.207  -5.614
  207   2HG2  VAL  41           HG23     VAL  41   1.972  -0.866  -5.073
  208   3HG2  VAL  41           HG21     VAL  41   1.729   0.701  -4.294
  209    H    SER  42           H        SER  42   3.103  -0.108 -10.246
  210    HA   SER  42           HA       SER  42   5.992   0.313 -10.028
  211   1HB   SER  42           HB2      SER  42   5.417  -1.469 -11.497
  212   2HB   SER  42           HB1      SER  42   4.117  -0.559 -12.278
  213    HG   SER  42           HG       SER  42   6.015  -0.564 -13.634
  214    H    VAL  43           H        VAL  43   6.591   2.478  -9.553
  215    HA   VAL  43           HA       VAL  43   6.017   4.376 -11.766
  216    HB   VAL  43           HB       VAL  43   5.076   6.009 -10.213
  217   1HG1  VAL  43           HG12     VAL  43   3.558   4.097 -11.071
  218   2HG1  VAL  43           HG13     VAL  43   3.701   3.346  -9.464
  219   3HG1  VAL  43           HG11     VAL  43   3.008   4.972  -9.660
  220   1HG2  VAL  43           HG23     VAL  43   6.485   5.446  -8.127
  221   2HG2  VAL  43           HG21     VAL  43   4.742   5.599  -7.819
  222   3HG2  VAL  43           HG22     VAL  43   5.503   3.984  -7.926
  223    H    ALA  44           H        ALA  44   7.062   6.650 -11.258
  224    HA   ALA  44           HA       ALA  44   9.722   6.186  -9.962
  225   1HB   ALA  44           HB1      ALA  44   9.743   6.813 -12.389
  226   2HB   ALA  44           HB2      ALA  44   8.874   8.326 -11.993
  227   3HB   ALA  44           HB3      ALA  44  10.519   8.045 -11.354
  228    H    ASP  45           H        ASP  45   6.687   7.593  -9.016
  229    HA   ASP  45           HA       ASP  45   7.865   9.918  -7.705
  230   1HB   ASP  45           HB2      ASP  45   5.278   8.428  -7.054
  231   2HB   ASP  45           HB1      ASP  45   5.781  10.009  -6.402
  232    H    VAL  46           H        VAL  46   9.827   8.190  -7.099
  233    HA   VAL  46           HA       VAL  46   9.202   7.259  -4.329
  234    HB   VAL  46           HB       VAL  46   9.859   5.294  -5.267
  235   1HG1  VAL  46           HG13     VAL  46  11.878   6.759  -7.062
  236   2HG1  VAL  46           HG11     VAL  46  11.711   4.983  -6.948
  237   3HG1  VAL  46           HG12     VAL  46  10.353   5.944  -7.558
  238   1HG2  VAL  46           HG23     VAL  46  11.423   5.774  -3.344
  239   2HG2  VAL  46           HG21     VAL  46  12.128   4.696  -4.564
  240   3HG2  VAL  46           HG22     VAL  46  12.626   6.408  -4.519
  241    H    SER  47           H        SER  47  10.403  10.021  -5.855
  242    HA   SER  47           HA       SER  47  12.658  10.813  -4.658
  243   1HB   SER  47           HB2      SER  47  11.222  12.380  -5.898
  244   2HB   SER  47           HB1      SER  47   9.943  12.259  -4.647
  245    HG   SER  47           HG       SER  47  11.302  14.161  -4.343
  246    H    LYS  48           H        LYS  48   9.514  10.475  -2.876
  247    HA   LYS  48           HA       LYS  48  11.057  10.094  -0.379
  248   1HB   LYS  48           HB2      LYS  48  10.235  11.971   0.836
  249   2HB   LYS  48           HB1      LYS  48  10.723  12.624  -0.745
  250   1HG   LYS  48           HG2      LYS  48   7.887  12.223   0.381
  251   2HG   LYS  48           HG1      LYS  48   8.652  13.713  -0.202
  252   1HD   LYS  48           HD2      LYS  48   8.647  12.682  -2.567
  253   2HD   LYS  48           HD1      LYS  48   7.696  11.332  -1.853
  254   1HE   LYS  48           HE2      LYS  48   6.183  13.520  -1.042
  255   2HE   LYS  48           HE1      LYS  48   6.784  14.062  -2.630
  256   1HZ   LYS  48           HZ2      LYS  48   5.971  11.843  -3.570
  257   2HZ   LYS  48           HZ3      LYS  48   5.275  11.508  -2.011
  258   3HZ   LYS  48           HZ1      LYS  48   4.722  12.872  -2.967
  259    H    VAL  49           H        VAL  49   9.177   8.425  -2.019
  260    HA   VAL  49           HA       VAL  49   6.648   8.435  -0.779
  261    HB   VAL  49           HB       VAL  49   7.203   7.319  -2.941
  262   1HG1  VAL  49           HG12     VAL  49   9.394   6.194  -2.219
  263   2HG1  VAL  49           HG13     VAL  49   8.453   5.069  -1.268
  264   3HG1  VAL  49           HG11     VAL  49   8.271   5.091  -3.046
  265   1HG2  VAL  49           HG22     VAL  49   5.834   5.443  -0.900
  266   2HG2  VAL  49           HG23     VAL  49   5.055   6.711  -1.895
  267   3HG2  VAL  49           HG21     VAL  49   5.788   5.274  -2.661
  268    H    ASP  50           H        ASP  50   5.730   7.014   0.946
  269    HA   ASP  50           HA       ASP  50   7.839   5.889   2.780
  270   1HB   ASP  50           HB2      ASP  50   4.891   6.616   3.222
  271   2HB   ASP  50           HB1      ASP  50   5.923   5.759   4.403
  272    H    GLN  51           H        GLN  51   7.986   4.178   0.785
  273    HA   GLN  51           HA       GLN  51   5.789   2.260   0.697
  274   1HB   GLN  51           HB2      GLN  51   8.743   1.807   0.044
  275   2HB   GLN  51           HB1      GLN  51   7.447   0.639  -0.258
  276   1HG   GLN  51           HG2      GLN  51   6.599   1.720  -2.118
  277   2HG   GLN  51           HG1      GLN  51   6.942   3.330  -1.498
  278   1HE2  GLN  51           HE21     GLN  51   9.281   2.502  -4.409
  279   2HE2  GLN  51           HE22     GLN  51   7.577   2.342  -4.246
  280    H    ALA  52           H        ALA  52   9.069   2.539   2.318
  281    HA   ALA  52           HA       ALA  52   9.180   0.152   3.637
  282   1HB   ALA  52           HB1      ALA  52  10.971   1.902   3.798
  283   2HB   ALA  52           HB2      ALA  52   9.898   2.924   4.805
  284   3HB   ALA  52           HB3      ALA  52  10.489   1.349   5.430
  285    H    GLY  53           H        GLY  53   7.084   2.997   4.532
  286   1HA   GLY  53           HA2      GLY  53   5.993   1.505   6.853
  287   2HA   GLY  53           HA1      GLY  53   5.429   3.077   6.231
  288    H    LEU  54           H        LEU  54   5.015   2.377   3.437
  289    HA   LEU  54           HA       LEU  54   2.365   1.430   3.838
  290   1HB   LEU  54           HB2      LEU  54   3.498   2.850   1.841
  291   2HB   LEU  54           HB1      LEU  54   3.517   1.308   1.000
  292    HG   LEU  54           HG       LEU  54   0.835   1.972   2.264
  293   1HD1  LEU  54           HD13     LEU  54   2.142   4.059   0.495
  294   2HD1  LEU  54           HD11     LEU  54   0.382   3.866   0.581
  295   3HD1  LEU  54           HD12     LEU  54   1.358   4.223   2.005
  296   1HD2  LEU  54           HD22     LEU  54   1.603   1.396  -0.652
  297   2HD2  LEU  54           HD23     LEU  54   1.027   0.183   0.526
  298   3HD2  LEU  54           HD21     LEU  54  -0.056   1.500   0.002
  299    H    LYS  55           H        LYS  55   5.200  -0.408   3.602
  300    HA   LYS  55           HA       LYS  55   3.849  -2.607   2.235
  301   1HB   LYS  55           HB2      LYS  55   6.153  -3.658   2.222
  302   2HB   LYS  55           HB1      LYS  55   6.103  -1.958   1.607
  303   1HG   LYS  55           HG2      LYS  55   8.133  -2.213   2.629
  304   2HG   LYS  55           HG1      LYS  55   7.224  -1.229   3.730
  305   1HD   LYS  55           HD2      LYS  55   7.601  -2.663   5.452
  306   2HD   LYS  55           HD1      LYS  55   6.901  -4.036   4.545
  307   1HE   LYS  55           HE2      LYS  55   9.789  -2.981   4.173
  308   2HE   LYS  55           HE1      LYS  55   9.354  -4.276   5.314
  309   1HZ   LYS  55           HZ3      LYS  55   8.829  -4.450   2.325
  310   2HZ   LYS  55           HZ1      LYS  55  10.168  -5.176   3.160
  311   3HZ   LYS  55           HZ2      LYS  55   8.546  -5.680   3.515
  312    H    LYS  56           H        LYS  56   5.247  -1.982   5.388
  313    HA   LYS  56           HA       LYS  56   4.058  -4.520   6.414
  314   1HB   LYS  56           HB2      LYS  56   5.180  -4.028   8.505
  315   2HB   LYS  56           HB1      LYS  56   6.318  -3.921   7.144
  316   1HG   LYS  56           HG2      LYS  56   6.031  -1.318   7.246
  317   2HG   LYS  56           HG1      LYS  56   5.021  -1.571   8.677
  318   1HD   LYS  56           HD2      LYS  56   7.985  -2.437   8.307
  319   2HD   LYS  56           HD1      LYS  56   7.441  -0.911   9.051
  320   1HE   LYS  56           HE2      LYS  56   6.090  -2.378  10.742
  321   2HE   LYS  56           HE1      LYS  56   7.053  -3.757  10.137
  322   1HZ   LYS  56           HZ2      LYS  56   9.121  -2.481  10.727
  323   2HZ   LYS  56           HZ3      LYS  56   8.139  -1.186  11.358
  324   3HZ   LYS  56           HZ1      LYS  56   8.101  -2.743  12.118
  325    H    LEU  57           H        LEU  57   3.099  -1.144   6.048
  326    HA   LEU  57           HA       LEU  57   1.021  -1.527   8.157
  327   1HB   LEU  57           HB2      LEU  57   2.843   0.452   8.018
  328   2HB   LEU  57           HB1      LEU  57   1.689   1.136   6.844
  329    HG   LEU  57           HG       LEU  57   1.351   0.501   9.839
  330   1HD1  LEU  57           HD12     LEU  57   2.402   2.703   9.106
  331   2HD1  LEU  57           HD13     LEU  57   0.911   3.083   8.200
  332   3HD1  LEU  57           HD11     LEU  57   0.865   2.972   9.977
  333   1HD2  LEU  57           HD22     LEU  57  -0.923   1.288   7.929
  334   2HD2  LEU  57           HD23     LEU  57  -0.806  -0.243   8.880
  335   3HD2  LEU  57           HD21     LEU  57  -0.995   1.277   9.726
  336    H    GLY  58           H        GLY  58   1.477  -0.529   4.648
  337   1HA   GLY  58           HA2      GLY  58  -1.432  -0.086   4.346
  338   2HA   GLY  58           HA1      GLY  58  -0.194   0.043   3.084
  339    H    ALA  59           H        ALA  59   1.212  -2.284   3.041
  340    HA   ALA  59           HA       ALA  59  -0.905  -4.322   2.527
  341   1HB   ALA  59           HB1      ALA  59   0.344  -3.240   0.532
  342   2HB   ALA  59           HB2      ALA  59   1.830  -4.031   1.138
  343   3HB   ALA  59           HB3      ALA  59   0.447  -5.013   0.572
  344    H    ALA  60           H        ALA  60   1.116  -6.499   2.239
  345    HA   ALA  60           HA       ALA  60   2.050  -6.655   5.099
  346   1HB   ALA  60           HB1      ALA  60  -0.113  -8.002   4.715
  347   2HB   ALA  60           HB2      ALA  60   0.772  -8.957   3.479
  348   3HB   ALA  60           HB3      ALA  60   1.326  -8.969   5.160
  349    H    GLY  61           H        GLY  61   3.642  -5.804   2.796
  350   1HA   GLY  61           HA2      GLY  61   5.992  -6.869   2.837
  351   2HA   GLY  61           HA1      GLY  61   5.192  -8.298   2.147
  352    H    VAL  62           H        VAL  62   6.874  -5.580   1.107
  353    HA   VAL  62           HA       VAL  62   5.636  -5.929  -1.571
  354    HB   VAL  62           HB       VAL  62   5.532  -3.524  -2.046
  355   1HG1  VAL  62           HG13     VAL  62   4.544  -4.034   0.725
  356   2HG1  VAL  62           HG11     VAL  62   4.462  -2.377  -0.004
  357   3HG1  VAL  62           HG12     VAL  62   3.609  -3.729  -0.679
  358   1HG2  VAL  62           HG22     VAL  62   7.540  -3.135   0.194
  359   2HG2  VAL  62           HG23     VAL  62   7.764  -2.919  -1.551
  360   3HG2  VAL  62           HG21     VAL  62   6.718  -1.793  -0.684
  361    H    VAL  63           H        VAL  63   7.302  -4.909  -3.228
  362    HA   VAL  63           HA       VAL  63  10.053  -5.317  -2.216
  363    HB   VAL  63           HB       VAL  63  10.120  -7.488  -2.921
  364   1HG1  VAL  63           HG13     VAL  63   7.479  -7.055  -4.421
  365   2HG1  VAL  63           HG11     VAL  63   8.338  -8.609  -4.331
  366   3HG1  VAL  63           HG12     VAL  63   7.741  -7.829  -2.845
  367   1HG2  VAL  63           HG22     VAL  63   9.868  -6.267  -5.730
  368   2HG2  VAL  63           HG23     VAL  63  11.359  -6.446  -4.761
  369   3HG2  VAL  63           HG21     VAL  63  10.488  -7.894  -5.349
  370    H    VAL  64           H        VAL  64  11.568  -4.036  -3.454
  371    HA   VAL  64           HA       VAL  64  10.144  -2.219  -5.365
  372    HB   VAL  64           HB       VAL  64  12.550  -1.524  -3.632
  373   1HG1  VAL  64           HG12     VAL  64  12.125  -0.126  -5.700
  374   2HG1  VAL  64           HG13     VAL  64  10.480   0.243  -5.100
  375   3HG1  VAL  64           HG11     VAL  64  11.903   0.829  -4.204
  376   1HG2  VAL  64           HG23     VAL  64  10.658  -2.055  -2.082
  377   2HG2  VAL  64           HG21     VAL  64  11.002  -0.306  -2.094
  378   3HG2  VAL  64           HG22     VAL  64   9.589  -0.936  -2.971
  379    H    ALA  65           H        ALA  65  11.020  -2.182  -7.481
  380    HA   ALA  65           HA       ALA  65  13.760  -3.363  -7.836
  381   1HB   ALA  65           HB2      ALA  65  11.132  -4.280  -9.172
  382   2HB   ALA  65           HB3      ALA  65  12.772  -4.832  -9.628
  383   3HB   ALA  65           HB1      ALA  65  12.109  -5.223  -8.014
  384    H    GLY  66           H        GLY  66  14.409  -1.084  -8.348
  385   1HA   GLY  66           HA2      GLY  66  13.366   0.870  -9.692
  386   2HA   GLY  66           HA1      GLY  66  14.970   0.307 -10.203
  387    H    SER  67           H        SER  67  11.768   0.887 -11.367
  388    HA   SER  67           HA       SER  67  11.445   0.492 -13.803
  389   1HB   SER  67           HB2      SER  67  11.330  -1.857 -14.621
  390   2HB   SER  67           HB1      SER  67  12.996  -1.357 -14.283
  391    HG   SER  67           HG       SER  67  11.380  -3.007 -12.545
  392    H    GLY  68           H        GLY  68  10.621  -1.264 -10.753
  393   1HA   GLY  68           HA2      GLY  68   7.899  -0.477 -11.067
  394   2HA   GLY  68           HA1      GLY  68   8.100  -2.215 -11.449
  395    H    VAL  69           H        VAL  69   6.496  -1.782  -9.306
  396    HA   VAL  69           HA       VAL  69   8.202  -2.525  -6.981
  397    HB   VAL  69           HB       VAL  69   5.957  -0.441  -6.774
  398   1HG1  VAL  69           HG13     VAL  69   8.125  -1.318  -4.765
  399   2HG1  VAL  69           HG11     VAL  69   6.955  -0.038  -4.479
  400   3HG1  VAL  69           HG12     VAL  69   6.397  -1.712  -4.684
  401   1HG2  VAL  69           HG22     VAL  69   8.978   0.047  -7.006
  402   2HG2  VAL  69           HG23     VAL  69   7.680   0.640  -8.088
  403   3HG2  VAL  69           HG21     VAL  69   7.824   1.283  -6.439
  404    H    GLN  70           H        GLN  70   6.962  -4.054  -5.565
  405    HA   GLN  70           HA       GLN  70   4.258  -4.616  -6.658
  406   1HB   GLN  70           HB2      GLN  70   5.449  -7.065  -5.672
  407   2HB   GLN  70           HB1      GLN  70   4.800  -6.802  -7.297
  408   1HG   GLN  70           HG2      GLN  70   6.912  -5.857  -8.082
  409   2HG   GLN  70           HG1      GLN  70   7.673  -6.070  -6.502
  410   1HE2  GLN  70           HE21     GLN  70   7.337  -9.887  -7.307
  411   2HE2  GLN  70           HE22     GLN  70   6.333  -9.020  -6.239
  412    H    ALA  71           H        ALA  71   2.649  -5.341  -5.039
  413    HA   ALA  71           HA       ALA  71   3.688  -5.164  -2.322
  414   1HB   ALA  71           HB2      ALA  71   1.239  -3.728  -3.562
  415   2HB   ALA  71           HB3      ALA  71   1.536  -3.758  -1.816
  416   3HB   ALA  71           HB1      ALA  71   2.689  -2.923  -2.923
  417    H    ILE  72           H        ILE  72   2.542  -6.452  -0.700
  418    HA   ILE  72           HA       ILE  72   0.535  -8.215  -1.938
  419    HB   ILE  72           HB       ILE  72   3.328  -9.077  -1.224
  420   1HG1  ILE  72           HG12     ILE  72   2.479 -10.850  -3.142
  421   2HG1  ILE  72           HG11     ILE  72   1.344  -9.570  -3.508
  422   1HG2  ILE  72           HG23     ILE  72   0.831 -10.832  -0.857
  423   2HG2  ILE  72           HG21     ILE  72   2.511 -11.437  -0.862
  424   3HG2  ILE  72           HG22     ILE  72   2.002 -10.318   0.406
  425   1HD1  ILE  72           HD12     ILE  72   3.489  -8.022  -3.798
  426   2HD1  ILE  72           HD13     ILE  72   4.408  -9.525  -3.608
  427   3HD1  ILE  72           HD11     ILE  72   3.262  -9.341  -4.969
  428    H    PHE  73           H        PHE  73  -1.257  -8.408  -0.618
  429    HA   PHE  73           HA       PHE  73  -0.773  -7.746   2.274
  430   1HB   PHE  73           HB2      PHE  73  -2.843  -6.689   2.442
  431   2HB   PHE  73           HB1      PHE  73  -1.818  -5.914   1.220
  432    HD1  PHE  73           HD1      PHE  73  -2.217  -6.438  -1.314
  433    HD2  PHE  73           HD2      PHE  73  -5.159  -6.858   1.796
  434    HE1  PHE  73           HE1      PHE  73  -4.021  -6.344  -2.990
  435    HE2  PHE  73           HE2      PHE  73  -6.953  -6.640   0.117
  436    HZ   PHE  73           HZ       PHE  73  -6.398  -6.400  -2.292
  437    H    GLY  74           H        GLY  74  -0.185 -10.286   1.373
  438   1HA   GLY  74           HA2      GLY  74  -2.596 -11.963   1.699
  439   2HA   GLY  74           HA1      GLY  74  -0.927 -12.483   1.418
  440    H    THR  75           H        THR  75  -1.654 -14.050   3.218
  441    HA   THR  75           HA       THR  75  -1.316 -14.800   5.371
  442    HB   THR  75           HB       THR  75   0.786 -13.957   6.417
  443    HG1  THR  75           HG1      THR  75   1.884 -12.205   5.252
  444   1HG2  THR  75           HG21     THR  75   0.965 -14.365   3.358
  445   2HG2  THR  75           HG22     THR  75   2.308 -14.565   4.519
  446   3HG2  THR  75           HG23     THR  75   0.904 -15.667   4.589
  447    H    LYS  76           H        LYS  76  -0.637 -11.319   5.926
  448    HA   LYS  76           HA       LYS  76  -2.633 -11.375   8.205
  449   1HB   LYS  76           HB2      LYS  76  -1.327  -9.572   9.252
  450   2HB   LYS  76           HB1      LYS  76  -0.482 -11.115   9.124
  451   1HG   LYS  76           HG2      LYS  76   0.789 -10.159   7.074
  452   2HG   LYS  76           HG1      LYS  76   0.036  -8.601   7.408
  453   1HD   LYS  76           HD2      LYS  76   2.341  -8.758   8.257
  454   2HD   LYS  76           HD1      LYS  76   1.233  -8.610   9.651
  455   1HE   LYS  76           HE2      LYS  76   3.172 -10.314   9.845
  456   2HE   LYS  76           HE1      LYS  76   1.565 -10.936  10.261
  457   1HZ   LYS  76           HZ3      LYS  76   2.929 -11.356   7.563
  458   2HZ   LYS  76           HZ1      LYS  76   2.927 -12.491   8.883
  459   3HZ   LYS  76           HZ2      LYS  76   1.458 -12.130   8.129
  460    H    SER  77           H        SER  77  -3.774 -11.406   5.901
  461    HA   SER  77           HA       SER  77  -3.881  -8.788   4.620
  462   1HB   SER  77           HB2      SER  77  -4.366 -11.137   3.575
  463   2HB   SER  77           HB1      SER  77  -5.961 -11.029   4.351
  464    HG   SER  77           HG       SER  77  -4.953  -9.107   2.465
  465    H    ASP  78           H        ASP  78  -6.063 -10.844   6.760
  466    HA   ASP  78           HA       ASP  78  -8.099  -8.919   7.027
  467   1HB   ASP  78           HB2      ASP  78  -7.113 -11.017   9.062
  468   2HB   ASP  78           HB1      ASP  78  -8.647 -10.112   9.192
  469    H    ASN  79           H        ASN  79  -4.956  -9.273   8.861
  470    HA   ASN  79           HA       ASN  79  -5.698  -7.381  10.880
  471   1HB   ASN  79           HB2      ASN  79  -3.693  -9.005  10.971
  472   2HB   ASN  79           HB1      ASN  79  -2.853  -7.919   9.854
  473   1HD2  ASN  79           HD21     ASN  79  -3.100  -6.937  13.825
  474   2HD2  ASN  79           HD22     ASN  79  -3.821  -8.395  13.255
  475    H    LEU  80           H        LEU  80  -3.890  -7.066   7.745
  476    HA   LEU  80           HA       LEU  80  -3.408  -4.213   8.136
  477   1HB   LEU  80           HB2      LEU  80  -3.121  -6.165   5.775
  478   2HB   LEU  80           HB1      LEU  80  -3.011  -4.429   5.510
  479    HG   LEU  80           HG       LEU  80  -0.806  -5.777   5.928
  480   1HD1  LEU  80           HD12     LEU  80  -0.951  -3.296   5.767
  481   2HD1  LEU  80           HD13     LEU  80  -1.333  -3.189   7.517
  482   3HD1  LEU  80           HD11     LEU  80   0.258  -3.779   6.978
  483   1HD2  LEU  80           HD23     LEU  80  -1.484  -6.902   8.123
  484   2HD2  LEU  80           HD21     LEU  80   0.023  -5.971   8.217
  485   3HD2  LEU  80           HD22     LEU  80  -1.475  -5.309   8.909
  486    H    LYS  81           H        LYS  81  -5.751  -6.077   6.092
  487    HA   LYS  81           HA       LYS  81  -7.186  -3.848   5.162
  488   1HB   LYS  81           HB2      LYS  81  -8.104  -6.669   5.914
  489   2HB   LYS  81           HB1      LYS  81  -9.232  -5.496   5.200
  490   1HG   LYS  81           HG2      LYS  81  -8.102  -5.385   3.121
  491   2HG   LYS  81           HG1      LYS  81  -6.567  -5.996   3.772
  492   1HD   LYS  81           HD2      LYS  81  -7.797  -7.646   2.306
  493   2HD   LYS  81           HD1      LYS  81  -7.352  -8.262   3.919
  494   1HE   LYS  81           HE2      LYS  81  -9.585  -8.239   4.726
  495   2HE   LYS  81           HE1      LYS  81 -10.149  -7.126   3.449
  496   1HZ   LYS  81           HZ3      LYS  81  -9.139  -9.939   2.877
  497   2HZ   LYS  81           HZ1      LYS  81 -10.810  -9.549   3.112
  498   3HZ   LYS  81           HZ2      LYS  81  -9.942  -8.864   1.772
  499    H    THR  82           H        THR  82  -7.415  -5.570   8.392
  500    HA   THR  82           HA       THR  82  -9.695  -4.098   9.284
  501    HB   THR  82           HB       THR  82  -7.396  -5.447  10.792
  502    HG1  THR  82           HG1      THR  82  -9.264  -6.676  10.004
  503   1HG2  THR  82           HG21     THR  82  -9.573  -3.683  12.042
  504   2HG2  THR  82           HG22     THR  82  -8.575  -4.877  12.928
  505   3HG2  THR  82           HG23     THR  82  -7.796  -3.461  12.172
  506    H    GLU  83           H        GLU  83  -6.090  -3.333   9.409
  507    HA   GLU  83           HA       GLU  83  -6.513  -0.843  10.711
  508   1HB   GLU  83           HB2      GLU  83  -4.273  -1.469   8.703
  509   2HB   GLU  83           HB1      GLU  83  -4.350  -0.084   9.821
  510   1HG   GLU  83           HG2      GLU  83  -4.073  -3.031  10.651
  511   2HG   GLU  83           HG1      GLU  83  -2.850  -1.754  10.760
  512    H    MET  84           H        MET  84  -6.625  -1.781   7.145
  513    HA   MET  84           HA       MET  84  -6.978   0.860   6.233
  514   1HB   MET  84           HB2      MET  84  -8.234  -1.661   5.037
  515   2HB   MET  84           HB1      MET  84  -8.261  -0.051   4.277
  516   1HG   MET  84           HG2      MET  84  -5.860  -0.001   3.974
  517   2HG   MET  84           HG1      MET  84  -5.610  -1.436   5.011
  518   1HE   MET  84           HE3      MET  84  -7.706  -0.320   1.779
  519   2HE   MET  84           HE1      MET  84  -7.843  -1.895   0.932
  520   3HE   MET  84           HE2      MET  84  -8.763  -1.620   2.439
  521    H    ASP  85           H        ASP  85  -9.443  -1.562   7.386
  522    HA   ASP  85           HA       ASP  85 -11.668  -0.011   6.799
  523   1HB   ASP  85           HB2      ASP  85 -11.710  -2.411   7.645
  524   2HB   ASP  85           HB1      ASP  85 -11.432  -1.785   9.296
  525    H    GLU  86           H        GLU  86  -9.618  -0.025   9.797
  526    HA   GLU  86           HA       GLU  86 -11.002   1.885  11.258
  527   1HB   GLU  86           HB2      GLU  86  -8.092   1.054  11.170
  528   2HB   GLU  86           HB1      GLU  86  -8.344   2.683  11.793
  529   1HG   GLU  86           HG2      GLU  86  -9.913   0.291  12.897
  530   2HG   GLU  86           HG1      GLU  86  -8.338   0.813  13.547
  531    H    TYR  87           H        TYR  87  -8.765   2.509   8.449
  532    HA   TYR  87           HA       TYR  87  -8.490   5.266   9.085
  533   1HB   TYR  87           HB1      TYR  87  -8.528   4.110   6.249
  534   2HB   TYR  87           HB2      TYR  87  -7.697   5.602   6.762
  535    HD1  TYR  87           HD1      TYR  87  -6.570   4.012   9.485
  536    HD2  TYR  87           HD2      TYR  87  -6.459   3.455   5.233
  537    HE1  TYR  87           HE1      TYR  87  -4.863   2.285   9.757
  538    HE2  TYR  87           HE2      TYR  87  -4.436   2.011   5.474
  539    HH   TYR  87           HH       TYR  87  -3.350   0.523   7.048
  540    H    ILE  88           H        ILE  88 -10.847   3.603   6.880
  541    HA   ILE  88           HA       ILE  88 -11.943   6.122   5.986
  542    HB   ILE  88           HB       ILE  88 -13.422   3.445   5.999
  543   1HG1  ILE  88           HG12     ILE  88 -12.322   3.883   3.358
  544   2HG1  ILE  88           HG11     ILE  88 -10.976   4.193   4.460
  545   1HG2  ILE  88           HG22     ILE  88 -14.794   5.484   5.478
  546   2HG2  ILE  88           HG23     ILE  88 -13.664   5.914   4.161
  547   3HG2  ILE  88           HG21     ILE  88 -14.643   4.422   4.054
  548   1HD1  ILE  88           HD12     ILE  88 -11.475   1.898   5.531
  549   2HD1  ILE  88           HD13     ILE  88 -12.703   1.633   4.278
  550   3HD1  ILE  88           HD11     ILE  88 -10.978   1.809   3.829
  551    H    ARG  89           H        ARG  89 -12.629   3.792   8.677
  552    HA   ARG  89           HA       ARG  89 -14.978   5.228   9.586
  553   1HB   ARG  89           HB2      ARG  89 -13.065   3.255  10.983
  554   2HB   ARG  89           HB1      ARG  89 -14.540   3.908  11.740
  555   1HG   ARG  89           HG2      ARG  89 -15.988   2.909  10.062
  556   2HG   ARG  89           HG1      ARG  89 -14.616   2.544   8.991
  557   1HD   ARG  89           HD2      ARG  89 -14.090   0.539  10.181
  558   2HD   ARG  89           HD1      ARG  89 -14.538   1.280  11.713
  559    HE   ARG  89           HE       ARG  89 -16.592   0.326  11.615
  560   1HH1  ARG  89           HH12     ARG  89 -15.452   0.627   8.208
  561   2HH1  ARG  89           HH11     ARG  89 -16.961  -0.004   7.575
  562   1HH2  ARG  89           HH22     ARG  89 -18.456  -0.510  10.714
  563   2HH2  ARG  89           HH21     ARG  89 -18.618  -0.673   8.965
  564    H    ASN  90           H        ASN  90 -11.441   5.643  10.104
  565    HA   ASN  90           HA       ASN  90 -11.868   7.638  12.206
  566   1HB   ASN  90           HB2      ASN  90  -9.778   6.246  12.112
  567   2HB   ASN  90           HB1      ASN  90  -9.379   6.969  10.535
  568   1HD2  ASN  90           HD21     ASN  90  -9.013   9.301  13.978
  569   2HD2  ASN  90           HD22     ASN  90 -10.134   7.990  13.994
  570    H    PHE  91           H        PHE  91 -11.885   7.661   8.622
  571    HA   PHE  91           HA       PHE  91 -11.908  10.664   8.758
  572   1HB   PHE  91           HB2      PHE  91  -9.944   8.933   7.552
  573   2HB   PHE  91           HB1      PHE  91 -10.873   9.574   6.197
  574    HD1  PHE  91           HD1      PHE  91 -11.524  12.330   6.872
  575    HD2  PHE  91           HD2      PHE  91  -7.921  10.129   7.717
  576    HE1  PHE  91           HE1      PHE  91 -10.251  14.449   7.027
  577    HE2  PHE  91           HE2      PHE  91  -6.646  12.235   7.803
  578    HZ   PHE  91           HZ       PHE  91  -7.807  14.409   7.478
  579    H    GLY  92           H        GLY  92 -14.236   8.825   8.956
  580   1HA   GLY  92           HA2      GLY  92 -15.364   8.802   6.221
  581   2HA   GLY  92           HA1      GLY  92 -16.161   8.254   7.713
   
  No H/Q in entry =         581
  Start of MODEL    2
    1    H    MET  15           H        MET  15  -2.133   8.411  12.364
    2    HA   MET  15           HA       MET  15  -1.146   8.623  10.076
    3   1HB   MET  15           HB2      MET  15   0.985   7.406  10.503
    4   2HB   MET  15           HB1      MET  15   0.396   8.204  11.994
    5   1HG   MET  15           HG2      MET  15  -0.688   5.939  12.640
    6   2HG   MET  15           HG1      MET  15   0.246   5.199  11.292
    7   1HE   MET  15           HE2      MET  15   0.305   4.272  14.240
    8   2HE   MET  15           HE3      MET  15   1.507   3.531  13.130
    9   3HE   MET  15           HE1      MET  15   2.029   4.187  14.718
   10    H    ALA  16           H        ALA  16  -2.473   5.333  10.991
   11    HA   ALA  16           HA       ALA  16  -1.668   4.007   8.687
   12   1HB   ALA  16           HB1      ALA  16  -2.904   2.834  10.474
   13   2HB   ALA  16           HB2      ALA  16  -4.413   3.684  10.021
   14   3HB   ALA  16           HB3      ALA  16  -3.636   2.564   8.863
   15    HA   PRO  17           HA       PRO  17  -5.224   5.848   6.080
   16   1HB   PRO  17           HB2      PRO  17  -6.337   8.265   6.692
   17   2HB   PRO  17           HB1      PRO  17  -6.893   6.738   7.446
   18   1HG   PRO  17           HG1      PRO  17  -5.064   8.736   8.749
   19   2HG   PRO  17           HG2      PRO  17  -6.519   7.941   9.419
   20   1HD   PRO  17           HD1      PRO  17  -4.021   6.980   9.930
   21   2HD   PRO  17           HD2      PRO  17  -5.398   5.833   9.708
   22    H    ALA  18           H        ALA  18  -3.073   8.405   7.629
   23    HA   ALA  18           HA       ALA  18  -2.640   9.751   5.111
   24   1HB   ALA  18           HB1      ALA  18  -2.052  10.792   7.335
   25   2HB   ALA  18           HB2      ALA  18  -0.784   9.544   7.569
   26   3HB   ALA  18           HB3      ALA  18  -0.637  10.732   6.237
   27    H    LEU  19           H        LEU  19  -1.294   6.794   6.715
   28    HA   LEU  19           HA       LEU  19   1.094   6.914   5.092
   29   1HB   LEU  19           HB2      LEU  19   1.042   6.224   7.437
   30   2HB   LEU  19           HB1      LEU  19   0.140   4.742   7.037
   31    HG   LEU  19           HG       LEU  19   2.667   4.595   7.489
   32   1HD1  LEU  19           HD12     LEU  19   1.341   2.749   6.296
   33   2HD1  LEU  19           HD13     LEU  19   1.885   3.451   4.765
   34   3HD1  LEU  19           HD11     LEU  19   3.097   2.859   5.948
   35   1HD2  LEU  19           HD23     LEU  19   3.401   6.598   6.117
   36   2HD2  LEU  19           HD21     LEU  19   4.276   5.084   5.721
   37   3HD2  LEU  19           HD22     LEU  19   3.004   5.671   4.626
   38    H    VAL  20           H        VAL  20  -1.589   4.286   5.283
   39    HA   VAL  20           HA       VAL  20  -1.103   3.182   2.861
   40    HB   VAL  20           HB       VAL  20  -3.004   2.513   4.306
   41   1HG1  VAL  20           HG12     VAL  20  -3.946   4.904   4.472
   42   2HG1  VAL  20           HG13     VAL  20  -4.665   4.675   2.859
   43   3HG1  VAL  20           HG11     VAL  20  -5.150   3.619   4.228
   44   1HG2  VAL  20           HG23     VAL  20  -2.802   1.520   2.017
   45   2HG2  VAL  20           HG21     VAL  20  -4.516   1.741   2.468
   46   3HG2  VAL  20           HG22     VAL  20  -3.748   2.868   1.323
   47    H    ALA  21           H        ALA  21  -2.486   6.529   3.357
   48    HA   ALA  21           HA       ALA  21  -3.177   6.801   0.639
   49   1HB   ALA  21           HB1      ALA  21  -4.164   8.332   2.298
   50   2HB   ALA  21           HB2      ALA  21  -2.555   9.051   2.623
   51   3HB   ALA  21           HB3      ALA  21  -3.319   9.254   1.021
   52    H    ALA  22           H        ALA  22  -0.121   7.541   2.472
   53    HA   ALA  22           HA       ALA  22   1.277   9.041   0.633
   54   1HB   ALA  22           HB1      ALA  22   2.186   8.324   2.886
   55   2HB   ALA  22           HB2      ALA  22   2.448   6.683   2.221
   56   3HB   ALA  22           HB3      ALA  22   3.365   8.072   1.571
   57    H    PHE  23           H        PHE  23   0.316   5.671  -0.038
   58    HA   PHE  23           HA       PHE  23   1.805   5.949  -2.603
   59   1HB   PHE  23           HB2      PHE  23   3.163   4.673  -0.826
   60   2HB   PHE  23           HB1      PHE  23   1.912   3.371  -1.046
   61    HD1  PHE  23           HD1      PHE  23   3.677   5.492  -3.719
   62    HD2  PHE  23           HD2      PHE  23   3.261   1.630  -1.798
   63    HE1  PHE  23           HE1      PHE  23   5.192   4.490  -5.361
   64    HE2  PHE  23           HE2      PHE  23   4.765   0.651  -3.451
   65    HZ   PHE  23           HZ       PHE  23   5.687   2.068  -5.305
   66    H    GLY  24           H        GLY  24  -0.548   3.705  -0.791
   67   1HA   GLY  24           HA2      GLY  24  -1.899   3.038  -3.221
   68   2HA   GLY  24           HA1      GLY  24  -2.571   2.903  -1.573
   69    H    GLY  25           H        GLY  25  -1.997   6.054  -1.288
   70   1HA   GLY  25           HA2      GLY  25  -4.556   6.824  -2.689
   71   2HA   GLY  25           HA1      GLY  25  -3.863   7.662  -1.299
   72    H    LYS  26           H        LYS  26  -1.504   6.685  -3.772
   73    HA   LYS  26           HA       LYS  26  -1.374   9.565  -4.630
   74   1HB   LYS  26           HB2      LYS  26   0.524   7.191  -5.054
   75   2HB   LYS  26           HB1      LYS  26   0.829   8.876  -5.560
   76   1HG   LYS  26           HG2      LYS  26   0.463   7.930  -2.650
   77   2HG   LYS  26           HG1      LYS  26   2.031   8.123  -3.475
   78   1HD   LYS  26           HD2      LYS  26   0.632  10.627  -3.834
   79   2HD   LYS  26           HD1      LYS  26   0.418  10.189  -2.125
   80   1HE   LYS  26           HE2      LYS  26   2.835  10.101  -1.774
   81   2HE   LYS  26           HE1      LYS  26   3.178  10.181  -3.525
   82   1HZ   LYS  26           HZ3      LYS  26   1.817  12.402  -1.988
   83   2HZ   LYS  26           HZ1      LYS  26   3.505  12.364  -2.423
   84   3HZ   LYS  26           HZ2      LYS  26   2.295  12.424  -3.664
   85    H    GLU  27           H        GLU  27  -3.748   8.538  -5.508
   86    HA   GLU  27           HA       GLU  27  -3.646   6.486  -7.349
   87   1HB   GLU  27           HB2      GLU  27  -5.848   6.988  -8.050
   88   2HB   GLU  27           HB1      GLU  27  -5.754   7.647  -6.399
   89   1HG   GLU  27           HG2      GLU  27  -5.248   9.949  -7.501
   90   2HG   GLU  27           HG1      GLU  27  -5.531   9.169  -9.088
   91    H    ASN  28           H        ASN  28  -2.630   9.849  -7.894
   92    HA   ASN  28           HA       ASN  28  -2.605   9.959 -10.666
   93   1HB   ASN  28           HB2      ASN  28  -1.857  11.793  -9.094
   94   2HB   ASN  28           HB1      ASN  28  -0.396  10.850  -8.702
   95   1HD2  ASN  28           HD21     ASN  28  -0.772  12.660 -12.464
   96   2HD2  ASN  28           HD22     ASN  28  -2.207  12.174 -11.634
   97    H    ILE  29           H        ILE  29  -0.763   7.642  -8.747
   98    HA   ILE  29           HA       ILE  29   1.512   7.227 -10.149
   99    HB   ILE  29           HB       ILE  29  -0.568   5.270  -9.071
  100   1HG1  ILE  29           HG12     ILE  29   0.233   5.847  -7.005
  101   2HG1  ILE  29           HG11     ILE  29   1.643   4.933  -7.398
  102   1HG2  ILE  29           HG23     ILE  29   2.136   4.401 -10.161
  103   2HG2  ILE  29           HG21     ILE  29   1.209   3.417  -9.042
  104   3HG2  ILE  29           HG22     ILE  29   0.497   3.863 -10.598
  105   1HD1  ILE  29           HD12     ILE  29   2.795   6.956  -8.324
  106   2HD1  ILE  29           HD13     ILE  29   1.435   7.953  -7.747
  107   3HD1  ILE  29           HD11     ILE  29   2.442   7.033  -6.587
  108    H    THR  30           H        THR  30   2.355   5.883 -11.850
  109    HA   THR  30           HA       THR  30   0.791   5.993 -14.219
  110    HB   THR  30           HB       THR  30   2.736   4.628 -15.205
  111    HG1  THR  30           HG1      THR  30   3.621   3.669 -13.243
  112   1HG2  THR  30           HG21     THR  30   3.278   7.249 -13.670
  113   2HG2  THR  30           HG22     THR  30   4.356   6.543 -14.904
  114   3HG2  THR  30           HG23     THR  30   2.724   7.103 -15.363
  115    H    ASN  31           H        ASN  31   1.708   2.891 -12.306
  116    HA   ASN  31           HA       ASN  31  -0.912   1.875 -13.318
  117   1HB   ASN  31           HB2      ASN  31   1.816   0.856 -13.968
  118   2HB   ASN  31           HB1      ASN  31   0.759  -0.394 -13.263
  119   1HD2  ASN  31           HD21     ASN  31  -0.503  -0.924 -16.551
  120   2HD2  ASN  31           HD22     ASN  31   0.059  -1.646 -15.094
  121    H    LEU  32           H        LEU  32  -2.096   0.557 -11.887
  122    HA   LEU  32           HA       LEU  32  -0.781  -0.226  -9.287
  123   1HB   LEU  32           HB2      LEU  32  -3.521   0.971  -9.928
  124   2HB   LEU  32           HB1      LEU  32  -3.438  -0.232  -8.626
  125    HG   LEU  32           HG       LEU  32  -3.476   2.283  -8.022
  126   1HD1  LEU  32           HD12     LEU  32  -3.161   0.526  -6.305
  127   2HD1  LEU  32           HD13     LEU  32  -1.416   0.480  -6.658
  128   3HD1  LEU  32           HD11     LEU  32  -2.141   1.947  -5.969
  129   1HD2  LEU  32           HD23     LEU  32  -1.566   2.991  -9.552
  130   2HD2  LEU  32           HD21     LEU  32  -1.276   3.395  -7.823
  131   3HD2  LEU  32           HD22     LEU  32  -0.485   1.979  -8.545
  132    H    ASP  33           H        ASP  33  -1.388  -2.474  -8.693
  133    HA   ASP  33           HA       ASP  33  -3.219  -3.825 -10.677
  134   1HB   ASP  33           HB2      ASP  33  -0.850  -5.162  -9.374
  135   2HB   ASP  33           HB1      ASP  33  -1.915  -5.871 -10.581
  136    H    ALA  34           H        ALA  34  -4.431  -2.674  -8.576
  137    HA   ALA  34           HA       ALA  34  -4.151  -4.032  -6.124
  138   1HB   ALA  34           HB1      ALA  34  -5.292  -1.888  -6.219
  139   2HB   ALA  34           HB2      ALA  34  -6.645  -2.618  -7.143
  140   3HB   ALA  34           HB3      ALA  34  -6.334  -3.126  -5.449
  141    H    CYS  35           H        CYS  35  -5.087  -5.973  -5.226
  142    HA   CYS  35           HA       CYS  35  -7.207  -7.309  -6.717
  143   1HB   CYS  35           HB2      CYS  35  -4.890  -7.727  -7.978
  144   2HB   CYS  35           HB1      CYS  35  -4.539  -8.817  -6.611
  145    H    ILE  36           H        ILE  36  -7.817  -9.463  -5.652
  146    HA   ILE  36           HA       ILE  36  -8.572  -9.602  -3.311
  147    HB   ILE  36           HB       ILE  36  -7.304 -12.009  -2.881
  148   1HG1  ILE  36           HG12     ILE  36  -6.967 -13.171  -5.026
  149   2HG1  ILE  36           HG11     ILE  36  -7.280 -11.700  -5.953
  150   1HG2  ILE  36           HG22     ILE  36  -9.715 -11.659  -3.058
  151   2HG2  ILE  36           HG23     ILE  36  -9.586 -11.482  -4.834
  152   3HG2  ILE  36           HG21     ILE  36  -9.199 -13.041  -4.047
  153   1HD1  ILE  36           HD12     ILE  36  -5.093 -10.735  -4.957
  154   2HD1  ILE  36           HD13     ILE  36  -4.787 -12.373  -4.268
  155   3HD1  ILE  36           HD11     ILE  36  -4.912 -12.149  -6.015
  156    H    THR  37           H        THR  37  -5.290 -10.936  -2.627
  157    HA   THR  37           HA       THR  37  -5.110  -8.936  -0.411
  158    HB   THR  37           HB       THR  37  -3.924 -10.689   0.830
  159    HG1  THR  37           HG1      THR  37  -4.512 -12.572  -1.224
  160   1HG2  THR  37           HG23     THR  37  -6.400 -10.490   1.152
  161   2HG2  THR  37           HG21     THR  37  -6.688 -11.649  -0.179
  162   3HG2  THR  37           HG22     THR  37  -5.877 -12.196   1.316
  163    H    ARG  38           H        ARG  38  -4.229  -8.736  -3.348
  164    HA   ARG  38           HA       ARG  38  -1.311  -8.493  -2.832
  165   1HB   ARG  38           HB2      ARG  38  -1.718 -10.598  -4.117
  166   2HB   ARG  38           HB1      ARG  38  -2.653  -9.697  -5.317
  167   1HG   ARG  38           HG2      ARG  38  -0.094  -8.309  -5.061
  168   2HG   ARG  38           HG1      ARG  38   0.254 -10.046  -5.171
  169   1HD   ARG  38           HD2      ARG  38  -1.477  -8.652  -7.262
  170   2HD   ARG  38           HD1      ARG  38   0.312  -8.824  -7.306
  171    HE   ARG  38           HE       ARG  38  -0.944 -11.392  -6.802
  172   1HH1  ARG  38           HH12     ARG  38  -0.303  -9.044  -9.465
  173   2HH1  ARG  38           HH11     ARG  38  -0.129 -10.334 -10.647
  174   1HH2  ARG  38           HH22     ARG  38  -0.725 -12.959  -8.387
  175   2HH2  ARG  38           HH21     ARG  38  -0.393 -12.508 -10.060
  176    H    LEU  39           H        LEU  39  -0.728  -6.288  -3.411
  177    HA   LEU  39           HA       LEU  39  -2.219  -5.165  -5.691
  178   1HB   LEU  39           HB2      LEU  39  -2.755  -3.051  -4.592
  179   2HB   LEU  39           HB1      LEU  39  -3.386  -4.406  -3.635
  180    HG   LEU  39           HG       LEU  39  -1.135  -3.997  -2.208
  181   1HD1  LEU  39           HD12     LEU  39  -0.330  -2.133  -3.838
  182   2HD1  LEU  39           HD13     LEU  39  -1.720  -1.155  -3.330
  183   3HD1  LEU  39           HD11     LEU  39  -0.468  -1.589  -2.136
  184   1HD2  LEU  39           HD23     LEU  39  -3.485  -3.737  -1.298
  185   2HD2  LEU  39           HD21     LEU  39  -2.439  -2.426  -0.718
  186   3HD2  LEU  39           HD22     LEU  39  -3.603  -2.132  -2.041
  187    H    ARG  40           H        ARG  40  -0.960  -2.979  -6.331
  188    HA   ARG  40           HA       ARG  40   1.918  -3.422  -5.949
  189   1HB   ARG  40           HB2      ARG  40   0.785  -3.677  -8.808
  190   2HB   ARG  40           HB1      ARG  40   2.492  -3.734  -8.358
  191   1HG   ARG  40           HG2      ARG  40   2.127  -5.937  -7.203
  192   2HG   ARG  40           HG1      ARG  40   0.447  -5.931  -7.672
  193   1HD   ARG  40           HD2      ARG  40   0.996  -6.646  -9.849
  194   2HD   ARG  40           HD1      ARG  40   2.278  -5.396  -9.995
  195    HE   ARG  40           HE       ARG  40   3.204  -7.558  -8.333
  196   1HH1  ARG  40           HH12     ARG  40   2.436  -6.780 -11.757
  197   2HH1  ARG  40           HH11     ARG  40   3.687  -7.857 -12.352
  198   1HH2  ARG  40           HH22     ARG  40   4.802  -8.892  -9.192
  199   2HH2  ARG  40           HH21     ARG  40   4.985  -9.053 -10.935
  200    H    VAL  41           H        VAL  41   3.194  -1.573  -7.004
  201    HA   VAL  41           HA       VAL  41   1.296   0.626  -7.749
  202    HB   VAL  41           HB       VAL  41   3.427   0.860  -5.623
  203   1HG1  VAL  41           HG12     VAL  41   2.420   2.933  -6.654
  204   2HG1  VAL  41           HG13     VAL  41   0.786   2.445  -6.137
  205   3HG1  VAL  41           HG11     VAL  41   2.015   2.882  -4.924
  206   1HG2  VAL  41           HG22     VAL  41   0.554   0.054  -5.005
  207   2HG2  VAL  41           HG23     VAL  41   2.045  -0.866  -4.620
  208   3HG2  VAL  41           HG21     VAL  41   1.711   0.670  -3.801
  209    H    SER  42           H        SER  42   2.299   0.065  -9.923
  210    HA   SER  42           HA       SER  42   5.177   0.337 -10.154
  211   1HB   SER  42           HB2      SER  42   4.215  -1.110 -11.750
  212   2HB   SER  42           HB1      SER  42   2.957   0.079 -12.162
  213    HG   SER  42           HG       SER  42   4.687   0.097 -13.764
  214    H    VAL  43           H        VAL  43   6.310   2.252  -9.881
  215    HA   VAL  43           HA       VAL  43   5.529   4.564 -11.419
  216    HB   VAL  43           HB       VAL  43   4.110   5.484  -9.866
  217   1HG1  VAL  43           HG13     VAL  43   5.233   3.458  -7.816
  218   2HG1  VAL  43           HG11     VAL  43   3.923   4.599  -7.443
  219   3HG1  VAL  43           HG12     VAL  43   3.657   3.357  -8.679
  220   1HG2  VAL  43           HG23     VAL  43   6.192   6.798  -9.247
  221   2HG2  VAL  43           HG21     VAL  43   4.994   6.700  -7.957
  222   3HG2  VAL  43           HG22     VAL  43   6.388   5.635  -7.874
  223    H    ALA  44           H        ALA  44   7.215   6.255 -11.374
  224    HA   ALA  44           HA       ALA  44   9.716   5.422  -9.910
  225   1HB   ALA  44           HB1      ALA  44   9.939   5.605 -12.376
  226   2HB   ALA  44           HB2      ALA  44   9.346   7.292 -12.317
  227   3HB   ALA  44           HB3      ALA  44  10.895   6.861 -11.529
  228    H    ASP  45           H        ASP  45   8.480   6.210  -7.943
  229    HA   ASP  45           HA       ASP  45   9.001   9.139  -7.592
  230   1HB   ASP  45           HB2      ASP  45   6.494   7.764  -6.470
  231   2HB   ASP  45           HB1      ASP  45   7.189   9.292  -5.892
  232    H    VAL  46           H        VAL  46  10.825   7.229  -7.358
  233    HA   VAL  46           HA       VAL  46  10.850   6.313  -4.555
  234    HB   VAL  46           HB       VAL  46  11.743   4.989  -6.544
  235   1HG1  VAL  46           HG12     VAL  46  13.082   6.806  -7.677
  236   2HG1  VAL  46           HG13     VAL  46  14.158   6.897  -6.255
  237   3HG1  VAL  46           HG11     VAL  46  14.101   5.414  -7.248
  238   1HG2  VAL  46           HG23     VAL  46  12.190   4.328  -4.188
  239   2HG2  VAL  46           HG21     VAL  46  13.580   3.963  -5.239
  240   3HG2  VAL  46           HG22     VAL  46  13.641   5.375  -4.150
  241    H    SER  47           H        SER  47  11.152   9.387  -5.962
  242    HA   SER  47           HA       SER  47  13.412  10.493  -4.896
  243   1HB   SER  47           HB2      SER  47  11.749  11.803  -6.174
  244   2HB   SER  47           HB1      SER  47  10.546  11.618  -4.862
  245    HG   SER  47           HG       SER  47  11.742  13.665  -4.705
  246    H    LYS  48           H        LYS  48  10.487   9.323  -3.054
  247    HA   LYS  48           HA       LYS  48  12.068   9.303  -0.687
  248   1HB   LYS  48           HB2      LYS  48  10.951  10.869   0.761
  249   2HB   LYS  48           HB1      LYS  48  11.775  11.713  -0.567
  250   1HG   LYS  48           HG2      LYS  48   8.764  11.363  -0.169
  251   2HG   LYS  48           HG1      LYS  48   9.698  12.848  -0.059
  252   1HD   LYS  48           HD2      LYS  48  10.300  12.799  -2.455
  253   2HD   LYS  48           HD1      LYS  48   9.338  11.342  -2.723
  254   1HE   LYS  48           HE2      LYS  48   8.221  14.057  -1.888
  255   2HE   LYS  48           HE1      LYS  48   8.076  13.240  -3.468
  256   1HZ   LYS  48           HZ2      LYS  48   6.807  11.401  -2.288
  257   2HZ   LYS  48           HZ3      LYS  48   6.772  12.420  -0.861
  258   3HZ   LYS  48           HZ1      LYS  48   6.013  12.941  -2.325
  259    H    VAL  49           H        VAL  49   8.510   9.615  -1.551
  260    HA   VAL  49           HA       VAL  49   6.740   8.556  -0.580
  261    HB   VAL  49           HB       VAL  49   7.588   7.622  -2.716
  262   1HG1  VAL  49           HG13     VAL  49   8.988   5.531  -0.963
  263   2HG1  VAL  49           HG11     VAL  49   8.679   5.312  -2.715
  264   3HG1  VAL  49           HG12     VAL  49   9.696   6.640  -2.173
  265   1HG2  VAL  49           HG23     VAL  49   5.393   6.942  -1.863
  266   2HG2  VAL  49           HG21     VAL  49   6.169   5.744  -2.922
  267   3HG2  VAL  49           HG22     VAL  49   6.088   5.454  -1.180
  268    H    ASP  50           H        ASP  50   5.932   6.464   0.810
  269    HA   ASP  50           HA       ASP  50   7.971   6.021   2.975
  270   1HB   ASP  50           HB2      ASP  50   6.151   7.823   3.396
  271   2HB   ASP  50           HB1      ASP  50   4.970   6.495   3.407
  272    H    GLN  51           H        GLN  51   7.969   4.354   0.863
  273    HA   GLN  51           HA       GLN  51   5.962   2.287   1.084
  274   1HB   GLN  51           HB2      GLN  51   8.797   1.958  -0.085
  275   2HB   GLN  51           HB1      GLN  51   7.423   0.827  -0.251
  276   1HG   GLN  51           HG2      GLN  51   6.156   2.544  -1.572
  277   2HG   GLN  51           HG1      GLN  51   7.491   3.689  -1.324
  278   1HE2  GLN  51           HE21     GLN  51   8.358   2.627  -4.618
  279   2HE2  GLN  51           HE22     GLN  51   7.321   3.754  -3.838
  280    H    ALA  52           H        ALA  52   9.405   2.757   2.241
  281    HA   ALA  52           HA       ALA  52   9.902   0.426   3.527
  282   1HB   ALA  52           HB1      ALA  52  11.439   2.397   3.635
  283   2HB   ALA  52           HB2      ALA  52  10.300   3.234   4.736
  284   3HB   ALA  52           HB3      ALA  52  11.149   1.749   5.277
  285    H    GLY  53           H        GLY  53   7.500   2.899   4.714
  286   1HA   GLY  53           HA2      GLY  53   6.823   1.117   7.013
  287   2HA   GLY  53           HA1      GLY  53   6.112   2.703   6.639
  288    H    LEU  54           H        LEU  54   5.252   2.474   4.016
  289    HA   LEU  54           HA       LEU  54   2.777   1.211   4.419
  290   1HB   LEU  54           HB2      LEU  54   3.682   2.879   2.508
  291   2HB   LEU  54           HB1      LEU  54   3.753   1.418   1.534
  292    HG   LEU  54           HG       LEU  54   1.114   1.883   3.026
  293   1HD1  LEU  54           HD13     LEU  54   2.219   3.935   1.064
  294   2HD1  LEU  54           HD11     LEU  54   0.484   3.752   1.356
  295   3HD1  LEU  54           HD12     LEU  54   1.635   4.161   2.657
  296   1HD2  LEU  54           HD22     LEU  54   1.731   1.237   0.095
  297   2HD2  LEU  54           HD23     LEU  54   1.264   0.061   1.351
  298   3HD2  LEU  54           HD21     LEU  54   0.107   1.313   0.827
  299    H    LYS  55           H        LYS  55   5.752  -0.213   3.334
  300    HA   LYS  55           HA       LYS  55   4.473  -2.448   2.172
  301   1HB   LYS  55           HB2      LYS  55   6.835  -3.387   2.011
  302   2HB   LYS  55           HB1      LYS  55   6.689  -1.680   1.485
  303   1HG   LYS  55           HG2      LYS  55   8.623  -1.449   2.716
  304   2HG   LYS  55           HG1      LYS  55   7.510  -1.322   4.094
  305   1HD   LYS  55           HD2      LYS  55   9.161  -2.829   4.795
  306   2HD   LYS  55           HD1      LYS  55   7.729  -3.821   4.412
  307   1HE   LYS  55           HE2      LYS  55   9.084  -3.912   1.960
  308   2HE   LYS  55           HE1      LYS  55  10.460  -3.626   3.033
  309   1HZ   LYS  55           HZ2      LYS  55   9.730  -5.597   4.392
  310   2HZ   LYS  55           HZ3      LYS  55   8.429  -5.854   3.259
  311   3HZ   LYS  55           HZ1      LYS  55  10.078  -6.024   2.728
  312    H    LYS  56           H        LYS  56   5.599  -1.890   5.414
  313    HA   LYS  56           HA       LYS  56   4.781  -4.711   6.132
  314   1HB   LYS  56           HB2      LYS  56   6.003  -4.266   8.315
  315   2HB   LYS  56           HB1      LYS  56   6.962  -4.477   6.815
  316   1HG   LYS  56           HG2      LYS  56   7.423  -2.069   6.672
  317   2HG   LYS  56           HG1      LYS  56   6.343  -1.749   8.067
  318   1HD   LYS  56           HD2      LYS  56   8.720  -1.619   8.621
  319   2HD   LYS  56           HD1      LYS  56   7.938  -2.907   9.576
  320   1HE   LYS  56           HE2      LYS  56   9.298  -3.700   6.961
  321   2HE   LYS  56           HE1      LYS  56  10.356  -3.219   8.297
  322   1HZ   LYS  56           HZ3      LYS  56   8.269  -5.392   8.603
  323   2HZ   LYS  56           HZ1      LYS  56   9.957  -5.646   8.241
  324   3HZ   LYS  56           HZ2      LYS  56   9.489  -4.914   9.737
  325    H    LEU  57           H        LEU  57   4.207  -1.230   6.989
  326    HA   LEU  57           HA       LEU  57   2.172  -1.889   8.911
  327   1HB   LEU  57           HB2      LEU  57   3.582   0.310   8.611
  328   2HB   LEU  57           HB1      LEU  57   2.429   0.733   7.325
  329    HG   LEU  57           HG       LEU  57   1.946   0.326  10.342
  330   1HD1  LEU  57           HD12     LEU  57   2.919   2.578   9.488
  331   2HD1  LEU  57           HD13     LEU  57   1.365   2.809   8.631
  332   3HD1  LEU  57           HD11     LEU  57   1.385   2.695  10.402
  333   1HD2  LEU  57           HD22     LEU  57  -0.126   0.768   8.098
  334   2HD2  LEU  57           HD23     LEU  57   0.025  -0.607   9.256
  335   3HD2  LEU  57           HD21     LEU  57  -0.484   0.997   9.843
  336    H    GLY  58           H        GLY  58   2.141  -0.734   5.417
  337   1HA   GLY  58           HA2      GLY  58  -0.787  -0.858   5.350
  338   2HA   GLY  58           HA1      GLY  58   0.283  -0.382   4.025
  339    H    ALA  59           H        ALA  59   1.965  -2.542   3.610
  340    HA   ALA  59           HA       ALA  59   0.071  -4.738   2.894
  341   1HB   ALA  59           HB1      ALA  59   1.119  -3.390   1.003
  342   2HB   ALA  59           HB2      ALA  59   2.696  -4.011   1.577
  343   3HB   ALA  59           HB3      ALA  59   1.458  -5.137   0.940
  344    H    ALA  60           H        ALA  60   2.161  -6.716   2.505
  345    HA   ALA  60           HA       ALA  60   3.537  -6.816   5.175
  346   1HB   ALA  60           HB1      ALA  60   1.266  -8.096   5.227
  347   2HB   ALA  60           HB2      ALA  60   1.973  -9.177   3.990
  348   3HB   ALA  60           HB3      ALA  60   2.722  -9.059   5.601
  349    H    GLY  61           H        GLY  61   4.654  -6.096   2.574
  350   1HA   GLY  61           HA2      GLY  61   6.907  -7.407   2.173
  351   2HA   GLY  61           HA1      GLY  61   5.811  -8.666   1.581
  352    H    VAL  62           H        VAL  62   7.208  -5.501   0.740
  353    HA   VAL  62           HA       VAL  62   5.877  -5.850  -1.916
  354    HB   VAL  62           HB       VAL  62   5.521  -3.457  -2.162
  355   1HG1  VAL  62           HG13     VAL  62   5.124  -4.034   0.765
  356   2HG1  VAL  62           HG11     VAL  62   4.560  -2.539  -0.084
  357   3HG1  VAL  62           HG12     VAL  62   3.919  -4.135  -0.461
  358   1HG2  VAL  62           HG22     VAL  62   7.774  -3.008  -0.183
  359   2HG2  VAL  62           HG23     VAL  62   7.763  -2.738  -1.937
  360   3HG2  VAL  62           HG21     VAL  62   6.746  -1.720  -0.906
  361    H    VAL  63           H        VAL  63   7.259  -5.038  -3.737
  362    HA   VAL  63           HA       VAL  63  10.151  -5.265  -2.981
  363    HB   VAL  63           HB       VAL  63  10.573  -6.966  -4.445
  364   1HG1  VAL  63           HG12     VAL  63   8.676  -7.906  -3.153
  365   2HG1  VAL  63           HG13     VAL  63   7.509  -7.372  -4.390
  366   3HG1  VAL  63           HG11     VAL  63   8.731  -8.600  -4.797
  367   1HG2  VAL  63           HG22     VAL  63   8.624  -5.701  -6.437
  368   2HG2  VAL  63           HG23     VAL  63  10.400  -5.691  -6.452
  369   3HG2  VAL  63           HG21     VAL  63   9.514  -7.215  -6.733
  370    H    VAL  64           H        VAL  64  11.549  -3.887  -4.412
  371    HA   VAL  64           HA       VAL  64   9.899  -1.832  -5.855
  372    HB   VAL  64           HB       VAL  64  12.332  -1.167  -4.146
  373   1HG1  VAL  64           HG12     VAL  64  11.525   0.464  -5.921
  374   2HG1  VAL  64           HG13     VAL  64   9.932   0.536  -5.110
  375   3HG1  VAL  64           HG11     VAL  64  11.384   1.138  -4.270
  376   1HG2  VAL  64           HG22     VAL  64   9.416  -1.192  -3.172
  377   2HG2  VAL  64           HG23     VAL  64  10.751  -2.184  -2.545
  378   3HG2  VAL  64           HG21     VAL  64  10.779  -0.416  -2.326
  379    H    ALA  65           H        ALA  65  10.371  -2.637  -7.955
  380    HA   ALA  65           HA       ALA  65  13.301  -2.995  -8.584
  381   1HB   ALA  65           HB2      ALA  65  10.762  -4.108  -9.929
  382   2HB   ALA  65           HB3      ALA  65  12.446  -4.410 -10.445
  383   3HB   ALA  65           HB1      ALA  65  11.871  -5.009  -8.861
  384    H    GLY  66           H        GLY  66  13.611  -0.576  -8.897
  385   1HA   GLY  66           HA2      GLY  66  12.322   1.341 -10.061
  386   2HA   GLY  66           HA1      GLY  66  13.935   0.966 -10.697
  387    H    SER  67           H        SER  67  10.576   1.195 -11.588
  388    HA   SER  67           HA       SER  67  10.203   0.981 -14.083
  389   1HB   SER  67           HB2      SER  67  11.247  -1.863 -13.572
  390   2HB   SER  67           HB1      SER  67  10.219  -1.383 -14.952
  391    HG   SER  67           HG       SER  67  12.510  -1.221 -15.500
  392    H    GLY  68           H        GLY  68   9.768  -1.244 -11.235
  393   1HA   GLY  68           HA2      GLY  68   6.914  -0.665 -11.309
  394   2HA   GLY  68           HA1      GLY  68   7.326  -2.357 -11.715
  395    H    VAL  69           H        VAL  69   5.839  -1.620  -9.300
  396    HA   VAL  69           HA       VAL  69   7.808  -2.457  -7.220
  397    HB   VAL  69           HB       VAL  69   5.619  -0.394  -6.753
  398   1HG1  VAL  69           HG12     VAL  69   6.236  -1.691  -4.739
  399   2HG1  VAL  69           HG13     VAL  69   7.932  -1.190  -4.938
  400   3HG1  VAL  69           HG11     VAL  69   6.729   0.018  -4.581
  401   1HG2  VAL  69           HG22     VAL  69   8.627   0.047  -7.257
  402   2HG2  VAL  69           HG23     VAL  69   7.267   0.667  -8.238
  403   3HG2  VAL  69           HG21     VAL  69   7.550   1.311  -6.606
  404    H    GLN  70           H        GLN  70   6.814  -4.181  -5.968
  405    HA   GLN  70           HA       GLN  70   4.006  -4.834  -6.810
  406   1HB   GLN  70           HB2      GLN  70   5.355  -6.585  -7.724
  407   2HB   GLN  70           HB1      GLN  70   6.493  -6.529  -6.372
  408   1HG   GLN  70           HG2      GLN  70   4.964  -7.513  -4.802
  409   2HG   GLN  70           HG1      GLN  70   3.644  -7.499  -6.006
  410   1HE2  GLN  70           HE21     GLN  70   4.706 -10.771  -7.128
  411   2HE2  GLN  70           HE22     GLN  70   3.425  -9.632  -7.070
  412    H    ALA  71           H        ALA  71   2.514  -5.581  -4.954
  413    HA   ALA  71           HA       ALA  71   3.779  -5.201  -2.355
  414   1HB   ALA  71           HB1      ALA  71   2.806  -2.953  -2.988
  415   2HB   ALA  71           HB2      ALA  71   1.242  -3.742  -3.305
  416   3HB   ALA  71           HB3      ALA  71   1.850  -3.654  -1.643
  417    H    ILE  72           H        ILE  72   3.124  -6.773  -0.765
  418    HA   ILE  72           HA       ILE  72   0.640  -8.242  -1.534
  419    HB   ILE  72           HB       ILE  72   3.478  -9.291  -1.317
  420   1HG1  ILE  72           HG12     ILE  72   2.300 -11.040  -3.023
  421   2HG1  ILE  72           HG11     ILE  72   1.006  -9.846  -3.043
  422   1HG2  ILE  72           HG22     ILE  72   2.274 -10.520   0.592
  423   2HG2  ILE  72           HG23     ILE  72   1.136 -11.131  -0.656
  424   3HG2  ILE  72           HG21     ILE  72   2.861 -11.551  -0.723
  425   1HD1  ILE  72           HD12     ILE  72   2.905  -8.136  -3.742
  426   2HD1  ILE  72           HD13     ILE  72   3.959  -9.566  -3.861
  427   3HD1  ILE  72           HD11     ILE  72   2.526  -9.403  -4.921
  428    H    PHE  73           H        PHE  73  -0.807  -8.554   0.146
  429    HA   PHE  73           HA       PHE  73   0.327  -7.948   2.848
  430   1HB   PHE  73           HB2      PHE  73  -2.255  -7.917   3.302
  431   2HB   PHE  73           HB1      PHE  73  -1.324  -6.458   3.027
  432    HD1  PHE  73           HD2      PHE  73  -0.990  -6.175   0.137
  433    HD2  PHE  73           HD1      PHE  73  -4.399  -6.877   2.622
  434    HE1  PHE  73           HE2      PHE  73  -2.476  -6.014  -1.832
  435    HE2  PHE  73           HE1      PHE  73  -5.904  -6.498   0.693
  436    HZ   PHE  73           HZ       PHE  73  -4.932  -6.238  -1.594
  437    H    GLY  74           H        GLY  74  -0.502 -10.708   0.883
  438   1HA   GLY  74           HA2      GLY  74  -0.239 -12.904   1.593
  439   2HA   GLY  74           HA1      GLY  74   0.570 -12.212   3.020
  440    H    THR  75           H        THR  75  -0.581 -14.055   4.177
  441    HA   THR  75           HA       THR  75  -3.437 -13.879   4.497
  442    HB   THR  75           HB       THR  75  -2.341 -15.930   5.248
  443    HG1  THR  75           HG1      THR  75  -4.287 -15.185   6.402
  444   1HG2  THR  75           HG21     THR  75  -0.949 -14.182   7.383
  445   2HG2  THR  75           HG22     THR  75  -1.081 -15.961   7.444
  446   3HG2  THR  75           HG23     THR  75  -0.147 -15.194   6.138
  447    H    LYS  76           H        LYS  76  -0.656 -12.067   5.942
  448    HA   LYS  76           HA       LYS  76  -2.011 -11.044   8.153
  449   1HB   LYS  76           HB2      LYS  76   0.473 -10.301   6.811
  450   2HB   LYS  76           HB1      LYS  76  -0.491  -8.833   6.919
  451   1HG   LYS  76           HG2      LYS  76   0.834  -8.861   8.867
  452   2HG   LYS  76           HG1      LYS  76  -0.795  -9.294   9.434
  453   1HD   LYS  76           HD2      LYS  76  -0.148 -11.699   9.530
  454   2HD   LYS  76           HD1      LYS  76   1.440 -11.352   8.798
  455   1HE   LYS  76           HE2      LYS  76   0.537 -10.191  11.504
  456   2HE   LYS  76           HE1      LYS  76   1.421 -11.729  11.329
  457   1HZ   LYS  76           HZ2      LYS  76   3.297 -10.552  10.267
  458   2HZ   LYS  76           HZ3      LYS  76   2.501  -9.019  10.487
  459   3HZ   LYS  76           HZ1      LYS  76   2.969  -9.943  11.863
  460    H    SER  77           H        SER  77  -2.549 -10.240   4.713
  461    HA   SER  77           HA       SER  77  -3.884  -7.904   4.764
  462   1HB   SER  77           HB2      SER  77  -5.570  -8.886   3.138
  463   2HB   SER  77           HB1      SER  77  -3.934  -9.476   2.756
  464    HG   SER  77           HG       SER  77  -4.543 -11.456   3.910
  465    H    ASP  78           H        ASP  78  -5.295 -10.795   6.532
  466    HA   ASP  78           HA       ASP  78  -7.815  -9.424   6.765
  467   1HB   ASP  78           HB2      ASP  78  -7.417 -11.840   7.329
  468   2HB   ASP  78           HB1      ASP  78  -6.575 -11.330   8.824
  469    H    ASN  79           H        ASN  79  -4.796  -9.413   8.836
  470    HA   ASN  79           HA       ASN  79  -5.941  -7.595  10.742
  471   1HB   ASN  79           HB2      ASN  79  -3.913  -9.120  11.137
  472   2HB   ASN  79           HB1      ASN  79  -2.941  -7.983  10.173
  473   1HD2  ASN  79           HD21     ASN  79  -2.658  -5.755  13.025
  474   2HD2  ASN  79           HD22     ASN  79  -2.048  -6.158  11.466
  475    H    LEU  80           H        LEU  80  -3.958  -7.076   7.719
  476    HA   LEU  80           HA       LEU  80  -3.670  -4.226   8.377
  477   1HB   LEU  80           HB2      LEU  80  -3.158  -5.480   5.641
  478   2HB   LEU  80           HB1      LEU  80  -2.559  -3.930   6.290
  479    HG   LEU  80           HG       LEU  80  -1.744  -6.786   7.105
  480   1HD1  LEU  80           HD12     LEU  80  -0.585  -5.825   5.105
  481   2HD1  LEU  80           HD13     LEU  80  -0.062  -4.435   6.096
  482   3HD1  LEU  80           HD11     LEU  80   0.534  -6.077   6.463
  483   1HD2  LEU  80           HD22     LEU  80  -0.962  -4.176   8.551
  484   2HD2  LEU  80           HD23     LEU  80  -1.887  -5.540   9.237
  485   3HD2  LEU  80           HD21     LEU  80  -0.184  -5.769   8.801
  486    H    LYS  81           H        LYS  81  -5.878  -6.259   6.297
  487    HA   LYS  81           HA       LYS  81  -7.370  -4.075   5.284
  488   1HB   LYS  81           HB2      LYS  81  -8.249  -6.905   6.086
  489   2HB   LYS  81           HB1      LYS  81  -9.416  -5.753   5.514
  490   1HG   LYS  81           HG2      LYS  81  -7.032  -5.805   3.693
  491   2HG   LYS  81           HG1      LYS  81  -7.776  -7.396   3.844
  492   1HD   LYS  81           HD2      LYS  81  -8.597  -5.931   1.917
  493   2HD   LYS  81           HD1      LYS  81  -9.857  -6.709   2.903
  494   1HE   LYS  81           HE2      LYS  81 -10.558  -4.652   3.900
  495   2HE   LYS  81           HE1      LYS  81  -9.030  -3.829   3.505
  496   1HZ   LYS  81           HZ3      LYS  81 -11.088  -4.773   1.483
  497   2HZ   LYS  81           HZ1      LYS  81 -10.966  -3.148   2.092
  498   3HZ   LYS  81           HZ2      LYS  81  -9.668  -3.809   1.147
  499    H    THR  82           H        THR  82  -7.456  -5.601   8.597
  500    HA   THR  82           HA       THR  82  -9.772  -4.120   9.401
  501    HB   THR  82           HB       THR  82  -7.487  -5.377  10.982
  502    HG1  THR  82           HG1      THR  82  -9.348  -6.643  10.210
  503   1HG2  THR  82           HG21     THR  82  -9.702  -3.581  12.119
  504   2HG2  THR  82           HG22     THR  82  -8.720  -4.735  13.076
  505   3HG2  THR  82           HG23     THR  82  -7.926  -3.349  12.275
  506    H    GLU  83           H        GLU  83  -6.193  -3.189   9.540
  507    HA   GLU  83           HA       GLU  83  -6.891  -0.697  10.777
  508   1HB   GLU  83           HB2      GLU  83  -4.660  -0.034  10.633
  509   2HB   GLU  83           HB1      GLU  83  -4.512  -1.808  10.547
  510   1HG   GLU  83           HG2      GLU  83  -4.501  -1.434   7.924
  511   2HG   GLU  83           HG1      GLU  83  -4.328   0.291   8.266
  512    H    MET  84           H        MET  84  -6.740  -1.776   7.277
  513    HA   MET  84           HA       MET  84  -6.859   0.911   6.330
  514   1HB   MET  84           HB2      MET  84  -7.795  -1.623   4.875
  515   2HB   MET  84           HB1      MET  84  -7.686   0.017   4.167
  516   1HG   MET  84           HG2      MET  84  -5.171   0.021   4.800
  517   2HG   MET  84           HG1      MET  84  -5.340  -1.738   5.085
  518   1HE   MET  84           HE2      MET  84  -6.585  -3.279   3.018
  519   2HE   MET  84           HE3      MET  84  -7.734  -2.020   2.423
  520   3HE   MET  84           HE1      MET  84  -6.546  -2.754   1.306
  521    H    ASP  85           H        ASP  85  -9.345  -1.643   7.199
  522    HA   ASP  85           HA       ASP  85 -11.620  -0.361   6.305
  523   1HB   ASP  85           HB2      ASP  85 -11.806  -2.536   7.395
  524   2HB   ASP  85           HB1      ASP  85 -11.325  -1.847   8.967
  525    H    GLU  86           H        GLU  86  -9.917   0.135   9.541
  526    HA   GLU  86           HA       GLU  86 -11.590   2.242  10.350
  527   1HB   GLU  86           HB2      GLU  86  -8.644   1.681  10.994
  528   2HB   GLU  86           HB1      GLU  86  -9.447   3.162  11.588
  529   1HG   GLU  86           HG2      GLU  86 -11.224   1.843  12.708
  530   2HG   GLU  86           HG1      GLU  86 -10.457   0.318  12.170
  531    H    TYR  87           H        TYR  87  -8.490   2.467   8.375
  532    HA   TYR  87           HA       TYR  87  -8.408   5.196   8.186
  533   1HB   TYR  87           HB1      TYR  87  -6.669   4.333   6.859
  534   2HB   TYR  87           HB2      TYR  87  -7.664   3.027   6.296
  535    HD1  TYR  87           HD2      TYR  87  -8.245   6.739   5.664
  536    HD2  TYR  87           HD1      TYR  87  -7.538   2.821   4.006
  537    HE1  TYR  87           HE2      TYR  87  -8.426   7.661   3.406
  538    HE2  TYR  87           HE1      TYR  87  -7.706   3.756   1.749
  539    HH   TYR  87           HH       TYR  87  -8.519   5.675   0.483
  540    H    ILE  88           H        ILE  88 -10.402   3.159   5.881
  541    HA   ILE  88           HA       ILE  88 -11.340   5.516   4.587
  542    HB   ILE  88           HB       ILE  88 -13.012   2.958   4.679
  543   1HG1  ILE  88           HG12     ILE  88 -11.505   2.943   2.222
  544   2HG1  ILE  88           HG11     ILE  88 -10.318   3.386   3.448
  545   1HG2  ILE  88           HG22     ILE  88 -14.106   4.998   3.715
  546   2HG2  ILE  88           HG23     ILE  88 -12.752   5.180   2.559
  547   3HG2  ILE  88           HG21     ILE  88 -13.828   3.754   2.469
  548   1HD1  ILE  88           HD12     ILE  88 -11.218   1.306   4.786
  549   2HD1  ILE  88           HD13     ILE  88 -12.081   0.856   3.311
  550   3HD1  ILE  88           HD11     ILE  88 -10.291   0.951   3.309
  551    H    ARG  89           H        ARG  89 -12.725   3.559   7.351
  552    HA   ARG  89           HA       ARG  89 -15.073   5.195   7.518
  553   1HB   ARG  89           HB2      ARG  89 -13.749   3.696   9.855
  554   2HB   ARG  89           HB1      ARG  89 -15.418   4.284   9.737
  555   1HG   ARG  89           HG2      ARG  89 -15.193   2.643   7.416
  556   2HG   ARG  89           HG1      ARG  89 -14.179   1.799   8.611
  557   1HD   ARG  89           HD2      ARG  89 -17.191   2.307   8.704
  558   2HD   ARG  89           HD1      ARG  89 -16.313   0.814   8.777
  559    HE   ARG  89           HE       ARG  89 -15.593   1.091  10.984
  560   1HH1  ARG  89           HH12     ARG  89 -17.776   3.865  10.050
  561   2HH1  ARG  89           HH11     ARG  89 -18.059   4.250  11.731
  562   1HH2  ARG  89           HH22     ARG  89 -16.039   1.726  13.065
  563   2HH2  ARG  89           HH21     ARG  89 -17.104   3.092  13.392
  564    H    ASN  90           H        ASN  90 -11.728   5.690   8.677
  565    HA   ASN  90           HA       ASN  90 -12.450   7.869  10.484
  566   1HB   ASN  90           HB2      ASN  90 -10.392   6.450  10.825
  567   2HB   ASN  90           HB1      ASN  90  -9.732   7.036   9.284
  568   1HD2  ASN  90           HD21     ASN  90  -9.738   9.548  12.595
  569   2HD2  ASN  90           HD22     ASN  90 -10.794   8.183  12.593
  570    H    PHE  91           H        PHE  91 -11.796   7.509   6.962
  571    HA   PHE  91           HA       PHE  91 -11.821  10.513   6.748
  572   1HB   PHE  91           HB2      PHE  91  -9.718   8.637   6.123
  573   2HB   PHE  91           HB1      PHE  91 -10.397   9.092   4.564
  574    HD1  PHE  91           HD1      PHE  91 -11.020  11.859   4.563
  575    HD2  PHE  91           HD2      PHE  91  -7.901   9.956   6.829
  576    HE1  PHE  91           HE1      PHE  91  -9.699  13.958   4.539
  577    HE2  PHE  91           HE2      PHE  91  -6.489  11.967   6.599
  578    HZ   PHE  91           HZ       PHE  91  -7.402  13.998   5.489
  579    H    GLY  92           H        GLY  92 -14.172   8.720   6.793
  580   1HA   GLY  92           HA2      GLY  92 -15.704   9.632   4.756
  581   2HA   GLY  92           HA1      GLY  92 -14.838   8.287   3.945
   
  No H/Q in entry =         581
  Start of MODEL    3
    1    H    MET  15           H        MET  15  -2.756   7.152  11.499
    2    HA   MET  15           HA       MET  15  -0.829   8.263   9.529
    3   1HB   MET  15           HB2      MET  15  -0.378   5.951  11.496
    4   2HB   MET  15           HB1      MET  15   0.803   6.555  10.301
    5   1HG   MET  15           HG2      MET  15   1.413   8.351  11.663
    6   2HG   MET  15           HG1      MET  15  -0.274   8.788  12.007
    7   1HE   MET  15           HE2      MET  15  -1.354   8.547  14.274
    8   2HE   MET  15           HE1      MET  15  -1.783   6.891  13.723
    9   3HE   MET  15           HE3      MET  15  -1.088   7.142  15.353
   10    H    ALA  16           H        ALA  16  -2.535   5.047  10.374
   11    HA   ALA  16           HA       ALA  16  -1.922   3.806   8.024
   12   1HB   ALA  16           HB3      ALA  16  -3.386   2.760   9.838
   13   2HB   ALA  16           HB2      ALA  16  -4.779   3.613   9.145
   14   3HB   ALA  16           HB1      ALA  16  -3.900   2.423   8.156
   15    HA   PRO  17           HA       PRO  17  -5.321   5.943   5.427
   16   1HB   PRO  17           HB2      PRO  17  -6.308   8.420   6.145
   17   2HB   PRO  17           HB1      PRO  17  -6.951   6.873   6.764
   18   1HG   PRO  17           HG2      PRO  17  -5.054   8.672   8.261
   19   2HG   PRO  17           HG1      PRO  17  -6.575   7.933   8.838
   20   1HD   PRO  17           HD2      PRO  17  -4.159   6.772   9.364
   21   2HD   PRO  17           HD1      PRO  17  -5.603   5.750   9.029
   22    H    ALA  18           H        ALA  18  -3.037   8.253   7.174
   23    HA   ALA  18           HA       ALA  18  -2.477   9.730   4.768
   24   1HB   ALA  18           HB3      ALA  18  -1.876  10.578   7.076
   25   2HB   ALA  18           HB2      ALA  18  -0.651   9.274   7.212
   26   3HB   ALA  18           HB1      ALA  18  -0.464  10.551   5.971
   27    H    LEU  19           H        LEU  19  -1.317   6.578   6.144
   28    HA   LEU  19           HA       LEU  19   1.118   6.712   4.598
   29   1HB   LEU  19           HB2      LEU  19   0.590   5.390   6.888
   30   2HB   LEU  19           HB1      LEU  19   0.207   4.075   5.752
   31    HG   LEU  19           HG       LEU  19   2.466   3.781   6.430
   32   1HD1  LEU  19           HD12     LEU  19   2.143   3.610   3.978
   33   2HD1  LEU  19           HD11     LEU  19   2.753   5.268   3.730
   34   3HD1  LEU  19           HD13     LEU  19   3.820   4.033   4.418
   35   1HD2  LEU  19           HD21     LEU  19   2.911   5.970   7.518
   36   2HD2  LEU  19           HD23     LEU  19   4.250   5.489   6.449
   37   3HD2  LEU  19           HD22     LEU  19   3.105   6.749   5.921
   38    H    VAL  20           H        VAL  20  -1.818   4.381   4.505
   39    HA   VAL  20           HA       VAL  20  -1.246   3.373   2.044
   40    HB   VAL  20           HB       VAL  20  -3.247   2.691   3.426
   41   1HG1  VAL  20           HG12     VAL  20  -4.238   5.010   3.632
   42   2HG1  VAL  20           HG11     VAL  20  -4.717   4.946   1.914
   43   3HG1  VAL  20           HG13     VAL  20  -5.420   3.796   3.085
   44   1HG2  VAL  20           HG21     VAL  20  -2.872   1.717   1.151
   45   2HG2  VAL  20           HG23     VAL  20  -4.612   1.930   1.469
   46   3HG2  VAL  20           HG22     VAL  20  -3.756   3.080   0.408
   47    H    ALA  21           H        ALA  21  -2.600   6.665   2.753
   48    HA   ALA  21           HA       ALA  21  -3.197   7.224   0.063
   49   1HB   ALA  21           HB3      ALA  21  -4.097   8.668   1.858
   50   2HB   ALA  21           HB2      ALA  21  -2.445   9.234   2.255
   51   3HB   ALA  21           HB1      ALA  21  -3.176   9.644   0.679
   52    H    ALA  22           H        ALA  22  -0.182   7.683   2.069
   53    HA   ALA  22           HA       ALA  22   1.310   9.267   0.496
   54   1HB   ALA  22           HB3      ALA  22   2.172   8.206   2.636
   55   2HB   ALA  22           HB2      ALA  22   2.425   6.681   1.732
   56   3HB   ALA  22           HB1      ALA  22   3.361   8.138   1.309
   57    H    PHE  23           H        PHE  23   0.489   5.861  -0.408
   58    HA   PHE  23           HA       PHE  23   2.087   6.307  -2.911
   59   1HB   PHE  23           HB2      PHE  23   3.095   4.726  -1.254
   60   2HB   PHE  23           HB1      PHE  23   1.713   3.594  -1.622
   61    HD1  PHE  23           HD2      PHE  23   2.906   5.231  -4.689
   62    HD2  PHE  23           HD1      PHE  23   3.690   2.114  -1.794
   63    HE1  PHE  23           HE2      PHE  23   4.365   4.068  -6.243
   64    HE2  PHE  23           HE1      PHE  23   5.213   1.029  -3.370
   65    HZ   PHE  23           HZ       PHE  23   5.746   2.143  -5.559
   66    H    GLY  24           H        GLY  24  -0.692   4.244  -1.508
   67   1HA   GLY  24           HA1      GLY  24  -1.812   3.847  -4.133
   68   2HA   GLY  24           HA2      GLY  24  -2.612   3.533  -2.573
   69    H    GLY  25           H        GLY  25  -1.976   6.616  -1.884
   70   1HA   GLY  25           HA1      GLY  25  -4.440   7.617  -3.288
   71   2HA   GLY  25           HA2      GLY  25  -3.712   8.328  -1.845
   72    H    LYS  26           H        LYS  26  -1.304   7.418  -4.263
   73    HA   LYS  26           HA       LYS  26  -0.908  10.323  -4.819
   74   1HB   LYS  26           HB2      LYS  26   0.626   7.812  -5.614
   75   2HB   LYS  26           HB1      LYS  26   1.147   9.494  -5.984
   76   1HG   LYS  26           HG2      LYS  26   0.799   8.251  -3.200
   77   2HG   LYS  26           HG1      LYS  26   2.333   8.360  -4.114
   78   1HD   LYS  26           HD2      LYS  26   1.291  11.041  -4.051
   79   2HD   LYS  26           HD1      LYS  26   0.955  10.403  -2.439
   80   1HE   LYS  26           HE2      LYS  26   3.772   9.732  -3.084
   81   2HE   LYS  26           HE1      LYS  26   3.478  11.421  -3.513
   82   1HZ   LYS  26           HZ2      LYS  26   2.552  11.755  -1.194
   83   2HZ   LYS  26           HZ1      LYS  26   3.022  10.093  -0.845
   84   3HZ   LYS  26           HZ3      LYS  26   4.217  11.251  -1.235
   85    H    GLU  27           H        GLU  27  -3.168  10.231  -5.908
   86    HA   GLU  27           HA       GLU  27  -3.779   8.424  -7.910
   87   1HB   GLU  27           HB2      GLU  27  -5.712   9.623  -8.129
   88   2HB   GLU  27           HB1      GLU  27  -5.054  10.804  -6.987
   89   1HG   GLU  27           HG2      GLU  27  -4.068  12.087  -8.952
   90   2HG   GLU  27           HG1      GLU  27  -4.829  10.893 -10.051
   91    H    ASN  28           H        ASN  28  -1.673  11.319  -8.232
   92    HA   ASN  28           HA       ASN  28  -1.398  11.592 -10.931
   93   1HB   ASN  28           HB2      ASN  28  -0.019  12.841  -9.253
   94   2HB   ASN  28           HB1      ASN  28   0.879  11.352  -8.854
   95   1HD2  ASN  28           HD22     ASN  28   3.297  12.393 -11.298
   96   2HD2  ASN  28           HD21     ASN  28   3.033  11.883  -9.673
   97    H    ILE  29           H        ILE  29  -0.147   8.879  -9.021
   98    HA   ILE  29           HA       ILE  29   1.548   7.492 -10.332
   99    HB   ILE  29           HB       ILE  29  -1.167   6.819  -9.183
  100   1HG1  ILE  29           HG12     ILE  29  -0.071   6.018  -7.330
  101   2HG1  ILE  29           HG11     ILE  29   1.000   5.003  -8.274
  102   1HG2  ILE  29           HG22     ILE  29  -1.335   5.299 -11.061
  103   2HG2  ILE  29           HG21     ILE  29   0.126   4.453 -10.482
  104   3HG2  ILE  29           HG23     ILE  29  -1.354   4.532  -9.468
  105   1HD1  ILE  29           HD11     ILE  29   1.554   8.000  -7.776
  106   2HD1  ILE  29           HD13     ILE  29   2.244   6.647  -6.847
  107   3HD1  ILE  29           HD12     ILE  29   2.664   6.884  -8.539
  108    H    THR  30           H        THR  30   1.779   5.522 -11.604
  109    HA   THR  30           HA       THR  30   0.686   6.143 -14.311
  110    HB   THR  30           HB       THR  30   2.825   6.539 -14.865
  111    HG1  THR  30           HG1      THR  30   3.265   3.743 -14.588
  112   1HG2  THR  30           HG22     THR  30   3.795   4.914 -12.508
  113   2HG2  THR  30           HG21     THR  30   4.851   5.823 -13.628
  114   3HG2  THR  30           HG23     THR  30   3.719   6.712 -12.561
  115    H    ASN  31           H        ASN  31   1.777   3.053 -12.451
  116    HA   ASN  31           HA       ASN  31  -0.685   1.931 -13.612
  117   1HB   ASN  31           HB2      ASN  31   1.244  -0.129 -14.218
  118   2HB   ASN  31           HB1      ASN  31   0.222   0.755 -15.350
  119   1HD2  ASN  31           HD22     ASN  31   3.090   2.382 -16.726
  120   2HD2  ASN  31           HD21     ASN  31   1.438   1.959 -16.942
  121    H    LEU  32           H        LEU  32  -1.690   0.458 -12.203
  122    HA   LEU  32           HA       LEU  32   0.034  -0.807 -10.063
  123   1HB   LEU  32           HB2      LEU  32  -2.776   0.451 -10.036
  124   2HB   LEU  32           HB1      LEU  32  -2.337  -0.767  -8.825
  125    HG   LEU  32           HG       LEU  32  -0.803   0.618  -7.719
  126   1HD1  LEU  32           HD11     LEU  32  -0.765   2.377 -10.218
  127   2HD1  LEU  32           HD13     LEU  32   0.025   2.810  -8.639
  128   3HD1  LEU  32           HD12     LEU  32   0.630   1.470  -9.587
  129   1HD2  LEU  32           HD21     LEU  32  -3.120   1.391  -7.339
  130   2HD2  LEU  32           HD23     LEU  32  -1.954   2.729  -7.218
  131   3HD2  LEU  32           HD22     LEU  32  -2.955   2.559  -8.682
  132    H    ASP  33           H        ASP  33  -1.032  -2.851  -9.224
  133    HA   ASP  33           HA       ASP  33  -2.764  -4.221 -11.252
  134   1HB   ASP  33           HB2      ASP  33  -0.035  -5.105 -10.309
  135   2HB   ASP  33           HB1      ASP  33  -1.286  -6.348 -10.540
  136    H    ALA  34           H        ALA  34  -4.397  -3.460  -9.629
  137    HA   ALA  34           HA       ALA  34  -4.266  -4.420  -6.926
  138   1HB   ALA  34           HB3      ALA  34  -5.726  -2.555  -7.513
  139   2HB   ALA  34           HB2      ALA  34  -6.727  -3.644  -8.527
  140   3HB   ALA  34           HB1      ALA  34  -6.650  -3.887  -6.752
  141    H    CYS  35           H        CYS  35  -5.411  -6.339  -5.969
  142    HA   CYS  35           HA       CYS  35  -6.899  -8.094  -7.695
  143   1HB   CYS  35           HB2      CYS  35  -4.202  -8.392  -8.275
  144   2HB   CYS  35           HB1      CYS  35  -4.335  -9.392  -6.819
  145    HG   CYS  35           HG       CYS  35  -4.728 -10.855  -8.801
  146    H    ILE  36           H        ILE  36  -7.085 -10.437  -6.523
  147    HA   ILE  36           HA       ILE  36  -8.600 -10.148  -4.457
  148    HB   ILE  36           HB       ILE  36  -8.302 -12.390  -3.628
  149   1HG1  ILE  36           HG12     ILE  36  -6.027 -13.059  -3.598
  150   2HG1  ILE  36           HG11     ILE  36  -6.766 -14.040  -4.829
  151   1HG2  ILE  36           HG22     ILE  36  -9.624 -11.903  -5.728
  152   2HG2  ILE  36           HG21     ILE  36  -8.229 -12.446  -6.703
  153   3HG2  ILE  36           HG23     ILE  36  -9.033 -13.574  -5.594
  154   1HD1  ILE  36           HD11     ILE  36  -5.062 -11.547  -5.536
  155   2HD1  ILE  36           HD13     ILE  36  -4.511 -13.230  -5.493
  156   3HD1  ILE  36           HD12     ILE  36  -5.763 -12.729  -6.663
  157    H    THR  37           H        THR  37  -5.166 -11.030  -3.337
  158    HA   THR  37           HA       THR  37  -5.679  -9.160  -1.059
  159    HB   THR  37           HB       THR  37  -5.974 -11.495  -0.263
  160    HG1  THR  37           HG1      THR  37  -4.303 -11.231   1.370
  161   1HG2  THR  37           HG22     THR  37  -3.115 -11.937  -1.385
  162   2HG2  THR  37           HG21     THR  37  -3.876 -12.984  -0.163
  163   3HG2  THR  37           HG23     THR  37  -4.595 -12.856  -1.775
  164    H    ARG  38           H        ARG  38  -4.538  -8.698  -3.754
  165    HA   ARG  38           HA       ARG  38  -1.711  -8.272  -2.995
  166   1HB   ARG  38           HB2      ARG  38  -1.450 -10.272  -4.293
  167   2HB   ARG  38           HB1      ARG  38  -2.841  -9.953  -5.276
  168   1HG   ARG  38           HG2      ARG  38  -1.704  -8.191  -6.589
  169   2HG   ARG  38           HG1      ARG  38  -0.331  -8.203  -5.473
  170   1HD   ARG  38           HD2      ARG  38   0.427  -9.328  -7.377
  171   2HD   ARG  38           HD1      ARG  38   0.113 -10.636  -6.180
  172    HE   ARG  38           HE       ARG  38  -2.201 -10.339  -7.813
  173   1HH1  ARG  38           HH11     ARG  38   1.243 -11.335  -8.148
  174   2HH1  ARG  38           HH12     ARG  38   0.888 -12.359  -9.530
  175   1HH2  ARG  38           HH21     ARG  38  -2.556 -11.689  -9.591
  176   2HH2  ARG  38           HH22     ARG  38  -1.220 -12.567 -10.329
  177    H    LEU  39           H        LEU  39  -0.970  -6.184  -3.652
  178    HA   LEU  39           HA       LEU  39  -2.421  -5.055  -5.889
  179   1HB   LEU  39           HB2      LEU  39  -3.212  -3.006  -4.779
  180   2HB   LEU  39           HB1      LEU  39  -3.879  -4.424  -3.953
  181    HG   LEU  39           HG       LEU  39  -1.725  -4.050  -2.385
  182   1HD1  LEU  39           HD12     LEU  39  -0.880  -1.966  -3.623
  183   2HD1  LEU  39           HD11     LEU  39  -2.413  -1.161  -3.228
  184   3HD1  LEU  39           HD13     LEU  39  -1.282  -1.615  -1.926
  185   1HD2  LEU  39           HD21     LEU  39  -4.180  -4.046  -1.622
  186   2HD2  LEU  39           HD23     LEU  39  -3.269  -2.775  -0.784
  187   3HD2  LEU  39           HD22     LEU  39  -4.343  -2.361  -2.146
  188    H    ARG  40           H        ARG  40  -0.816  -4.098  -7.267
  189    HA   ARG  40           HA       ARG  40   1.866  -3.735  -5.977
  190   1HB   ARG  40           HB2      ARG  40   1.164  -3.786  -8.929
  191   2HB   ARG  40           HB1      ARG  40   2.747  -3.941  -8.191
  192   1HG   ARG  40           HG2      ARG  40   1.724  -6.083  -6.984
  193   2HG   ARG  40           HG1      ARG  40   0.496  -6.090  -8.220
  194   1HD   ARG  40           HD2      ARG  40   3.511  -5.980  -8.850
  195   2HD   ARG  40           HD1      ARG  40   2.818  -7.532  -8.391
  196    HE   ARG  40           HE       ARG  40   1.113  -7.227 -10.244
  197   1HH1  ARG  40           HH11     ARG  40   4.673  -6.479 -10.551
  198   2HH1  ARG  40           HH12     ARG  40   4.624  -6.826 -12.263
  199   1HH2  ARG  40           HH21     ARG  40   1.233  -7.657 -12.410
  200   2HH2  ARG  40           HH22     ARG  40   2.751  -7.501 -13.286
  201    H    VAL  41           H        VAL  41   3.195  -1.839  -6.915
  202    HA   VAL  41           HA       VAL  41   1.468   0.349  -7.848
  203    HB   VAL  41           HB       VAL  41   3.313   0.931  -5.581
  204   1HG1  VAL  41           HG12     VAL  41   2.087   2.846  -6.848
  205   2HG1  VAL  41           HG11     VAL  41   0.543   2.096  -6.380
  206   3HG1  VAL  41           HG13     VAL  41   1.594   2.741  -5.133
  207   1HG2  VAL  41           HG21     VAL  41   2.105  -0.901  -4.582
  208   2HG2  VAL  41           HG23     VAL  41   1.618   0.630  -3.846
  209   3HG2  VAL  41           HG22     VAL  41   0.536  -0.162  -5.021
  210    H    SER  42           H        SER  42   2.722  -0.283  -9.924
  211    HA   SER  42           HA       SER  42   5.568   0.267  -9.885
  212   1HB   SER  42           HB2      SER  42   4.923  -1.230 -11.642
  213   2HB   SER  42           HB1      SER  42   3.593  -0.185 -12.174
  214    HG   SER  42           HG       SER  42   6.311   0.561 -12.560
  215    H    VAL  43           H        VAL  43   6.459   2.328  -9.444
  216    HA   VAL  43           HA       VAL  43   5.621   4.371 -11.351
  217    HB   VAL  43           HB       VAL  43   4.884   5.998  -9.721
  218   1HG1  VAL  43           HG11     VAL  43   3.931   3.272  -8.613
  219   2HG1  VAL  43           HG13     VAL  43   3.281   4.789  -8.124
  220   3HG1  VAL  43           HG12     VAL  43   3.110   4.294  -9.821
  221   1HG2  VAL  43           HG22     VAL  43   6.233   4.324  -7.528
  222   2HG2  VAL  43           HG21     VAL  43   6.857   5.859  -8.139
  223   3HG2  VAL  43           HG23     VAL  43   5.328   5.874  -7.272
  224    H    ALA  44           H        ALA  44   6.901   6.424 -11.233
  225    HA   ALA  44           HA       ALA  44   9.713   5.777 -10.425
  226   1HB   ALA  44           HB3      ALA  44   9.313   6.386 -12.815
  227   2HB   ALA  44           HB2      ALA  44   8.636   7.961 -12.296
  228   3HB   ALA  44           HB1      ALA  44  10.355   7.576 -11.977
  229    H    ASP  45           H        ASP  45   6.937   7.835  -9.370
  230    HA   ASP  45           HA       ASP  45   8.501   9.816  -8.038
  231   1HB   ASP  45           HB2      ASP  45   5.894   8.489  -7.085
  232   2HB   ASP  45           HB1      ASP  45   6.616   9.981  -6.428
  233    H    VAL  46           H        VAL  46  10.492   8.380  -7.504
  234    HA   VAL  46           HA       VAL  46   9.990   6.974  -4.925
  235    HB   VAL  46           HB       VAL  46  10.787   5.478  -6.737
  236   1HG1  VAL  46           HG12     VAL  46  12.388   6.968  -7.927
  237   2HG1  VAL  46           HG11     VAL  46  13.455   7.021  -6.497
  238   3HG1  VAL  46           HG13     VAL  46  13.198   5.488  -7.361
  239   1HG2  VAL  46           HG21     VAL  46  11.060   4.888  -4.325
  240   2HG2  VAL  46           HG23     VAL  46  12.424   4.278  -5.292
  241   3HG2  VAL  46           HG22     VAL  46  12.638   5.720  -4.272
  242    H    SER  47           H        SER  47   9.978   9.831  -5.160
  243    HA   SER  47           HA       SER  47  12.673  10.790  -4.691
  244   1HB   SER  47           HB2      SER  47  10.989  12.287  -5.663
  245   2HB   SER  47           HB1      SER  47   9.958  12.167  -4.227
  246    HG   SER  47           HG       SER  47  12.600  13.293  -4.217
  247    H    LYS  48           H        LYS  48   9.764  10.664  -2.512
  248    HA   LYS  48           HA       LYS  48  11.481   9.361  -0.432
  249   1HB   LYS  48           HB2      LYS  48  10.457  10.968   1.288
  250   2HB   LYS  48           HB1      LYS  48  11.612  11.699   0.153
  251   1HG   LYS  48           HG2      LYS  48   9.594  13.142   0.552
  252   2HG   LYS  48           HG1      LYS  48   9.860  12.732  -1.162
  253   1HD   LYS  48           HD2      LYS  48   7.987  11.098  -1.105
  254   2HD   LYS  48           HD1      LYS  48   7.838  11.276   0.662
  255   1HE   LYS  48           HE2      LYS  48   6.105  12.512  -0.702
  256   2HE   LYS  48           HE1      LYS  48   7.013  13.590   0.381
  257   1HZ   LYS  48           HZ1      LYS  48   7.699  13.227  -2.556
  258   2HZ   LYS  48           HZ3      LYS  48   6.610  14.446  -1.975
  259   3HZ   LYS  48           HZ2      LYS  48   8.268  14.473  -1.466
  260    H    VAL  49           H        VAL  49   8.828   8.707  -2.243
  261    HA   VAL  49           HA       VAL  49   6.662   8.405  -0.763
  262    HB   VAL  49           HB       VAL  49   6.868   7.530  -3.046
  263   1HG1  VAL  49           HG11     VAL  49   8.681   5.303  -1.921
  264   2HG1  VAL  49           HG13     VAL  49   8.015   5.365  -3.580
  265   3HG1  VAL  49           HG12     VAL  49   9.137   6.596  -2.953
  266   1HG2  VAL  49           HG22     VAL  49   5.828   5.438  -1.035
  267   2HG2  VAL  49           HG21     VAL  49   4.942   6.721  -1.883
  268   3HG2  VAL  49           HG23     VAL  49   5.602   5.341  -2.805
  269    H    ASP  50           H        ASP  50   5.911   7.239   1.134
  270    HA   ASP  50           HA       ASP  50   8.114   6.025   2.713
  271   1HB   ASP  50           HB2      ASP  50   6.549   7.756   3.638
  272   2HB   ASP  50           HB1      ASP  50   5.208   6.588   3.524
  273    H    GLN  51           H        GLN  51   8.229   4.182   0.986
  274    HA   GLN  51           HA       GLN  51   5.914   2.367   0.951
  275   1HB   GLN  51           HB2      GLN  51   8.737   1.790  -0.045
  276   2HB   GLN  51           HB1      GLN  51   7.281   0.819  -0.380
  277   1HG   GLN  51           HG2      GLN  51   6.224   2.624  -1.620
  278   2HG   GLN  51           HG1      GLN  51   7.422   3.767  -1.115
  279   1HE2  GLN  51           HE22     GLN  51   9.986   2.382  -3.466
  280   2HE2  GLN  51           HE21     GLN  51   9.971   2.644  -1.771
  281    H    ALA  52           H        ALA  52   9.245   2.549   2.435
  282    HA   ALA  52           HA       ALA  52   9.316   0.099   3.689
  283   1HB   ALA  52           HB3      ALA  52  11.180   1.734   3.826
  284   2HB   ALA  52           HB2      ALA  52  10.193   2.795   4.881
  285   3HB   ALA  52           HB1      ALA  52  10.709   1.176   5.461
  286    H    GLY  53           H        GLY  53   7.244   2.973   4.546
  287   1HA   GLY  53           HA1      GLY  53   6.183   1.561   6.929
  288   2HA   GLY  53           HA2      GLY  53   5.599   3.097   6.259
  289    H    LEU  54           H        LEU  54   5.222   2.261   3.464
  290    HA   LEU  54           HA       LEU  54   2.564   1.384   3.948
  291   1HB   LEU  54           HB2      LEU  54   3.586   2.807   1.963
  292   2HB   LEU  54           HB1      LEU  54   3.761   1.265   1.121
  293    HG   LEU  54           HG       LEU  54   1.010   1.675   2.282
  294   1HD1  LEU  54           HD11     LEU  54   2.169   3.884   0.570
  295   2HD1  LEU  54           HD13     LEU  54   0.435   3.461   0.450
  296   3HD1  LEU  54           HD12     LEU  54   1.180   3.940   1.985
  297   1HD2  LEU  54           HD21     LEU  54   1.462  -0.108   0.577
  298   2HD2  LEU  54           HD23     LEU  54   0.219   1.044   0.038
  299   3HD2  LEU  54           HD22     LEU  54   1.868   1.156  -0.611
  300    H    LYS  55           H        LYS  55   5.486  -0.504   3.457
  301    HA   LYS  55           HA       LYS  55   3.949  -2.717   2.385
  302   1HB   LYS  55           HB2      LYS  55   5.927  -3.844   2.071
  303   2HB   LYS  55           HB1      LYS  55   6.560  -2.176   2.044
  304   1HG   LYS  55           HG2      LYS  55   6.667  -4.312   4.310
  305   2HG   LYS  55           HG1      LYS  55   7.916  -3.975   3.086
  306   1HD   LYS  55           HD2      LYS  55   7.642  -1.467   4.071
  307   2HD   LYS  55           HD1      LYS  55   7.287  -2.383   5.555
  308   1HE   LYS  55           HE2      LYS  55   9.811  -2.595   3.783
  309   2HE   LYS  55           HE1      LYS  55   9.696  -1.869   5.407
  310   1HZ   LYS  55           HZ2      LYS  55   9.101  -4.115   6.313
  311   2HZ   LYS  55           HZ1      LYS  55   9.332  -4.831   4.748
  312   3HZ   LYS  55           HZ3      LYS  55  10.669  -4.092   5.561
  313    H    LYS  56           H        LYS  56   5.012  -1.686   5.554
  314    HA   LYS  56           HA       LYS  56   3.940  -4.243   6.699
  315   1HB   LYS  56           HB2      LYS  56   5.070  -3.680   8.746
  316   2HB   LYS  56           HB1      LYS  56   6.205  -3.611   7.369
  317   1HG   LYS  56           HG2      LYS  56   5.876  -1.004   7.417
  318   2HG   LYS  56           HG1      LYS  56   4.960  -1.246   8.912
  319   1HD   LYS  56           HD2      LYS  56   7.931  -1.979   8.351
  320   2HD   LYS  56           HD1      LYS  56   7.329  -0.554   9.227
  321   1HE   LYS  56           HE2      LYS  56   7.804  -1.859  11.075
  322   2HE   LYS  56           HE1      LYS  56   6.150  -2.447  10.791
  323   1HZ   LYS  56           HZ2      LYS  56   7.212  -4.398   9.527
  324   2HZ   LYS  56           HZ1      LYS  56   8.771  -3.737   9.914
  325   3HZ   LYS  56           HZ3      LYS  56   7.712  -4.284  11.179
  326    H    LEU  57           H        LEU  57   3.011  -0.836   6.276
  327    HA   LEU  57           HA       LEU  57   0.891  -1.213   8.333
  328   1HB   LEU  57           HB2      LEU  57   2.645   0.808   8.151
  329   2HB   LEU  57           HB1      LEU  57   1.541   1.385   6.882
  330    HG   LEU  57           HG       LEU  57   1.067   0.928   9.909
  331   1HD1  LEU  57           HD12     LEU  57   2.094   3.125   9.099
  332   2HD1  LEU  57           HD11     LEU  57   0.616   3.384   8.127
  333   3HD1  LEU  57           HD13     LEU  57   0.512   3.366   9.902
  334   1HD2  LEU  57           HD22     LEU  57  -1.124   1.477   7.822
  335   2HD2  LEU  57           HD21     LEU  57  -1.020   0.085   8.960
  336   3HD2  LEU  57           HD23     LEU  57  -1.305   1.704   9.592
  337    H    GLY  58           H        GLY  58   1.402  -0.462   4.752
  338   1HA   GLY  58           HA1      GLY  58  -1.521  -0.115   4.404
  339   2HA   GLY  58           HA2      GLY  58  -0.272   0.039   3.165
  340    H    ALA  59           H        ALA  59   1.207  -2.260   3.198
  341    HA   ALA  59           HA       ALA  59  -0.833  -4.392   2.608
  342   1HB   ALA  59           HB3      ALA  59   0.144  -3.244   0.598
  343   2HB   ALA  59           HB2      ALA  59   1.781  -3.642   1.190
  344   3HB   ALA  59           HB1      ALA  59   0.677  -4.939   0.658
  345    H    ALA  60           H        ALA  60   1.236  -6.472   2.313
  346    HA   ALA  60           HA       ALA  60   2.826  -6.369   4.795
  347   1HB   ALA  60           HB3      ALA  60   0.495  -7.157   5.529
  348   2HB   ALA  60           HB2      ALA  60   0.836  -8.707   4.757
  349   3HB   ALA  60           HB1      ALA  60   1.914  -8.110   6.033
  350    H    GLY  61           H        GLY  61   4.023  -6.339   2.491
  351   1HA   GLY  61           HA1      GLY  61   5.857  -8.208   2.313
  352   2HA   GLY  61           HA2      GLY  61   4.519  -9.162   1.637
  353    H    VAL  62           H        VAL  62   6.310  -5.991   1.154
  354    HA   VAL  62           HA       VAL  62   5.469  -6.198  -1.718
  355    HB   VAL  62           HB       VAL  62   5.326  -3.807  -1.862
  356   1HG1  VAL  62           HG11     VAL  62   4.265  -4.504   0.893
  357   2HG1  VAL  62           HG13     VAL  62   4.133  -2.873   0.127
  358   3HG1  VAL  62           HG12     VAL  62   3.388  -4.306  -0.543
  359   1HG2  VAL  62           HG22     VAL  62   7.390  -3.608   0.321
  360   2HG2  VAL  62           HG21     VAL  62   7.468  -3.156  -1.381
  361   3HG2  VAL  62           HG23     VAL  62   6.438  -2.206  -0.304
  362    H    VAL  63           H        VAL  63   7.035  -5.095  -3.249
  363    HA   VAL  63           HA       VAL  63   9.808  -5.510  -2.324
  364    HB   VAL  63           HB       VAL  63  10.188  -7.475  -3.408
  365   1HG1  VAL  63           HG11     VAL  63   7.155  -7.509  -3.921
  366   2HG1  VAL  63           HG13     VAL  63   8.247  -8.889  -4.172
  367   3HG1  VAL  63           HG12     VAL  63   8.030  -8.209  -2.545
  368   1HG2  VAL  63           HG22     VAL  63   8.841  -6.350  -5.927
  369   2HG2  VAL  63           HG21     VAL  63  10.570  -6.292  -5.513
  370   3HG2  VAL  63           HG23     VAL  63   9.776  -7.856  -5.821
  371    H    VAL  64           H        VAL  64  11.243  -4.017  -3.412
  372    HA   VAL  64           HA       VAL  64   9.786  -2.187  -5.299
  373    HB   VAL  64           HB       VAL  64  12.198  -1.641  -3.523
  374   1HG1  VAL  64           HG12     VAL  64  11.986  -0.229  -5.651
  375   2HG1  VAL  64           HG11     VAL  64  10.394   0.336  -5.067
  376   3HG1  VAL  64           HG13     VAL  64  11.866   0.722  -4.143
  377   1HG2  VAL  64           HG21     VAL  64  10.127  -2.017  -2.133
  378   2HG2  VAL  64           HG23     VAL  64  10.658  -0.314  -2.083
  379   3HG2  VAL  64           HG22     VAL  64   9.264  -0.779  -3.089
  380    H    ALA  65           H        ALA  65  10.579  -2.282  -7.474
  381    HA   ALA  65           HA       ALA  65  13.387  -3.298  -7.866
  382   1HB   ALA  65           HB2      ALA  65  10.813  -4.326  -9.225
  383   2HB   ALA  65           HB1      ALA  65  12.484  -4.778  -9.675
  384   3HB   ALA  65           HB3      ALA  65  11.827  -5.239  -8.076
  385    H    GLY  66           H        GLY  66  14.047  -1.062  -8.495
  386   1HA   GLY  66           HA1      GLY  66  12.829   0.871  -9.771
  387   2HA   GLY  66           HA2      GLY  66  14.434   0.377 -10.352
  388    H    SER  67           H        SER  67  11.223   0.887 -11.454
  389    HA   SER  67           HA       SER  67  10.776   0.459 -13.836
  390   1HB   SER  67           HB2      SER  67  11.659  -2.422 -13.255
  391   2HB   SER  67           HB1      SER  67  10.776  -1.853 -14.701
  392    HG   SER  67           HG       SER  67  13.105  -1.845 -15.065
  393    H    GLY  68           H        GLY  68  10.131  -1.251 -10.726
  394   1HA   GLY  68           HA1      GLY  68   7.398  -0.687 -10.977
  395   2HA   GLY  68           HA2      GLY  68   7.629  -2.411 -11.408
  396    H    VAL  69           H        VAL  69   6.091  -1.757  -9.109
  397    HA   VAL  69           HA       VAL  69   7.946  -2.573  -6.914
  398    HB   VAL  69           HB       VAL  69   5.827  -0.418  -6.627
  399   1HG1  VAL  69           HG11     VAL  69   7.633  -1.820  -4.561
  400   2HG1  VAL  69           HG13     VAL  69   6.933  -0.232  -4.258
  401   3HG1  VAL  69           HG12     VAL  69   5.869  -1.637  -4.573
  402   1HG2  VAL  69           HG22     VAL  69   8.880  -0.268  -6.794
  403   2HG2  VAL  69           HG21     VAL  69   7.671   0.564  -7.797
  404   3HG2  VAL  69           HG23     VAL  69   7.911   1.057  -6.106
  405    H    GLN  70           H        GLN  70   7.067  -4.543  -6.197
  406    HA   GLN  70           HA       GLN  70   4.205  -5.072  -6.852
  407   1HB   GLN  70           HB2      GLN  70   5.629  -6.843  -7.540
  408   2HB   GLN  70           HB1      GLN  70   6.571  -6.790  -6.039
  409   1HG   GLN  70           HG2      GLN  70   4.686  -7.555  -4.689
  410   2HG   GLN  70           HG1      GLN  70   3.684  -7.656  -6.177
  411   1HE2  GLN  70           HE22     GLN  70   5.443 -10.612  -7.437
  412   2HE2  GLN  70           HE21     GLN  70   4.640  -9.182  -7.974
  413    H    ALA  71           H        ALA  71   2.719  -5.769  -5.056
  414    HA   ALA  71           HA       ALA  71   3.659  -5.288  -2.487
  415   1HB   ALA  71           HB2      ALA  71   2.058  -3.041  -3.740
  416   2HB   ALA  71           HB1      ALA  71   1.609  -3.491  -2.074
  417   3HB   ALA  71           HB3      ALA  71   3.253  -2.924  -2.499
  418    H    ILE  72           H        ILE  72   2.659  -6.586  -0.906
  419    HA   ILE  72           HA       ILE  72   0.153  -7.833  -1.762
  420    HB   ILE  72           HB       ILE  72   2.921  -9.007  -1.938
  421   1HG1  ILE  72           HG12     ILE  72   1.203 -10.797  -3.347
  422   2HG1  ILE  72           HG11     ILE  72   0.410  -9.229  -3.490
  423   1HG2  ILE  72           HG21     ILE  72   0.810 -10.785  -0.643
  424   2HG2  ILE  72           HG23     ILE  72   2.369 -11.328  -1.321
  425   3HG2  ILE  72           HG22     ILE  72   2.370 -10.210   0.049
  426   1HD1  ILE  72           HD12     ILE  72   2.463  -8.200  -4.293
  427   2HD1  ILE  72           HD11     ILE  72   3.330  -9.775  -4.187
  428   3HD1  ILE  72           HD13     ILE  72   2.019  -9.547  -5.371
  429    H    PHE  73           H        PHE  73  -0.925  -9.052  -0.069
  430    HA   PHE  73           HA       PHE  73   0.307  -8.519   2.613
  431   1HB   PHE  73           HB2      PHE  73  -2.176  -8.166   3.320
  432   2HB   PHE  73           HB1      PHE  73  -1.191  -6.806   2.787
  433    HD1  PHE  73           HD1      PHE  73  -1.194  -6.423   0.054
  434    HD2  PHE  73           HD2      PHE  73  -4.453  -7.593   2.570
  435    HE1  PHE  73           HE1      PHE  73  -2.752  -6.164  -1.837
  436    HE2  PHE  73           HE2      PHE  73  -6.038  -7.159   0.735
  437    HZ   PHE  73           HZ       PHE  73  -5.186  -6.517  -1.519
  438    H    GLY  74           H        GLY  74   1.259 -10.560   2.048
  439   1HA   GLY  74           HA1      GLY  74   0.239 -12.774   1.094
  440   2HA   GLY  74           HA2      GLY  74   1.280 -12.835   2.523
  441    H    THR  75           H        THR  75   0.357 -13.461   4.562
  442    HA   THR  75           HA       THR  75  -2.579 -14.058   4.498
  443    HB   THR  75           HB       THR  75  -1.248 -15.998   5.083
  444    HG1  THR  75           HG1      THR  75  -2.508 -16.337   7.058
  445   1HG2  THR  75           HG22     THR  75  -0.182 -14.280   7.433
  446   2HG2  THR  75           HG21     THR  75  -0.077 -16.059   7.371
  447   3HG2  THR  75           HG23     THR  75   0.790 -15.092   6.167
  448    H    LYS  76           H        LYS  76  -0.166 -11.856   6.065
  449    HA   LYS  76           HA       LYS  76  -1.892 -11.252   8.279
  450   1HB   LYS  76           HB2      LYS  76   0.423  -9.767   6.963
  451   2HB   LYS  76           HB1      LYS  76  -0.438  -9.062   8.336
  452   1HG   LYS  76           HG2      LYS  76   0.980 -11.789   8.433
  453   2HG   LYS  76           HG1      LYS  76   1.624 -10.262   9.042
  454   1HD   LYS  76           HD2      LYS  76  -0.863 -10.286  10.352
  455   2HD   LYS  76           HD1      LYS  76  -0.546 -12.024  10.198
  456   1HE   LYS  76           HE2      LYS  76   0.301 -11.300  12.341
  457   2HE   LYS  76           HE1      LYS  76   1.747 -11.572  11.330
  458   1HZ   LYS  76           HZ1      LYS  76   0.436  -8.879  11.891
  459   2HZ   LYS  76           HZ3      LYS  76   1.842  -9.485  12.687
  460   3HZ   LYS  76           HZ2      LYS  76   1.916  -9.097  11.002
  461    H    SER  77           H        SER  77  -2.483 -10.516   4.921
  462    HA   SER  77           HA       SER  77  -3.861  -8.189   4.866
  463   1HB   SER  77           HB2      SER  77  -4.086  -9.882   3.160
  464   2HB   SER  77           HB1      SER  77  -4.911 -11.031   4.247
  465    HG   SER  77           HG       SER  77  -6.727  -9.522   4.156
  466    H    ASP  78           H        ASP  78  -4.967 -10.937   7.047
  467    HA   ASP  78           HA       ASP  78  -7.373  -9.576   7.740
  468   1HB   ASP  78           HB2      ASP  78  -5.624 -11.348   9.559
  469   2HB   ASP  78           HB1      ASP  78  -7.319 -10.877   9.862
  470    H    ASN  79           H        ASN  79  -4.058  -9.388   9.283
  471    HA   ASN  79           HA       ASN  79  -4.796  -7.412  11.193
  472   1HB   ASN  79           HB2      ASN  79  -2.636  -8.647  11.337
  473   2HB   ASN  79           HB1      ASN  79  -2.087  -7.899   9.816
  474   1HD2  ASN  79           HD22     ASN  79  -0.480  -5.441  11.854
  475   2HD2  ASN  79           HD21     ASN  79  -0.248  -6.675  10.673
  476    H    LEU  80           H        LEU  80  -3.587  -7.063   7.752
  477    HA   LEU  80           HA       LEU  80  -3.259  -4.183   8.140
  478   1HB   LEU  80           HB2      LEU  80  -3.191  -5.975   5.656
  479   2HB   LEU  80           HB1      LEU  80  -3.141  -4.208   5.520
  480    HG   LEU  80           HG       LEU  80  -0.925  -5.378   5.468
  481   1HD1  LEU  80           HD12     LEU  80  -1.064  -3.000   5.839
  482   2HD1  LEU  80           HD11     LEU  80  -1.239  -3.197   7.610
  483   3HD1  LEU  80           HD13     LEU  80   0.281  -3.635   6.806
  484   1HD2  LEU  80           HD21     LEU  80  -1.228  -7.028   7.354
  485   2HD2  LEU  80           HD23     LEU  80   0.198  -5.996   7.637
  486   3HD2  LEU  80           HD22     LEU  80  -1.298  -5.686   8.540
  487    H    LYS  81           H        LYS  81  -5.726  -6.248   6.381
  488    HA   LYS  81           HA       LYS  81  -7.378  -4.190   5.584
  489   1HB   LYS  81           HB2      LYS  81  -8.198  -6.874   6.820
  490   2HB   LYS  81           HB1      LYS  81  -9.395  -5.718   6.152
  491   1HG   LYS  81           HG2      LYS  81  -8.160  -5.766   3.925
  492   2HG   LYS  81           HG1      LYS  81  -7.207  -7.130   4.538
  493   1HD   LYS  81           HD2      LYS  81 -10.260  -6.983   4.097
  494   2HD   LYS  81           HD1      LYS  81  -9.090  -8.014   3.238
  495   1HE   LYS  81           HE2      LYS  81  -8.677  -9.239   5.476
  496   2HE   LYS  81           HE1      LYS  81  -9.998  -8.277   6.178
  497   1HZ   LYS  81           HZ2      LYS  81 -11.551  -9.188   4.479
  498   2HZ   LYS  81           HZ1      LYS  81 -10.272 -10.157   3.811
  499   3HZ   LYS  81           HZ3      LYS  81 -10.826 -10.454   5.425
  500    H    THR  82           H        THR  82  -6.972  -5.478   9.002
  501    HA   THR  82           HA       THR  82  -9.113  -3.863  10.046
  502    HB   THR  82           HB       THR  82  -6.643  -5.100  11.331
  503    HG1  THR  82           HG1      THR  82  -9.448  -5.464  11.795
  504   1HG2  THR  82           HG22     THR  82  -8.571  -3.137  12.701
  505   2HG2  THR  82           HG21     THR  82  -7.485  -4.281  13.551
  506   3HG2  THR  82           HG23     THR  82  -6.790  -2.986  12.536
  507    H    GLU  83           H        GLU  83  -5.546  -3.153   9.547
  508    HA   GLU  83           HA       GLU  83  -5.783  -0.506  10.633
  509   1HB   GLU  83           HB2      GLU  83  -3.818  -1.499   8.475
  510   2HB   GLU  83           HB1      GLU  83  -3.705   0.051   9.344
  511   1HG   GLU  83           HG2      GLU  83  -3.500  -2.753  10.627
  512   2HG   GLU  83           HG1      GLU  83  -2.165  -1.623  10.348
  513    H    MET  84           H        MET  84  -6.303  -1.809   7.254
  514    HA   MET  84           HA       MET  84  -6.727   0.805   6.146
  515   1HB   MET  84           HB2      MET  84  -7.989  -1.820   5.145
  516   2HB   MET  84           HB1      MET  84  -7.867  -0.267   4.275
  517   1HG   MET  84           HG2      MET  84  -5.300  -0.501   4.365
  518   2HG   MET  84           HG1      MET  84  -5.531  -2.150   5.023
  519   1HE   MET  84           HE2      MET  84  -4.183  -3.166   2.989
  520   2HE   MET  84           HE1      MET  84  -5.598  -4.233   3.245
  521   3HE   MET  84           HE3      MET  84  -5.112  -3.759   1.581
  522    H    ASP  85           H        ASP  85  -8.831  -1.649   7.855
  523    HA   ASP  85           HA       ASP  85 -11.277  -0.532   7.140
  524   1HB   ASP  85           HB2      ASP  85 -11.065  -2.703   8.386
  525   2HB   ASP  85           HB1      ASP  85 -10.668  -1.787   9.870
  526    H    GLU  86           H        GLU  86  -8.968   0.262   9.882
  527    HA   GLU  86           HA       GLU  86 -10.541   2.317  10.962
  528   1HB   GLU  86           HB2      GLU  86  -7.502   1.974  10.946
  529   2HB   GLU  86           HB1      GLU  86  -8.238   3.484  11.538
  530   1HG   GLU  86           HG2      GLU  86  -9.678   2.203  13.152
  531   2HG   GLU  86           HG1      GLU  86  -8.800   0.708  12.708
  532    H    TYR  87           H        TYR  87  -8.021   2.568   8.278
  533    HA   TYR  87           HA       TYR  87  -8.151   5.271   7.917
  534   1HB   TYR  87           HB1      TYR  87  -6.738   4.319   6.293
  535   2HB   TYR  87           HB2      TYR  87  -7.854   3.009   5.980
  536    HD1  TYR  87           HD2      TYR  87  -8.759   6.668   5.483
  537    HD2  TYR  87           HD1      TYR  87  -7.895   2.864   3.657
  538    HE1  TYR  87           HE2      TYR  87  -9.364   7.584   3.311
  539    HE2  TYR  87           HE1      TYR  87  -8.616   3.766   1.489
  540    HH   TYR  87           HH       TYR  87  -9.773   7.107   1.007
  541    H    ILE  88           H        ILE  88 -10.531   3.041   6.281
  542    HA   ILE  88           HA       ILE  88 -11.920   5.280   5.197
  543    HB   ILE  88           HB       ILE  88 -13.346   2.639   5.754
  544   1HG1  ILE  88           HG12     ILE  88 -12.426   2.534   3.034
  545   2HG1  ILE  88           HG11     ILE  88 -11.021   3.134   3.916
  546   1HG2  ILE  88           HG22     ILE  88 -14.744   4.568   4.972
  547   2HG2  ILE  88           HG21     ILE  88 -13.696   4.741   3.531
  548   3HG2  ILE  88           HG23     ILE  88 -14.680   3.264   3.758
  549   1HD1  ILE  88           HD12     ILE  88 -11.466   1.105   5.553
  550   2HD1  ILE  88           HD11     ILE  88 -12.598   0.504   4.337
  551   3HD1  ILE  88           HD13     ILE  88 -10.863   0.692   3.929
  552    H    ARG  89           H        ARG  89 -12.468   3.346   8.229
  553    HA   ARG  89           HA       ARG  89 -14.809   4.792   9.036
  554   1HB   ARG  89           HB2      ARG  89 -12.640   3.351  10.660
  555   2HB   ARG  89           HB1      ARG  89 -14.101   4.031  11.408
  556   1HG   ARG  89           HG2      ARG  89 -15.581   2.538  10.277
  557   2HG   ARG  89           HG1      ARG  89 -14.375   2.057   9.062
  558   1HD   ARG  89           HD2      ARG  89 -13.135   0.733  10.604
  559   2HD   ARG  89           HD1      ARG  89 -13.890   1.374  12.035
  560    HE   ARG  89           HE       ARG  89 -14.956  -0.633  10.082
  561   1HH1  ARG  89           HH11     ARG  89 -15.921   1.570  12.791
  562   2HH1  ARG  89           HH12     ARG  89 -17.313   0.574  13.171
  563   1HH2  ARG  89           HH21     ARG  89 -16.791  -1.781  10.628
  564   2HH2  ARG  89           HH22     ARG  89 -17.819  -1.257  11.961
  565    H    ASN  90           H        ASN  90 -11.317   5.637   9.237
  566    HA   ASN  90           HA       ASN  90 -11.832   7.900  11.040
  567   1HB   ASN  90           HB2      ASN  90  -9.663   6.670  11.149
  568   2HB   ASN  90           HB1      ASN  90  -9.334   7.055   9.445
  569   1HD2  ASN  90           HD22     ASN  90  -9.046  10.112  12.270
  570   2HD2  ASN  90           HD21     ASN  90 -10.081   8.778  12.618
  571    H    PHE  91           H        PHE  91 -11.979   7.316   7.516
  572    HA   PHE  91           HA       PHE  91 -12.121  10.294   7.116
  573   1HB   PHE  91           HB2      PHE  91 -10.020   8.539   6.336
  574   2HB   PHE  91           HB1      PHE  91 -11.011   8.619   4.880
  575    HD1  PHE  91           HD1      PHE  91  -9.294  10.615   7.552
  576    HD2  PHE  91           HD2      PHE  91 -10.802  10.695   3.519
  577    HE1  PHE  91           HE1      PHE  91  -8.039  12.705   7.126
  578    HE2  PHE  91           HE2      PHE  91  -9.545  12.789   3.098
  579    HZ   PHE  91           HZ       PHE  91  -8.145  13.786   4.890
  580    H    GLY  92           H        GLY  92 -14.381   8.564   7.730
  581   1HA   GLY  92           HA1      GLY  92 -15.448   7.414   5.349
  582   2HA   GLY  92           HA2      GLY  92 -16.402   7.850   6.787
   
  No H/Q in entry =         582
  Start of MODEL    4
    1    H    MET  15           H        MET  15  -2.958   8.815  11.608
    2    HA   MET  15           HA       MET  15  -1.506   9.888   9.265
    3   1HB   MET  15           HB2      MET  15  -0.235   8.251  11.545
    4   2HB   MET  15           HB1      MET  15   0.571   9.253  10.298
    5   1HG   MET  15           HG2      MET  15  -0.834  11.260  11.295
    6   2HG   MET  15           HG1      MET  15  -1.122  10.200  12.706
    7   1HE   MET  15           HE2      MET  15   0.760   9.593  14.493
    8   2HE   MET  15           HE1      MET  15   1.596   8.635  13.220
    9   3HE   MET  15           HE3      MET  15   2.513   9.827  14.195
   10    H    ALA  16           H        ALA  16  -2.376   6.669  10.830
   11    HA   ALA  16           HA       ALA  16  -1.225   5.121   8.806
   12   1HB   ALA  16           HB3      ALA  16  -2.147   4.150  10.898
   13   2HB   ALA  16           HB2      ALA  16  -3.811   4.439  10.327
   14   3HB   ALA  16           HB1      ALA  16  -2.745   3.309   9.454
   15    HA   PRO  17           HA       PRO  17  -5.057   5.627   6.041
   16   1HB   PRO  17           HB2      PRO  17  -6.443   8.115   6.258
   17   2HB   PRO  17           HB1      PRO  17  -7.032   6.549   6.823
   18   1HG   PRO  17           HG2      PRO  17  -5.910   8.800   8.431
   19   2HG   PRO  17           HG1      PRO  17  -6.902   7.423   9.010
   20   1HD   PRO  17           HD2      PRO  17  -4.134   7.793   9.385
   21   2HD   PRO  17           HD1      PRO  17  -5.044   6.290   9.741
   22    H    ALA  18           H        ALA  18  -3.356   8.708   7.137
   23    HA   ALA  18           HA       ALA  18  -3.045   9.755   4.487
   24   1HB   ALA  18           HB3      ALA  18  -2.426  11.065   6.574
   25   2HB   ALA  18           HB2      ALA  18  -1.026   9.970   6.807
   26   3HB   ALA  18           HB1      ALA  18  -1.109  11.011   5.360
   27    H    LEU  19           H        LEU  19  -1.427   7.092   6.351
   28    HA   LEU  19           HA       LEU  19   0.866   7.052   4.686
   29   1HB   LEU  19           HB2      LEU  19   0.507   5.941   7.042
   30   2HB   LEU  19           HB1      LEU  19  -0.113   4.570   6.107
   31    HG   LEU  19           HG       LEU  19   2.167   4.113   6.586
   32   1HD1  LEU  19           HD12     LEU  19   1.583   3.694   4.198
   33   2HD1  LEU  19           HD11     LEU  19   2.247   5.292   3.718
   34   3HD1  LEU  19           HD13     LEU  19   3.322   4.071   4.405
   35   1HD2  LEU  19           HD21     LEU  19   2.901   6.404   7.331
   36   2HD2  LEU  19           HD23     LEU  19   4.083   5.612   6.265
   37   3HD2  LEU  19           HD22     LEU  19   3.044   6.911   5.622
   38    H    VAL  20           H        VAL  20  -1.976   4.573   4.655
   39    HA   VAL  20           HA       VAL  20  -1.435   3.507   2.239
   40    HB   VAL  20           HB       VAL  20  -3.369   2.780   3.474
   41   1HG1  VAL  20           HG12     VAL  20  -4.280   4.968   4.063
   42   2HG1  VAL  20           HG11     VAL  20  -4.878   5.252   2.404
   43   3HG1  VAL  20           HG13     VAL  20  -5.559   3.926   3.400
   44   1HG2  VAL  20           HG21     VAL  20  -3.176   2.143   1.031
   45   2HG2  VAL  20           HG23     VAL  20  -4.883   2.264   1.545
   46   3HG2  VAL  20           HG22     VAL  20  -4.154   3.575   0.592
   47    H    ALA  21           H        ALA  21  -2.823   6.835   2.748
   48    HA   ALA  21           HA       ALA  21  -3.451   7.176   0.038
   49   1HB   ALA  21           HB3      ALA  21  -4.340   8.720   1.772
   50   2HB   ALA  21           HB2      ALA  21  -2.704   9.418   1.983
   51   3HB   ALA  21           HB1      ALA  21  -3.557   9.606   0.426
   52    H    ALA  22           H        ALA  22  -0.389   7.766   1.892
   53    HA   ALA  22           HA       ALA  22   1.083   9.195   0.066
   54   1HB   ALA  22           HB3      ALA  22   1.926   8.432   2.349
   55   2HB   ALA  22           HB2      ALA  22   2.194   6.805   1.655
   56   3HB   ALA  22           HB1      ALA  22   3.121   8.202   1.047
   57    H    PHE  23           H        PHE  23  -0.044   5.888  -0.671
   58    HA   PHE  23           HA       PHE  23   1.555   6.150  -3.155
   59   1HB   PHE  23           HB2      PHE  23   2.798   4.854  -1.262
   60   2HB   PHE  23           HB1      PHE  23   1.585   3.545  -1.593
   61    HD1  PHE  23           HD2      PHE  23   3.457   5.663  -4.210
   62    HD2  PHE  23           HD1      PHE  23   3.284   1.940  -2.000
   63    HE1  PHE  23           HE2      PHE  23   5.495   4.810  -5.300
   64    HE2  PHE  23           HE1      PHE  23   4.861   0.943  -3.575
   65    HZ   PHE  23           HZ       PHE  23   5.820   2.337  -5.440
   66    H    GLY  24           H        GLY  24  -0.995   4.011  -1.482
   67   1HA   GLY  24           HA1      GLY  24  -2.151   3.360  -4.048
   68   2HA   GLY  24           HA2      GLY  24  -2.928   3.194  -2.452
   69    H    GLY  25           H        GLY  25  -2.423   6.227  -1.850
   70   1HA   GLY  25           HA1      GLY  25  -4.825   7.166  -3.377
   71   2HA   GLY  25           HA2      GLY  25  -4.122   7.958  -1.966
   72    H    LYS  26           H        LYS  26  -1.422   7.201  -3.925
   73    HA   LYS  26           HA       LYS  26  -1.244   9.993  -4.846
   74   1HB   LYS  26           HB2      LYS  26   0.380   7.456  -5.406
   75   2HB   LYS  26           HB1      LYS  26   0.774   9.050  -6.104
   76   1HG   LYS  26           HG2      LYS  26   0.624   8.454  -3.090
   77   2HG   LYS  26           HG1      LYS  26   2.108   8.340  -4.078
   78   1HD   LYS  26           HD2      LYS  26   1.213  10.917  -4.703
   79   2HD   LYS  26           HD1      LYS  26   0.734  10.796  -2.996
   80   1HE   LYS  26           HE2      LYS  26   3.587  10.189  -4.043
   81   2HE   LYS  26           HE1      LYS  26   3.054  11.794  -3.499
   82   1HZ   LYS  26           HZ1      LYS  26   3.077   9.332  -1.743
   83   2HZ   LYS  26           HZ3      LYS  26   4.261  10.594  -1.748
   84   3HZ   LYS  26           HZ2      LYS  26   2.637  10.956  -1.261
   85    H    GLU  27           H        GLU  27  -3.354  10.109  -6.057
   86    HA   GLU  27           HA       GLU  27  -4.077   8.014  -7.857
   87   1HB   GLU  27           HB2      GLU  27  -6.055   9.119  -8.089
   88   2HB   GLU  27           HB1      GLU  27  -5.448  10.336  -6.954
   89   1HG   GLU  27           HG2      GLU  27  -4.516  11.626  -8.972
   90   2HG   GLU  27           HG1      GLU  27  -5.317  10.424 -10.028
   91    H    ASN  28           H        ASN  28  -2.083  10.976  -8.311
   92    HA   ASN  28           HA       ASN  28  -1.928  11.214 -11.029
   93   1HB   ASN  28           HB2      ASN  28  -0.563  12.570  -9.476
   94   2HB   ASN  28           HB1      ASN  28   0.396  11.147  -8.993
   95   1HD2  ASN  28           HD22     ASN  28   2.636  11.535 -11.770
   96   2HD2  ASN  28           HD21     ASN  28   2.330  10.726 -10.276
   97    H    ILE  29           H        ILE  29  -0.578   8.539  -9.127
   98    HA   ILE  29           HA       ILE  29   1.059   7.114 -10.361
   99    HB   ILE  29           HB       ILE  29  -1.618   6.500  -9.211
  100   1HG1  ILE  29           HG12     ILE  29  -0.491   4.928  -7.837
  101   2HG1  ILE  29           HG11     ILE  29   0.716   4.613  -9.110
  102   1HG2  ILE  29           HG22     ILE  29  -2.179   5.324 -11.235
  103   2HG2  ILE  29           HG21     ILE  29  -0.735   4.283 -11.099
  104   3HG2  ILE  29           HG23     ILE  29  -2.011   4.217  -9.849
  105   1HD1  ILE  29           HD11     ILE  29   0.747   7.308  -7.706
  106   2HD1  ILE  29           HD13     ILE  29   1.503   5.883  -6.937
  107   3HD1  ILE  29           HD12     ILE  29   2.100   6.508  -8.486
  108    H    THR  30           H        THR  30   1.416   5.270 -11.706
  109    HA   THR  30           HA       THR  30   0.334   5.810 -14.453
  110    HB   THR  30           HB       THR  30   2.511   6.241 -14.956
  111    HG1  THR  30           HG1      THR  30   3.496   4.211 -15.632
  112   1HG2  THR  30           HG22     THR  30   3.449   4.477 -12.666
  113   2HG2  THR  30           HG21     THR  30   4.507   5.414 -13.754
  114   3HG2  THR  30           HG23     THR  30   3.408   6.273 -12.644
  115    H    ASN  31           H        ASN  31   1.555   2.927 -12.383
  116    HA   ASN  31           HA       ASN  31  -0.574   1.350 -13.766
  117   1HB   ASN  31           HB2      ASN  31   2.385   1.281 -14.353
  118   2HB   ASN  31           HB1      ASN  31   1.636  -0.308 -14.115
  119   1HD2  ASN  31           HD22     ASN  31  -0.463  -0.243 -16.994
  120   2HD2  ASN  31           HD21     ASN  31  -0.347  -0.895 -15.401
  121    H    LEU  32           H        LEU  32  -1.631   0.432 -11.960
  122    HA   LEU  32           HA       LEU  32   0.140  -0.984  -9.958
  123   1HB   LEU  32           HB2      LEU  32  -2.583   0.408  -9.748
  124   2HB   LEU  32           HB1      LEU  32  -2.153  -0.882  -8.602
  125    HG   LEU  32           HG       LEU  32  -0.452   0.393  -7.559
  126   1HD1  LEU  32           HD11     LEU  32  -0.509   2.349  -9.910
  127   2HD1  LEU  32           HD13     LEU  32   0.470   2.518  -8.407
  128   3HD1  LEU  32           HD12     LEU  32   0.829   1.244  -9.559
  129   1HD2  LEU  32           HD21     LEU  32  -2.684   1.205  -6.946
  130   2HD2  LEU  32           HD23     LEU  32  -1.478   2.513  -6.884
  131   3HD2  LEU  32           HD22     LEU  32  -2.618   2.421  -8.249
  132    H    ASP  33           H        ASP  33  -0.813  -3.079  -9.161
  133    HA   ASP  33           HA       ASP  33  -2.634  -4.359 -11.196
  134   1HB   ASP  33           HB2      ASP  33  -0.136  -5.585  -9.978
  135   2HB   ASP  33           HB1      ASP  33  -1.342  -6.475 -10.920
  136    H    ALA  34           H        ALA  34  -4.073  -3.423  -9.309
  137    HA   ALA  34           HA       ALA  34  -3.819  -4.539  -6.725
  138   1HB   ALA  34           HB3      ALA  34  -5.241  -2.586  -7.116
  139   2HB   ALA  34           HB2      ALA  34  -6.380  -3.586  -8.070
  140   3HB   ALA  34           HB1      ALA  34  -6.164  -3.895  -6.318
  141    H    CYS  35           H        CYS  35  -4.834  -6.478  -5.712
  142    HA   CYS  35           HA       CYS  35  -6.566  -8.113  -7.359
  143   1HB   CYS  35           HB2      CYS  35  -3.856  -8.420  -7.997
  144   2HB   CYS  35           HB1      CYS  35  -4.072  -9.693  -6.767
  145    HG   CYS  35           HG       CYS  35  -5.864 -10.740  -8.217
  146    H    ILE  36           H        ILE  36  -7.078 -10.292  -6.232
  147    HA   ILE  36           HA       ILE  36  -8.319  -9.929  -4.036
  148    HB   ILE  36           HB       ILE  36  -8.155 -12.224  -3.245
  149   1HG1  ILE  36           HG12     ILE  36  -5.901 -13.058  -3.439
  150   2HG1  ILE  36           HG11     ILE  36  -6.888 -13.980  -4.547
  151   1HG2  ILE  36           HG22     ILE  36  -9.629 -11.599  -5.184
  152   2HG2  ILE  36           HG21     ILE  36  -8.388 -12.207  -6.315
  153   3HG2  ILE  36           HG23     ILE  36  -9.154 -13.312  -5.156
  154   1HD1  ILE  36           HD11     ILE  36  -5.062 -11.671  -5.513
  155   2HD1  ILE  36           HD13     ILE  36  -4.683 -13.404  -5.518
  156   3HD1  ILE  36           HD12     ILE  36  -6.021 -12.780  -6.524
  157    H    THR  37           H        THR  37  -4.881 -11.096  -3.339
  158    HA   THR  37           HA       THR  37  -4.993  -9.402  -0.884
  159    HB   THR  37           HB       THR  37  -3.860 -11.338   0.255
  160    HG1  THR  37           HG1      THR  37  -4.014 -13.406  -0.894
  161   1HG2  THR  37           HG23     THR  37  -6.354 -10.971   0.548
  162   2HG2  THR  37           HG22     THR  37  -6.664 -12.049  -0.847
  163   3HG2  THR  37           HG21     THR  37  -5.935 -12.706   0.643
  164    H    ARG  38           H        ARG  38  -3.974  -8.854  -3.604
  165    HA   ARG  38           HA       ARG  38  -1.109  -8.719  -3.036
  166   1HB   ARG  38           HB2      ARG  38  -1.371 -10.965  -3.930
  167   2HB   ARG  38           HB1      ARG  38  -2.346 -10.374  -5.278
  168   1HG   ARG  38           HG2      ARG  38   0.302  -9.000  -5.131
  169   2HG   ARG  38           HG1      ARG  38   0.497 -10.765  -5.315
  170   1HD   ARG  38           HD2      ARG  38  -1.253  -9.153  -7.215
  171   2HD   ARG  38           HD1      ARG  38   0.458  -9.412  -7.464
  172    HE   ARG  38           HE       ARG  38  -1.807 -11.448  -7.345
  173   1HH1  ARG  38           HH11     ARG  38   1.726 -11.002  -8.152
  174   2HH1  ARG  38           HH12     ARG  38   1.767 -12.565  -8.938
  175   1HH2  ARG  38           HH21     ARG  38  -1.553 -13.427  -8.306
  176   2HH2  ARG  38           HH22     ARG  38  -0.013 -13.906  -9.007
  177    H    LEU  39           H        LEU  39  -0.767  -6.474  -3.456
  178    HA   LEU  39           HA       LEU  39  -1.937  -5.520  -6.021
  179   1HB   LEU  39           HB2      LEU  39  -2.444  -3.321  -5.048
  180   2HB   LEU  39           HB1      LEU  39  -3.268  -4.654  -4.240
  181    HG   LEU  39           HG       LEU  39  -1.220  -4.395  -2.467
  182   1HD1  LEU  39           HD12     LEU  39  -0.235  -2.424  -3.851
  183   2HD1  LEU  39           HD11     LEU  39  -1.674  -1.493  -3.421
  184   3HD1  LEU  39           HD13     LEU  39  -0.574  -2.055  -2.130
  185   1HD2  LEU  39           HD21     LEU  39  -3.699  -4.199  -1.895
  186   2HD2  LEU  39           HD23     LEU  39  -2.709  -2.997  -1.055
  187   3HD2  LEU  39           HD22     LEU  39  -3.691  -2.528  -2.471
  188    H    ARG  40           H        ARG  40  -0.572  -3.282  -6.604
  189    HA   ARG  40           HA       ARG  40   2.273  -3.834  -6.092
  190   1HB   ARG  40           HB2      ARG  40   1.341  -4.022  -8.999
  191   2HB   ARG  40           HB1      ARG  40   3.020  -4.181  -8.479
  192   1HG   ARG  40           HG2      ARG  40   2.363  -6.355  -7.257
  193   2HG   ARG  40           HG1      ARG  40   0.761  -6.129  -7.958
  194   1HD   ARG  40           HD2      ARG  40   2.359  -5.906 -10.265
  195   2HD   ARG  40           HD1      ARG  40   3.465  -6.833  -9.205
  196    HE   ARG  40           HE       ARG  40   0.806  -8.023  -9.248
  197   1HH1  ARG  40           HH11     ARG  40   3.684  -7.603 -11.357
  198   2HH1  ARG  40           HH12     ARG  40   3.321  -9.069 -12.258
  199   1HH2  ARG  40           HH21     ARG  40   0.419  -9.875 -10.442
  200   2HH2  ARG  40           HH22     ARG  40   1.500 -10.332 -11.760
  201    H    VAL  41           H        VAL  41   3.668  -1.977  -7.057
  202    HA   VAL  41           HA       VAL  41   1.863   0.261  -7.831
  203    HB   VAL  41           HB       VAL  41   3.887   0.584  -5.683
  204   1HG1  VAL  41           HG12     VAL  41   2.711   2.626  -6.688
  205   2HG1  VAL  41           HG11     VAL  41   1.121   1.933  -6.238
  206   3HG1  VAL  41           HG13     VAL  41   2.240   2.433  -4.985
  207   1HG2  VAL  41           HG22     VAL  41   1.049  -0.443  -5.143
  208   2HG2  VAL  41           HG21     VAL  41   2.583  -1.284  -4.761
  209   3HG2  VAL  41           HG23     VAL  41   2.152   0.204  -3.902
  210    H    SER  42           H        SER  42   3.019  -0.551  -9.964
  211    HA   SER  42           HA       SER  42   5.819   0.156 -10.146
  212   1HB   SER  42           HB2      SER  42   4.947  -1.452 -11.776
  213   2HB   SER  42           HB1      SER  42   3.741  -0.263 -12.360
  214    HG   SER  42           HG       SER  42   5.650  -0.249 -13.719
  215    H    VAL  43           H        VAL  43   6.351   2.319  -9.513
  216    HA   VAL  43           HA       VAL  43   5.372   4.351 -11.419
  217    HB   VAL  43           HB       VAL  43   4.442   5.785  -9.716
  218   1HG1  VAL  43           HG11     VAL  43   3.560   2.901  -8.995
  219   2HG1  VAL  43           HG13     VAL  43   2.813   4.334  -8.389
  220   3HG1  VAL  43           HG12     VAL  43   2.815   4.023 -10.163
  221   1HG2  VAL  43           HG21     VAL  43   6.274   5.417  -7.936
  222   2HG2  VAL  43           HG23     VAL  43   4.615   5.442  -7.310
  223   3HG2  VAL  43           HG22     VAL  43   5.479   3.874  -7.536
  224    H    ALA  44           H        ALA  44   6.438   6.578 -10.958
  225    HA   ALA  44           HA       ALA  44   9.225   6.095  -9.916
  226   1HB   ALA  44           HB3      ALA  44   9.063   6.535 -12.389
  227   2HB   ALA  44           HB2      ALA  44   8.264   8.098 -12.041
  228   3HB   ALA  44           HB1      ALA  44   9.950   7.816 -11.511
  229    H    ASP  45           H        ASP  45   6.318   7.587  -8.796
  230    HA   ASP  45           HA       ASP  45   7.676   9.964  -7.751
  231   1HB   ASP  45           HB2      ASP  45   5.099   8.600  -6.821
  232   2HB   ASP  45           HB1      ASP  45   5.708  10.189  -6.284
  233    H    VAL  46           H        VAL  46   9.604   8.212  -7.235
  234    HA   VAL  46           HA       VAL  46   9.173   7.166  -4.476
  235    HB   VAL  46           HB       VAL  46  10.025   5.505  -5.981
  236   1HG1  VAL  46           HG11     VAL  46  12.299   7.480  -6.613
  237   2HG1  VAL  46           HG13     VAL  46  12.423   5.725  -6.929
  238   3HG1  VAL  46           HG12     VAL  46  11.185   6.670  -7.765
  239   1HG2  VAL  46           HG21     VAL  46  10.877   5.481  -3.593
  240   2HG2  VAL  46           HG23     VAL  46  11.972   4.710  -4.752
  241   3HG2  VAL  46           HG22     VAL  46  12.351   6.337  -4.143
  242    H    SER  47           H        SER  47  10.131  10.114  -5.968
  243    HA   SER  47           HA       SER  47  12.309  11.108  -4.866
  244   1HB   SER  47           HB2      SER  47  10.668  12.567  -5.946
  245   2HB   SER  47           HB1      SER  47   9.480  12.292  -4.633
  246    HG   SER  47           HG       SER  47  10.674  14.294  -4.333
  247    H    LYS  48           H        LYS  48   9.308  10.680  -2.842
  248    HA   LYS  48           HA       LYS  48  11.061  10.094  -0.530
  249   1HB   LYS  48           HB2      LYS  48  10.448  11.934   0.845
  250   2HB   LYS  48           HB1      LYS  48  10.763  12.662  -0.746
  251   1HG   LYS  48           HG2      LYS  48   8.057  12.218   0.656
  252   2HG   LYS  48           HG1      LYS  48   8.794  13.738   0.113
  253   1HD   LYS  48           HD2      LYS  48   8.507  12.910  -2.304
  254   2HD   LYS  48           HD1      LYS  48   7.565  11.531  -1.627
  255   1HE   LYS  48           HE2      LYS  48   6.838  14.509  -1.462
  256   2HE   LYS  48           HE1      LYS  48   6.040  13.234  -2.425
  257   1HZ   LYS  48           HZ2      LYS  48   5.528  12.083  -0.206
  258   2HZ   LYS  48           HZ1      LYS  48   6.039  13.548   0.580
  259   3HZ   LYS  48           HZ3      LYS  48   4.678  13.560  -0.519
  260    H    VAL  49           H        VAL  49   8.963   8.611  -2.103
  261    HA   VAL  49           HA       VAL  49   6.536   8.593  -0.739
  262    HB   VAL  49           HB       VAL  49   7.044   7.451  -2.908
  263   1HG1  VAL  49           HG12     VAL  49   9.263   6.369  -2.193
  264   2HG1  VAL  49           HG11     VAL  49   8.345   5.258  -1.202
  265   3HG1  VAL  49           HG13     VAL  49   8.148   5.222  -2.981
  266   1HG2  VAL  49           HG22     VAL  49   5.701   5.608  -0.822
  267   2HG2  VAL  49           HG21     VAL  49   4.924   6.850  -1.849
  268   3HG2  VAL  49           HG23     VAL  49   5.672   5.401  -2.572
  269    H    ASP  50           H        ASP  50   5.642   7.126   0.986
  270    HA   ASP  50           HA       ASP  50   7.810   6.102   2.803
  271   1HB   ASP  50           HB2      ASP  50   6.129   7.886   3.531
  272   2HB   ASP  50           HB1      ASP  50   4.864   6.633   3.442
  273    H    GLN  51           H        GLN  51   7.861   4.329   0.884
  274    HA   GLN  51           HA       GLN  51   5.665   2.423   0.877
  275   1HB   GLN  51           HB2      GLN  51   8.613   1.964   0.157
  276   2HB   GLN  51           HB1      GLN  51   7.309   0.788  -0.112
  277   1HG   GLN  51           HG2      GLN  51   6.373   1.939  -1.888
  278   2HG   GLN  51           HG1      GLN  51   6.831   3.528  -1.308
  279   1HE2  GLN  51           HE22     GLN  51   9.136   2.188  -4.197
  280   2HE2  GLN  51           HE21     GLN  51   7.508   1.698  -3.927
  281    H    ALA  52           H        ALA  52   8.960   2.695   2.464
  282    HA   ALA  52           HA       ALA  52   9.089   0.295   3.770
  283   1HB   ALA  52           HB2      ALA  52   9.739   3.077   4.963
  284   2HB   ALA  52           HB1      ALA  52  10.355   1.514   5.593
  285   3HB   ALA  52           HB3      ALA  52  10.851   2.084   3.971
  286    H    GLY  53           H        GLY  53   6.920   3.087   4.640
  287   1HA   GLY  53           HA1      GLY  53   5.804   1.566   6.922
  288   2HA   GLY  53           HA2      GLY  53   5.188   3.099   6.253
  289    H    LEU  54           H        LEU  54   4.809   2.502   3.516
  290    HA   LEU  54           HA       LEU  54   2.219   1.464   3.881
  291   1HB   LEU  54           HB2      LEU  54   3.238   2.968   1.947
  292   2HB   LEU  54           HB1      LEU  54   3.417   1.453   1.056
  293    HG   LEU  54           HG       LEU  54   0.656   1.810   2.261
  294   1HD1  LEU  54           HD11     LEU  54   1.794   4.078   0.597
  295   2HD1  LEU  54           HD13     LEU  54   0.076   3.640   0.503
  296   3HD1  LEU  54           HD12     LEU  54   0.843   4.077   2.040
  297   1HD2  LEU  54           HD22     LEU  54   1.506   1.308  -0.632
  298   2HD2  LEU  54           HD21     LEU  54   1.060   0.058   0.552
  299   3HD2  LEU  54           HD23     LEU  54  -0.150   1.247   0.014
  300    H    LYS  55           H        LYS  55   5.144  -0.279   3.412
  301    HA   LYS  55           HA       LYS  55   3.846  -2.523   2.138
  302   1HB   LYS  55           HB2      LYS  55   6.140  -3.606   2.314
  303   2HB   LYS  55           HB1      LYS  55   6.107  -1.933   1.636
  304   1HG   LYS  55           HG2      LYS  55   8.089  -2.159   2.802
  305   2HG   LYS  55           HG1      LYS  55   7.123  -1.139   3.820
  306   1HD   LYS  55           HD2      LYS  55   7.354  -2.528   5.597
  307   2HD   LYS  55           HD1      LYS  55   6.711  -3.922   4.679
  308   1HE   LYS  55           HE2      LYS  55   9.622  -2.909   4.510
  309   2HE   LYS  55           HE1      LYS  55   9.082  -4.171   5.643
  310   1HZ   LYS  55           HZ1      LYS  55   8.787  -4.421   2.625
  311   2HZ   LYS  55           HZ3      LYS  55  10.055  -5.128   3.578
  312   3HZ   LYS  55           HZ2      LYS  55   8.405  -5.614   3.822
  313    H    LYS  56           H        LYS  56   5.007  -1.860   5.362
  314    HA   LYS  56           HA       LYS  56   3.967  -4.491   6.311
  315   1HB   LYS  56           HB2      LYS  56   4.897  -3.904   8.509
  316   2HB   LYS  56           HB1      LYS  56   6.105  -3.812   7.216
  317   1HG   LYS  56           HG2      LYS  56   5.781  -1.222   7.229
  318   2HG   LYS  56           HG1      LYS  56   4.700  -1.437   8.613
  319   1HD   LYS  56           HD2      LYS  56   7.673  -2.326   8.437
  320   2HD   LYS  56           HD1      LYS  56   7.125  -0.752   9.035
  321   1HE   LYS  56           HE2      LYS  56   5.559  -2.536  10.590
  322   2HE   LYS  56           HE1      LYS  56   7.108  -3.397  10.438
  323   1HZ   LYS  56           HZ2      LYS  56   8.252  -1.318  11.239
  324   2HZ   LYS  56           HZ1      LYS  56   6.697  -0.536  11.399
  325   3HZ   LYS  56           HZ3      LYS  56   7.085  -1.897  12.397
  326    H    LEU  57           H        LEU  57   3.146  -0.993   6.499
  327    HA   LEU  57           HA       LEU  57   0.887  -1.548   8.328
  328   1HB   LEU  57           HB2      LEU  57   2.264   0.410   8.673
  329   2HB   LEU  57           HB1      LEU  57   2.004   1.006   7.012
  330    HG   LEU  57           HG       LEU  57   0.785   2.247   8.760
  331   1HD1  LEU  57           HD12     LEU  57   0.058   2.214   6.301
  332   2HD1  LEU  57           HD11     LEU  57  -1.213   1.052   6.735
  333   3HD1  LEU  57           HD13     LEU  57  -1.208   2.655   7.490
  334   1HD2  LEU  57           HD21     LEU  57   0.147   0.252  10.207
  335   2HD2  LEU  57           HD23     LEU  57  -1.206   1.362   9.862
  336   3HD2  LEU  57           HD22     LEU  57  -1.078  -0.194   8.981
  337    H    GLY  58           H        GLY  58   1.443  -0.498   4.859
  338   1HA   GLY  58           HA1      GLY  58  -1.443  -0.270   4.437
  339   2HA   GLY  58           HA2      GLY  58  -0.197  -0.100   3.198
  340    H    ALA  59           H        ALA  59   1.255  -2.373   3.074
  341    HA   ALA  59           HA       ALA  59  -0.840  -4.365   2.429
  342   1HB   ALA  59           HB3      ALA  59   0.586  -3.340   0.563
  343   2HB   ALA  59           HB2      ALA  59   1.999  -4.175   1.279
  344   3HB   ALA  59           HB1      ALA  59   0.636  -5.118   0.601
  345    H    ALA  60           H        ALA  60   1.355  -6.554   2.304
  346    HA   ALA  60           HA       ALA  60   2.374  -6.511   5.110
  347   1HB   ALA  60           HB3      ALA  60   0.142  -7.862   5.008
  348   2HB   ALA  60           HB2      ALA  60   1.010  -9.017   3.944
  349   3HB   ALA  60           HB1      ALA  60   1.591  -8.735   5.593
  350    H    GLY  61           H        GLY  61   3.840  -5.899   2.710
  351   1HA   GLY  61           HA1      GLY  61   6.163  -7.083   2.774
  352   2HA   GLY  61           HA2      GLY  61   5.273  -8.472   2.121
  353    H    VAL  62           H        VAL  62   6.869  -5.538   1.115
  354    HA   VAL  62           HA       VAL  62   5.769  -6.031  -1.619
  355    HB   VAL  62           HB       VAL  62   5.502  -3.645  -2.060
  356   1HG1  VAL  62           HG11     VAL  62   4.635  -4.115   0.783
  357   2HG1  VAL  62           HG13     VAL  62   4.304  -2.586  -0.118
  358   3HG1  VAL  62           HG12     VAL  62   3.636  -4.132  -0.607
  359   1HG2  VAL  62           HG22     VAL  62   7.484  -3.134   0.180
  360   2HG2  VAL  62           HG21     VAL  62   7.696  -2.903  -1.567
  361   3HG2  VAL  62           HG23     VAL  62   6.578  -1.848  -0.696
  362    H    VAL  63           H        VAL  63   7.334  -4.999  -3.297
  363    HA   VAL  63           HA       VAL  63  10.107  -5.219  -2.264
  364    HB   VAL  63           HB       VAL  63  10.605  -7.203  -3.245
  365   1HG1  VAL  63           HG11     VAL  63   7.617  -7.387  -3.992
  366   2HG1  VAL  63           HG13     VAL  63   8.773  -8.743  -3.991
  367   3HG1  VAL  63           HG12     VAL  63   8.355  -7.930  -2.464
  368   1HG2  VAL  63           HG21     VAL  63  10.972  -6.040  -5.406
  369   2HG2  VAL  63           HG23     VAL  63  10.340  -7.689  -5.640
  370   3HG2  VAL  63           HG22     VAL  63   9.251  -6.291  -5.837
  371    H    VAL  64           H        VAL  64  11.496  -3.694  -3.334
  372    HA   VAL  64           HA       VAL  64   9.996  -1.986  -5.284
  373    HB   VAL  64           HB       VAL  64  12.365  -1.308  -3.487
  374   1HG1  VAL  64           HG12     VAL  64  12.244   0.046  -5.608
  375   2HG1  VAL  64           HG11     VAL  64  10.558   0.494  -5.232
  376   3HG1  VAL  64           HG13     VAL  64  11.879   1.051  -4.173
  377   1HG2  VAL  64           HG21     VAL  64  10.282  -1.721  -2.142
  378   2HG2  VAL  64           HG23     VAL  64  10.730   0.006  -2.139
  379   3HG2  VAL  64           HG22     VAL  64   9.385  -0.560  -3.165
  380    H    ALA  65           H        ALA  65  10.811  -2.085  -7.450
  381    HA   ALA  65           HA       ALA  65  13.647  -3.064  -7.825
  382   1HB   ALA  65           HB2      ALA  65  11.091  -4.138  -9.168
  383   2HB   ALA  65           HB1      ALA  65  12.768  -4.584  -9.604
  384   3HB   ALA  65           HB3      ALA  65  12.110  -5.021  -7.998
  385    H    GLY  66           H        GLY  66  14.220  -0.786  -8.393
  386   1HA   GLY  66           HA1      GLY  66  13.012   1.109  -9.710
  387   2HA   GLY  66           HA2      GLY  66  14.640   0.643 -10.247
  388    H    SER  67           H        SER  67  11.467   1.112 -11.443
  389    HA   SER  67           HA       SER  67  11.039   0.680 -13.797
  390   1HB   SER  67           HB2      SER  67  12.850  -0.941 -14.335
  391   2HB   SER  67           HB1      SER  67  12.024  -2.184 -13.314
  392    HG   SER  67           HG       SER  67  11.406  -2.313 -15.597
  393    H    GLY  68           H        GLY  68  10.380  -1.002 -10.700
  394   1HA   GLY  68           HA1      GLY  68   7.617  -0.764 -11.161
  395   2HA   GLY  68           HA2      GLY  68   8.082  -2.450 -11.500
  396    H    VAL  69           H        VAL  69   6.331  -1.896  -9.275
  397    HA   VAL  69           HA       VAL  69   8.138  -2.724  -7.028
  398    HB   VAL  69           HB       VAL  69   5.862  -0.712  -6.785
  399   1HG1  VAL  69           HG12     VAL  69   6.073  -2.119  -4.770
  400   2HG1  VAL  69           HG11     VAL  69   7.801  -1.728  -4.621
  401   3HG1  VAL  69           HG13     VAL  69   6.594  -0.459  -4.415
  402   1HG2  VAL  69           HG22     VAL  69   8.902  -0.274  -6.783
  403   2HG2  VAL  69           HG21     VAL  69   7.696   0.424  -7.896
  404   3HG2  VAL  69           HG23     VAL  69   7.753   0.958  -6.204
  405    H    GLN  70           H        GLN  70   7.145  -4.535  -5.896
  406    HA   GLN  70           HA       GLN  70   4.373  -5.214  -6.856
  407   1HB   GLN  70           HB2      GLN  70   5.772  -6.968  -7.597
  408   2HB   GLN  70           HB1      GLN  70   6.826  -6.878  -6.167
  409   1HG   GLN  70           HG2      GLN  70   5.057  -7.767  -4.710
  410   2HG   GLN  70           HG1      GLN  70   3.936  -7.854  -6.106
  411   1HE2  GLN  70           HE22     GLN  70   6.583 -10.913  -5.482
  412   2HE2  GLN  70           HE21     GLN  70   6.441  -9.648  -4.327
  413    H    ALA  71           H        ALA  71   2.796  -5.945  -5.049
  414    HA   ALA  71           HA       ALA  71   3.813  -5.372  -2.396
  415   1HB   ALA  71           HB2      ALA  71   1.445  -3.929  -3.735
  416   2HB   ALA  71           HB1      ALA  71   1.719  -3.881  -1.984
  417   3HB   ALA  71           HB3      ALA  71   2.930  -3.171  -3.109
  418    H    ILE  72           H        ILE  72   2.970  -6.826  -0.794
  419    HA   ILE  72           HA       ILE  72   0.704  -8.452  -1.825
  420    HB   ILE  72           HB       ILE  72   3.486  -9.323  -1.272
  421   1HG1  ILE  72           HG12     ILE  72   2.550 -11.315  -2.789
  422   2HG1  ILE  72           HG11     ILE  72   1.130 -10.305  -3.028
  423   1HG2  ILE  72           HG22     ILE  72   2.396 -10.324   0.701
  424   2HG2  ILE  72           HG21     ILE  72   1.195 -11.125  -0.393
  425   3HG2  ILE  72           HG23     ILE  72   2.922 -11.551  -0.460
  426   1HD1  ILE  72           HD12     ILE  72   2.742  -8.493  -3.981
  427   2HD1  ILE  72           HD11     ILE  72   4.061  -9.653  -3.650
  428   3HD1  ILE  72           HD13     ILE  72   2.811 -10.036  -4.867
  429    H    PHE  73           H        PHE  73  -1.035  -8.713  -0.425
  430    HA   PHE  73           HA       PHE  73  -0.464  -8.123   2.470
  431   1HB   PHE  73           HB2      PHE  73  -2.624  -7.205   2.760
  432   2HB   PHE  73           HB1      PHE  73  -1.607  -6.254   1.654
  433    HD1  PHE  73           HD2      PHE  73  -1.854  -6.570  -0.917
  434    HD2  PHE  73           HD1      PHE  73  -4.934  -7.277   1.998
  435    HE1  PHE  73           HE2      PHE  73  -3.551  -6.561  -2.703
  436    HE2  PHE  73           HE1      PHE  73  -6.642  -7.202   0.194
  437    HZ   PHE  73           HZ       PHE  73  -5.960  -6.775  -2.150
  438    H    GLY  74           H        GLY  74   0.208 -10.467   1.577
  439   1HA   GLY  74           HA1      GLY  74  -2.123 -12.339   1.783
  440   2HA   GLY  74           HA2      GLY  74  -0.496 -12.705   1.173
  441    H    THR  75           H        THR  75  -1.579 -14.224   3.371
  442    HA   THR  75           HA       THR  75  -0.618 -15.117   5.253
  443    HB   THR  75           HB       THR  75   1.301 -12.774   5.614
  444    HG1  THR  75           HG1      THR  75   1.607 -14.959   3.776
  445   1HG2  THR  75           HG22     THR  75   1.498 -15.787   6.245
  446   2HG2  THR  75           HG21     THR  75   2.786 -14.572   6.485
  447   3HG2  THR  75           HG23     THR  75   1.261 -14.454   7.426
  448    H    LYS  76           H        LYS  76  -1.269 -11.455   5.390
  449    HA   LYS  76           HA       LYS  76  -3.283 -12.186   7.417
  450   1HB   LYS  76           HB2      LYS  76  -2.424 -10.711   9.098
  451   2HB   LYS  76           HB1      LYS  76  -1.195 -11.907   8.716
  452   1HG   LYS  76           HG2      LYS  76  -0.863  -9.387   7.092
  453   2HG   LYS  76           HG1      LYS  76  -0.835  -9.107   8.841
  454   1HD   LYS  76           HD2      LYS  76   0.971 -11.108   8.881
  455   2HD   LYS  76           HD1      LYS  76   1.105 -10.718   7.148
  456   1HE   LYS  76           HE2      LYS  76   2.803  -9.396   8.237
  457   2HE   LYS  76           HE1      LYS  76   1.478  -8.233   7.957
  458   1HZ   LYS  76           HZ2      LYS  76   0.784  -8.572  10.368
  459   2HZ   LYS  76           HZ1      LYS  76   2.096  -9.693  10.552
  460   3HZ   LYS  76           HZ3      LYS  76   2.395  -8.011  10.215
  461    H    SER  77           H        SER  77  -4.087 -11.644   4.995
  462    HA   SER  77           HA       SER  77  -4.151  -8.879   4.316
  463   1HB   SER  77           HB2      SER  77  -6.570 -10.548   3.486
  464   2HB   SER  77           HB1      SER  77  -5.540  -9.505   2.495
  465    HG   SER  77           HG       SER  77  -3.955 -11.279   2.667
  466    H    ASP  78           H        ASP  78  -6.655 -11.071   5.851
  467    HA   ASP  78           HA       ASP  78  -8.590  -9.072   6.235
  468   1HB   ASP  78           HB2      ASP  78  -7.953 -11.524   7.984
  469   2HB   ASP  78           HB1      ASP  78  -9.435 -10.538   8.141
  470    H    ASN  79           H        ASN  79  -5.761  -9.963   8.383
  471    HA   ASN  79           HA       ASN  79  -6.534  -8.239  10.504
  472   1HB   ASN  79           HB2      ASN  79  -4.598  -9.871  10.661
  473   2HB   ASN  79           HB1      ASN  79  -3.687  -8.838   9.519
  474   1HD2  ASN  79           HD22     ASN  79  -2.266  -7.424  12.481
  475   2HD2  ASN  79           HD21     ASN  79  -1.966  -8.465  11.140
  476    H    LEU  80           H        LEU  80  -4.551  -7.655   7.492
  477    HA   LEU  80           HA       LEU  80  -3.998  -4.895   8.199
  478   1HB   LEU  80           HB2      LEU  80  -3.687  -6.495   5.646
  479   2HB   LEU  80           HB1      LEU  80  -3.627  -4.727   5.597
  480    HG   LEU  80           HG       LEU  80  -1.405  -6.129   5.882
  481   1HD1  LEU  80           HD11     LEU  80  -1.980  -3.592   7.548
  482   2HD1  LEU  80           HD13     LEU  80  -0.359  -4.218   7.146
  483   3HD1  LEU  80           HD12     LEU  80  -1.449  -3.690   5.841
  484   1HD2  LEU  80           HD21     LEU  80  -2.202  -7.369   8.010
  485   2HD2  LEU  80           HD23     LEU  80  -0.610  -6.576   8.113
  486   3HD2  LEU  80           HD22     LEU  80  -2.023  -5.830   8.887
  487    H    LYS  81           H        LYS  81  -6.173  -6.220   5.605
  488    HA   LYS  81           HA       LYS  81  -7.545  -3.936   5.230
  489   1HB   LYS  81           HB2      LYS  81  -7.997  -6.553   4.322
  490   2HB   LYS  81           HB1      LYS  81  -9.407  -6.318   5.349
  491   1HG   LYS  81           HG2      LYS  81  -9.809  -5.776   2.969
  492   2HG   LYS  81           HG1      LYS  81 -10.096  -4.354   4.002
  493   1HD   LYS  81           HD2      LYS  81  -8.850  -4.011   1.725
  494   2HD   LYS  81           HD1      LYS  81  -8.183  -3.176   3.137
  495   1HE   LYS  81           HE2      LYS  81  -6.380  -4.866   3.362
  496   2HE   LYS  81           HE1      LYS  81  -7.152  -5.873   2.115
  497   1HZ   LYS  81           HZ1      LYS  81  -6.108  -3.044   1.641
  498   2HZ   LYS  81           HZ3      LYS  81  -5.172  -4.461   1.323
  499   3HZ   LYS  81           HZ2      LYS  81  -6.626  -4.170   0.430
  500    H    THR  82           H        THR  82  -8.010  -5.952   8.160
  501    HA   THR  82           HA       THR  82 -10.365  -4.548   9.031
  502    HB   THR  82           HB       THR  82  -8.237  -6.128  10.557
  503    HG1  THR  82           HG1      THR  82 -10.106  -7.548  10.643
  504   1HG2  THR  82           HG22     THR  82 -10.718  -4.685  11.686
  505   2HG2  THR  82           HG21     THR  82  -9.790  -5.958  12.539
  506   3HG2  THR  82           HG23     THR  82  -9.005  -4.406  12.145
  507    H    GLU  83           H        GLU  83  -6.951  -4.119  10.357
  508    HA   GLU  83           HA       GLU  83  -7.575  -1.652  11.518
  509   1HB   GLU  83           HB2      GLU  83  -5.210  -1.157  11.651
  510   2HB   GLU  83           HB1      GLU  83  -5.501  -2.863  12.070
  511   1HG   GLU  83           HG2      GLU  83  -4.823  -3.540   9.752
  512   2HG   GLU  83           HG1      GLU  83  -4.415  -1.864   9.339
  513    H    MET  84           H        MET  84  -6.718  -2.301   8.033
  514    HA   MET  84           HA       MET  84  -6.401   0.465   7.439
  515   1HB   MET  84           HB2      MET  84  -7.428  -1.631   5.452
  516   2HB   MET  84           HB1      MET  84  -6.800   0.002   5.131
  517   1HG   MET  84           HG2      MET  84  -4.570  -0.840   6.319
  518   2HG   MET  84           HG1      MET  84  -5.239  -2.471   6.098
  519   1HE   MET  84           HE1      MET  84  -3.648   0.610   4.625
  520   2HE   MET  84           HE3      MET  84  -3.577   0.311   2.859
  521   3HE   MET  84           HE2      MET  84  -5.110   0.845   3.623
  522    H    ASP  85           H        ASP  85  -9.295  -1.755   7.414
  523    HA   ASP  85           HA       ASP  85 -11.128  -0.005   6.369
  524   1HB   ASP  85           HB2      ASP  85 -11.701  -2.343   7.079
  525   2HB   ASP  85           HB1      ASP  85 -11.724  -1.801   8.783
  526    H    GLU  86           H        GLU  86  -9.975  -0.180   9.856
  527    HA   GLU  86           HA       GLU  86 -11.589   1.975  10.745
  528   1HB   GLU  86           HB2      GLU  86  -8.860   0.985  11.767
  529   2HB   GLU  86           HB1      GLU  86  -9.669   2.419  12.455
  530   1HG   GLU  86           HG2      GLU  86 -11.706   1.073  12.993
  531   2HG   GLU  86           HG1      GLU  86 -10.895  -0.397  12.380
  532    H    TYR  87           H        TYR  87  -8.268   1.987   9.185
  533    HA   TYR  87           HA       TYR  87  -7.741   4.683   9.789
  534   1HB   TYR  87           HB1      TYR  87  -6.925   3.372   7.148
  535   2HB   TYR  87           HB2      TYR  87  -6.110   4.710   7.992
  536    HD1  TYR  87           HD1      TYR  87  -6.472   3.065  10.868
  537    HD2  TYR  87           HD2      TYR  87  -4.605   2.426   7.028
  538    HE1  TYR  87           HE1      TYR  87  -4.960   1.433  11.872
  539    HE2  TYR  87           HE2      TYR  87  -3.274   0.584   8.008
  540    HH   TYR  87           HH       TYR  87  -2.965   0.121  11.512
  541    H    ILE  88           H        ILE  88  -9.481   3.338   6.846
  542    HA   ILE  88           HA       ILE  88  -9.775   5.975   5.735
  543    HB   ILE  88           HB       ILE  88 -11.716   3.681   5.190
  544   1HG1  ILE  88           HG12     ILE  88  -9.770   3.788   3.041
  545   2HG1  ILE  88           HG11     ILE  88  -8.809   3.836   4.524
  546   1HG2  ILE  88           HG22     ILE  88 -12.403   5.932   4.341
  547   2HG2  ILE  88           HG21     ILE  88 -10.850   6.083   3.467
  548   3HG2  ILE  88           HG23     ILE  88 -12.027   4.820   3.000
  549   1HD1  ILE  88           HD12     ILE  88 -10.176   1.772   5.299
  550   2HD1  ILE  88           HD11     ILE  88 -10.883   1.703   3.675
  551   3HD1  ILE  88           HD13     ILE  88  -9.118   1.479   3.899
  552    H    ARG  89           H        ARG  89 -11.854   3.924   7.913
  553    HA   ARG  89           HA       ARG  89 -14.021   5.837   7.954
  554   1HB   ARG  89           HB2      ARG  89 -13.188   3.621   9.926
  555   2HB   ARG  89           HB1      ARG  89 -14.670   4.591  10.115
  556   1HG   ARG  89           HG2      ARG  89 -15.601   3.800   8.014
  557   2HG   ARG  89           HG1      ARG  89 -14.048   3.099   7.507
  558   1HD   ARG  89           HD2      ARG  89 -14.412   1.117   8.800
  559   2HD   ARG  89           HD1      ARG  89 -15.217   2.037  10.066
  560    HE   ARG  89           HE       ARG  89 -17.251   1.520   9.204
  561   1HH1  ARG  89           HH11     ARG  89 -14.900   1.292   6.480
  562   2HH1  ARG  89           HH12     ARG  89 -16.172   0.939   5.324
  563   1HH2  ARG  89           HH21     ARG  89 -18.788   1.005   7.667
  564   2HH2  ARG  89           HH22     ARG  89 -18.328   0.734   5.985
  565    H    ASN  90           H        ASN  90 -10.901   5.678   9.676
  566    HA   ASN  90           HA       ASN  90 -11.647   7.703  11.635
  567   1HB   ASN  90           HB2      ASN  90  -9.838   6.030  12.051
  568   2HB   ASN  90           HB1      ASN  90  -8.913   6.674  10.673
  569   1HD2  ASN  90           HD22     ASN  90  -7.084   8.423  13.162
  570   2HD2  ASN  90           HD21     ASN  90  -7.062   7.078  12.087
  571    H    PHE  91           H        PHE  91 -10.632   7.760   8.201
  572    HA   PHE  91           HA       PHE  91 -10.231  10.747   8.426
  573   1HB   PHE  91           HB2      PHE  91  -8.377   8.666   7.794
  574   2HB   PHE  91           HB1      PHE  91  -8.768   9.343   6.226
  575    HD1  PHE  91           HD2      PHE  91  -8.172  10.693   9.749
  576    HD2  PHE  91           HD1      PHE  91  -6.970  10.817   5.609
  577    HE1  PHE  91           HE2      PHE  91  -6.495  12.431  10.282
  578    HE2  PHE  91           HE1      PHE  91  -5.209  12.457   6.175
  579    HZ   PHE  91           HZ       PHE  91  -4.984  13.294   8.504
  580    H    GLY  92           H        GLY  92 -12.745   9.049   7.685
  581   1HA   GLY  92           HA1      GLY  92 -12.881   9.716   4.766
  582   2HA   GLY  92           HA2      GLY  92 -14.019   8.710   5.685
   
  No H/Q in entry =         582
  Start of MODEL    5
    1    H    MET  15           H        MET  15  -2.325   8.073  11.960
    2    HA   MET  15           HA       MET  15  -1.020   7.971   9.889
    3   1HB   MET  15           HB2      MET  15   0.701   6.217  10.493
    4   2HB   MET  15           HB1      MET  15   0.283   7.325  11.837
    5   1HG   MET  15           HG2      MET  15  -1.278   5.599  12.804
    6   2HG   MET  15           HG1      MET  15  -0.832   4.462  11.490
    7   1HE   MET  15           HE2      MET  15  -0.621   3.814  14.576
    8   2HE   MET  15           HE1      MET  15  -0.107   2.645  13.312
    9   3HE   MET  15           HE3      MET  15   0.984   3.022  14.686
   10    H    ALA  16           H        ALA  16  -3.084   4.971  10.482
   11    HA   ALA  16           HA       ALA  16  -2.207   3.717   8.106
   12   1HB   ALA  16           HB3      ALA  16  -3.724   2.581   9.732
   13   2HB   ALA  16           HB2      ALA  16  -5.091   3.567   9.138
   14   3HB   ALA  16           HB1      ALA  16  -4.257   2.446   8.024
   15    HA   PRO  17           HA       PRO  17  -5.276   6.314   5.529
   16   1HB   PRO  17           HB2      PRO  17  -5.890   8.898   6.486
   17   2HB   PRO  17           HB1      PRO  17  -6.939   7.468   6.611
   18   1HG   PRO  17           HG2      PRO  17  -5.439   8.781   8.799
   19   2HG   PRO  17           HG1      PRO  17  -6.826   7.663   8.899
   20   1HD   PRO  17           HD2      PRO  17  -4.054   7.064   9.358
   21   2HD   PRO  17           HD1      PRO  17  -5.399   5.865   9.329
   22    H    ALA  18           H        ALA  18  -3.101   8.559   7.490
   23    HA   ALA  18           HA       ALA  18  -2.252   9.986   5.191
   24   1HB   ALA  18           HB3      ALA  18  -1.698  10.730   7.533
   25   2HB   ALA  18           HB2      ALA  18  -0.580   9.337   7.707
   26   3HB   ALA  18           HB1      ALA  18  -0.227  10.625   6.513
   27    H    LEU  19           H        LEU  19  -1.036   6.901   6.697
   28    HA   LEU  19           HA       LEU  19   1.253   6.895   4.996
   29   1HB   LEU  19           HB2      LEU  19   0.840   5.529   7.283
   30   2HB   LEU  19           HB1      LEU  19   0.330   4.256   6.147
   31    HG   LEU  19           HG       LEU  19   2.614   3.863   6.668
   32   1HD1  LEU  19           HD12     LEU  19   2.171   3.708   4.267
   33   2HD1  LEU  19           HD11     LEU  19   2.672   5.392   3.975
   34   3HD1  LEU  19           HD13     LEU  19   3.864   4.221   4.543
   35   1HD2  LEU  19           HD22     LEU  19   3.255   6.842   6.273
   36   2HD2  LEU  19           HD21     LEU  19   3.225   5.944   7.811
   37   3HD2  LEU  19           HD23     LEU  19   4.453   5.558   6.582
   38    H    VAL  20           H        VAL  20  -1.724   4.636   4.986
   39    HA   VAL  20           HA       VAL  20  -1.159   3.565   2.554
   40    HB   VAL  20           HB       VAL  20  -3.175   2.975   4.053
   41   1HG1  VAL  20           HG12     VAL  20  -4.245   5.307   3.806
   42   2HG1  VAL  20           HG11     VAL  20  -4.691   4.855   2.148
   43   3HG1  VAL  20           HG13     VAL  20  -5.350   3.938   3.536
   44   1HG2  VAL  20           HG22     VAL  20  -3.536   2.900   0.985
   45   2HG2  VAL  20           HG21     VAL  20  -2.671   1.690   1.968
   46   3HG2  VAL  20           HG23     VAL  20  -4.427   1.899   2.157
   47    H    ALA  21           H        ALA  21  -2.455   6.880   3.144
   48    HA   ALA  21           HA       ALA  21  -3.253   7.294   0.483
   49   1HB   ALA  21           HB3      ALA  21  -4.018   8.858   2.246
   50   2HB   ALA  21           HB2      ALA  21  -2.337   9.404   2.523
   51   3HB   ALA  21           HB1      ALA  21  -3.148   9.753   0.971
   52    H    ALA  22           H        ALA  22  -0.102   7.835   2.204
   53    HA   ALA  22           HA       ALA  22   1.264   9.305   0.309
   54   1HB   ALA  22           HB3      ALA  22   2.215   8.633   2.537
   55   2HB   ALA  22           HB2      ALA  22   2.353   6.956   1.935
   56   3HB   ALA  22           HB1      ALA  22   3.366   8.252   1.225
   57    H    PHE  23           H        PHE  23   0.377   5.850  -0.172
   58    HA   PHE  23           HA       PHE  23   1.722   6.103  -2.819
   59   1HB   PHE  23           HB2      PHE  23   3.071   4.718  -1.138
   60   2HB   PHE  23           HB1      PHE  23   1.805   3.458  -1.434
   61    HD1  PHE  23           HD2      PHE  23   3.559   5.795  -3.978
   62    HD2  PHE  23           HD1      PHE  23   3.153   1.786  -2.399
   63    HE1  PHE  23           HE2      PHE  23   5.272   4.990  -5.516
   64    HE2  PHE  23           HE1      PHE  23   4.630   0.962  -4.183
   65    HZ   PHE  23           HZ       PHE  23   5.673   2.556  -5.786
   66    H    GLY  24           H        GLY  24  -0.842   4.133  -1.000
   67   1HA   GLY  24           HA1      GLY  24  -2.131   3.485  -3.501
   68   2HA   GLY  24           HA2      GLY  24  -2.821   3.327  -1.864
   69    H    GLY  25           H        GLY  25  -2.148   6.411  -1.437
   70   1HA   GLY  25           HA1      GLY  25  -4.660   7.351  -2.758
   71   2HA   GLY  25           HA2      GLY  25  -3.775   8.217  -1.496
   72    H    LYS  26           H        LYS  26  -1.644   6.926  -3.994
   73    HA   LYS  26           HA       LYS  26  -1.480   9.687  -5.157
   74   1HB   LYS  26           HB2      LYS  26   0.383   7.311  -5.477
   75   2HB   LYS  26           HB1      LYS  26   0.718   9.012  -5.945
   76   1HG   LYS  26           HG2      LYS  26   0.369   7.940  -3.100
   77   2HG   LYS  26           HG1      LYS  26   1.933   8.094  -3.948
   78   1HD   LYS  26           HD2      LYS  26   0.443  10.679  -3.845
   79   2HD   LYS  26           HD1      LYS  26   0.696   9.988  -2.235
   80   1HE   LYS  26           HE2      LYS  26   2.689  11.122  -2.291
   81   2HE   LYS  26           HE1      LYS  26   3.288   9.698  -3.134
   82   1HZ   LYS  26           HZ2      LYS  26   2.733  10.871  -5.300
   83   2HZ   LYS  26           HZ1      LYS  26   2.292  12.279  -4.366
   84   3HZ   LYS  26           HZ3      LYS  26   3.924  11.696  -4.335
   85    H    GLU  27           H        GLU  27  -3.877   8.583  -5.832
   86    HA   GLU  27           HA       GLU  27  -3.802   6.349  -7.518
   87   1HB   GLU  27           HB2      GLU  27  -6.042   6.781  -8.160
   88   2HB   GLU  27           HB1      GLU  27  -5.893   7.483  -6.530
   89   1HG   GLU  27           HG2      GLU  27  -5.476   9.766  -7.712
   90   2HG   GLU  27           HG1      GLU  27  -5.812   8.940  -9.263
   91    H    ASN  28           H        ASN  28  -2.847   9.682  -8.227
   92    HA   ASN  28           HA       ASN  28  -2.914   9.632 -11.015
   93   1HB   ASN  28           HB2      ASN  28  -2.278  11.595  -9.552
   94   2HB   ASN  28           HB1      ASN  28  -0.733  10.788  -9.170
   95   1HD2  ASN  28           HD22     ASN  28   0.589  12.737 -11.885
   96   2HD2  ASN  28           HD21     ASN  28   0.708  12.349 -10.208
   97    H    ILE  29           H        ILE  29  -1.038   7.392  -9.085
   98    HA   ILE  29           HA       ILE  29   1.325   7.198 -10.384
   99    HB   ILE  29           HB       ILE  29  -0.628   5.078  -9.346
  100   1HG1  ILE  29           HG12     ILE  29   0.230   5.611  -7.295
  101   2HG1  ILE  29           HG11     ILE  29   1.720   4.845  -7.796
  102   1HG2  ILE  29           HG22     ILE  29   0.486   3.797 -10.991
  103   2HG2  ILE  29           HG21     ILE  29   2.104   4.286 -10.384
  104   3HG2  ILE  29           HG23     ILE  29   1.075   3.259  -9.413
  105   1HD1  ILE  29           HD12     ILE  29   2.635   7.072  -8.569
  106   2HD1  ILE  29           HD11     ILE  29   1.142   7.842  -7.990
  107   3HD1  ILE  29           HD13     ILE  29   2.253   7.014  -6.850
  108    H    THR  30           H        THR  30   2.368   5.850 -11.985
  109    HA   THR  30           HA       THR  30   0.961   6.054 -14.474
  110    HB   THR  30           HB       THR  30   3.046   5.078 -15.466
  111    HG1  THR  30           HG1      THR  30   3.857   3.808 -13.676
  112   1HG2  THR  30           HG22     THR  30   3.370   7.424 -13.480
  113   2HG2  THR  30           HG21     THR  30   4.544   6.981 -14.746
  114   3HG2  THR  30           HG23     THR  30   2.905   7.526 -15.203
  115    H    ASN  31           H        ASN  31   2.014   3.013 -12.546
  116    HA   ASN  31           HA       ASN  31  -0.275   1.716 -13.976
  117   1HB   ASN  31           HB2      ASN  31   2.026   1.168 -14.987
  118   2HB   ASN  31           HB1      ASN  31   2.417   0.403 -13.433
  119   1HD2  ASN  31           HD22     ASN  31  -0.374  -1.387 -15.943
  120   2HD2  ASN  31           HD21     ASN  31  -0.064   0.306 -16.108
  121    H    LEU  32           H        LEU  32  -1.428   0.087 -12.796
  122    HA   LEU  32           HA       LEU  32  -0.572  -0.381  -9.945
  123   1HB   LEU  32           HB2      LEU  32  -3.243   0.367 -11.198
  124   2HB   LEU  32           HB1      LEU  32  -3.294  -0.813  -9.880
  125    HG   LEU  32           HG       LEU  32  -3.781   1.707  -9.412
  126   1HD1  LEU  32           HD11     LEU  32  -2.073   0.075  -7.493
  127   2HD1  LEU  32           HD13     LEU  32  -3.009   1.518  -7.061
  128   3HD1  LEU  32           HD12     LEU  32  -3.836   0.049  -7.631
  129   1HD2  LEU  32           HD21     LEU  32  -1.623   2.634 -10.392
  130   2HD2  LEU  32           HD23     LEU  32  -1.855   3.074  -8.669
  131   3HD2  LEU  32           HD22     LEU  32  -0.735   1.768  -9.103
  132    H    ASP  33           H        ASP  33  -1.392  -2.546  -9.156
  133    HA   ASP  33           HA       ASP  33  -2.354  -4.375 -11.268
  134   1HB   ASP  33           HB2      ASP  33   0.415  -4.244 -10.717
  135   2HB   ASP  33           HB1      ASP  33  -0.136  -5.727  -9.864
  136    H    ALA  34           H        ALA  34  -4.217  -3.804  -9.802
  137    HA   ALA  34           HA       ALA  34  -4.074  -4.797  -7.076
  138   1HB   ALA  34           HB3      ALA  34  -5.537  -2.885  -7.664
  139   2HB   ALA  34           HB2      ALA  34  -6.541  -3.961  -8.676
  140   3HB   ALA  34           HB1      ALA  34  -6.458  -4.219  -6.909
  141    H    CYS  35           H        CYS  35  -5.304  -6.653  -6.180
  142    HA   CYS  35           HA       CYS  35  -6.636  -8.456  -7.977
  143   1HB   CYS  35           HB2      CYS  35  -3.747  -8.641  -7.979
  144   2HB   CYS  35           HB1      CYS  35  -4.329 -10.051  -7.050
  145    HG   CYS  35           HG       CYS  35  -4.125 -10.644  -9.486
  146    H    ILE  36           H        ILE  36  -6.688 -10.834  -6.778
  147    HA   ILE  36           HA       ILE  36  -8.479 -10.486  -4.875
  148    HB   ILE  36           HB       ILE  36  -8.197 -12.661  -3.907
  149   1HG1  ILE  36           HG12     ILE  36  -5.809 -12.981  -3.529
  150   2HG1  ILE  36           HG11     ILE  36  -6.477 -14.302  -4.488
  151   1HG2  ILE  36           HG22     ILE  36  -9.245 -12.432  -6.167
  152   2HG2  ILE  36           HG21     ILE  36  -7.712 -12.895  -6.946
  153   3HG2  ILE  36           HG23     ILE  36  -8.542 -14.043  -5.876
  154   1HD1  ILE  36           HD11     ILE  36  -4.817 -12.028  -5.745
  155   2HD1  ILE  36           HD13     ILE  36  -4.217 -13.620  -5.246
  156   3HD1  ILE  36           HD12     ILE  36  -5.423 -13.491  -6.554
  157    H    THR  37           H        THR  37  -4.980 -10.835  -3.833
  158    HA   THR  37           HA       THR  37  -5.670  -9.118  -1.520
  159    HB   THR  37           HB       THR  37  -4.481 -11.949  -1.340
  160    HG1  THR  37           HG1      THR  37  -7.033 -10.982  -0.450
  161   1HG2  THR  37           HG22     THR  37  -5.045  -9.860   0.860
  162   2HG2  THR  37           HG21     THR  37  -4.783 -11.595   1.193
  163   3HG2  THR  37           HG23     THR  37  -3.480 -10.633   0.461
  164    H    ARG  38           H        ARG  38  -4.467  -8.460  -3.963
  165    HA   ARG  38           HA       ARG  38  -1.641  -8.096  -3.147
  166   1HB   ARG  38           HB2      ARG  38  -1.505  -9.950  -4.692
  167   2HB   ARG  38           HB1      ARG  38  -2.675  -9.180  -5.788
  168   1HG   ARG  38           HG2      ARG  38  -1.065  -7.382  -6.396
  169   2HG   ARG  38           HG1      ARG  38   0.057  -7.987  -5.165
  170   1HD   ARG  38           HD2      ARG  38   1.007  -8.874  -7.103
  171   2HD   ARG  38           HD1      ARG  38   0.003 -10.257  -6.559
  172    HE   ARG  38           HE       ARG  38  -1.466  -8.582  -8.415
  173   1HH1  ARG  38           HH11     ARG  38   1.325 -10.850  -8.357
  174   2HH1  ARG  38           HH12     ARG  38   1.086 -11.301 -10.037
  175   1HH2  ARG  38           HH21     ARG  38  -1.696  -9.232 -10.571
  176   2HH2  ARG  38           HH22     ARG  38  -0.578 -10.405 -11.271
  177    H    LEU  39           H        LEU  39  -0.831  -6.004  -3.761
  178    HA   LEU  39           HA       LEU  39  -2.466  -4.426  -5.590
  179   1HB   LEU  39           HB2      LEU  39  -2.612  -4.205  -2.639
  180   2HB   LEU  39           HB1      LEU  39  -2.084  -2.677  -3.339
  181    HG   LEU  39           HG       LEU  39  -4.556  -4.144  -4.453
  182   1HD1  LEU  39           HD11     LEU  39  -4.546  -2.168  -2.098
  183   2HD1  LEU  39           HD13     LEU  39  -6.002  -2.726  -2.976
  184   3HD1  LEU  39           HD12     LEU  39  -5.027  -3.887  -2.043
  185   1HD2  LEU  39           HD21     LEU  39  -3.525  -2.249  -5.800
  186   2HD2  LEU  39           HD23     LEU  39  -5.176  -1.869  -5.246
  187   3HD2  LEU  39           HD22     LEU  39  -3.770  -1.168  -4.404
  188    H    ARG  40           H        ARG  40  -1.087  -3.230  -6.930
  189    HA   ARG  40           HA       ARG  40   1.737  -2.894  -5.916
  190   1HB   ARG  40           HB2      ARG  40   1.905  -4.763  -7.458
  191   2HB   ARG  40           HB1      ARG  40   0.592  -4.126  -8.429
  192   1HG   ARG  40           HG2      ARG  40   1.918  -2.433  -9.526
  193   2HG   ARG  40           HG1      ARG  40   3.236  -2.646  -8.380
  194   1HD   ARG  40           HD2      ARG  40   3.148  -5.171  -9.382
  195   2HD   ARG  40           HD1      ARG  40   2.700  -4.263 -10.848
  196    HE   ARG  40           HE       ARG  40   4.947  -2.933  -9.810
  197   1HH1  ARG  40           HH11     ARG  40   4.182  -6.225 -11.053
  198   2HH1  ARG  40           HH12     ARG  40   5.862  -6.530 -11.461
  199   1HH2  ARG  40           HH21     ARG  40   7.064  -3.417 -10.373
  200   2HH2  ARG  40           HH22     ARG  40   7.460  -4.966 -11.118
  201    H    VAL  41           H        VAL  41   2.933  -1.081  -6.743
  202    HA   VAL  41           HA       VAL  41   1.235   0.857  -8.227
  203    HB   VAL  41           HB       VAL  41   2.593   2.179  -6.038
  204   1HG1  VAL  41           HG12     VAL  41   0.453   2.976  -7.211
  205   2HG1  VAL  41           HG11     VAL  41  -0.438   1.699  -6.371
  206   3HG1  VAL  41           HG13     VAL  41   0.369   2.997  -5.443
  207   1HG2  VAL  41           HG21     VAL  41   2.489   0.007  -4.682
  208   2HG2  VAL  41           HG23     VAL  41   1.387   1.237  -4.043
  209   3HG2  VAL  41           HG22     VAL  41   0.748  -0.078  -5.029
  210    H    SER  42           H        SER  42   2.607   0.524 -10.138
  211    HA   SER  42           HA       SER  42   5.491   0.822  -9.657
  212   1HB   SER  42           HB2      SER  42   4.443   0.609 -12.466
  213   2HB   SER  42           HB1      SER  42   5.862  -0.162 -11.755
  214    HG   SER  42           HG       SER  42   4.087  -1.690 -12.093
  215    H    VAL  43           H        VAL  43   6.545   2.853  -9.863
  216    HA   VAL  43           HA       VAL  43   5.296   4.954 -11.498
  217    HB   VAL  43           HB       VAL  43   3.874   5.606  -9.826
  218   1HG1  VAL  43           HG11     VAL  43   5.394   3.801  -7.901
  219   2HG1  VAL  43           HG13     VAL  43   3.949   4.737  -7.439
  220   3HG1  VAL  43           HG12     VAL  43   3.787   3.486  -8.665
  221   1HG2  VAL  43           HG22     VAL  43   6.429   6.248  -8.278
  222   2HG2  VAL  43           HG21     VAL  43   5.502   7.399  -9.331
  223   3HG2  VAL  43           HG23     VAL  43   4.839   6.852  -7.793
  224    H    ALA  44           H        ALA  44   6.614   7.085 -11.323
  225    HA   ALA  44           HA       ALA  44   9.384   6.508 -11.413
  226   1HB   ALA  44           HB2      ALA  44   8.023   9.219 -10.894
  227   2HB   ALA  44           HB1      ALA  44   9.751   8.965 -11.294
  228   3HB   ALA  44           HB3      ALA  44   8.479   8.535 -12.479
  229    H    ASP  45           H        ASP  45   7.575   8.282  -8.733
  230    HA   ASP  45           HA       ASP  45   9.229   8.763  -6.868
  231   1HB   ASP  45           HB2      ASP  45   6.834   7.029  -6.104
  232   2HB   ASP  45           HB1      ASP  45   7.749   8.134  -5.053
  233    H    VAL  46           H        VAL  46   8.303   5.449  -5.640
  234    HA   VAL  46           HA       VAL  46   9.712   4.008  -4.621
  235    HB   VAL  46           HB       VAL  46  10.548   2.536  -6.108
  236   1HG1  VAL  46           HG12     VAL  46   8.362   3.472  -7.059
  237   2HG1  VAL  46           HG11     VAL  46   9.348   4.505  -8.122
  238   3HG1  VAL  46           HG13     VAL  46   9.436   2.734  -8.300
  239   1HG2  VAL  46           HG22     VAL  46  11.910   4.818  -7.682
  240   2HG2  VAL  46           HG21     VAL  46  12.701   3.539  -6.699
  241   3HG2  VAL  46           HG23     VAL  46  11.864   3.106  -8.198
  242    H    SER  47           H        SER  47  10.561   6.968  -4.254
  243    HA   SER  47           HA       SER  47  13.338   6.335  -3.327
  244   1HB   SER  47           HB2      SER  47  13.632   7.270  -5.516
  245   2HB   SER  47           HB1      SER  47  12.416   8.539  -5.256
  246    HG   SER  47           HG       SER  47  14.914   8.389  -3.835
  247    H    LYS  48           H        LYS  48  11.326   9.398  -3.409
  248    HA   LYS  48           HA       LYS  48  11.857   9.710  -0.578
  249   1HB   LYS  48           HB2      LYS  48  10.988  11.816  -0.754
  250   2HB   LYS  48           HB1      LYS  48  11.252  11.553  -2.484
  251   1HG   LYS  48           HG2      LYS  48   8.640  11.431  -0.856
  252   2HG   LYS  48           HG1      LYS  48   9.100  12.614  -2.088
  253   1HD   LYS  48           HD2      LYS  48   9.127  10.074  -3.458
  254   2HD   LYS  48           HD1      LYS  48   7.684  10.051  -2.412
  255   1HE   LYS  48           HE2      LYS  48   6.912  10.919  -4.476
  256   2HE   LYS  48           HE1      LYS  48   7.069  12.358  -3.441
  257   1HZ   LYS  48           HZ2      LYS  48   9.298  12.775  -4.525
  258   2HZ   LYS  48           HZ1      LYS  48   9.047  11.376  -5.528
  259   3HZ   LYS  48           HZ3      LYS  48   7.988  12.744  -5.686
  260    H    VAL  49           H        VAL  49   9.394   8.004  -2.404
  261    HA   VAL  49           HA       VAL  49   7.175   8.216  -0.838
  262    HB   VAL  49           HB       VAL  49   7.403   6.948  -2.990
  263   1HG1  VAL  49           HG12     VAL  49   9.500   5.671  -2.454
  264   2HG1  VAL  49           HG11     VAL  49   8.618   4.669  -1.296
  265   3HG1  VAL  49           HG13     VAL  49   8.181   4.621  -3.022
  266   1HG2  VAL  49           HG22     VAL  49   5.954   5.436  -0.747
  267   2HG2  VAL  49           HG21     VAL  49   5.309   6.678  -1.857
  268   3HG2  VAL  49           HG23     VAL  49   5.829   5.085  -2.482
  269    H    ASP  50           H        ASP  50   6.246   6.960   0.991
  270    HA   ASP  50           HA       ASP  50   8.360   5.936   2.851
  271   1HB   ASP  50           HB2      ASP  50   6.654   6.319   4.599
  272   2HB   ASP  50           HB1      ASP  50   6.889   7.779   3.603
  273    H    GLN  51           H        GLN  51   8.008   4.054   0.822
  274    HA   GLN  51           HA       GLN  51   5.756   2.325   1.294
  275   1HB   GLN  51           HB2      GLN  51   8.493   1.643   0.209
  276   2HB   GLN  51           HB1      GLN  51   7.104   0.521   0.146
  277   1HG   GLN  51           HG2      GLN  51   5.848   1.810  -1.391
  278   2HG   GLN  51           HG1      GLN  51   6.717   3.288  -1.038
  279   1HE2  GLN  51           HE22     GLN  51   9.429   1.758  -3.403
  280   2HE2  GLN  51           HE21     GLN  51   9.524   1.495  -1.727
  281    H    ALA  52           H        ALA  52   9.182   2.528   2.541
  282    HA   ALA  52           HA       ALA  52   9.482   0.313   4.046
  283   1HB   ALA  52           HB3      ALA  52  11.035   2.286   4.143
  284   2HB   ALA  52           HB2      ALA  52   9.816   3.213   5.072
  285   3HB   ALA  52           HB1      ALA  52  10.592   1.767   5.799
  286    H    GLY  53           H        GLY  53   7.148   3.003   4.904
  287   1HA   GLY  53           HA1      GLY  53   6.148   1.396   7.199
  288   2HA   GLY  53           HA2      GLY  53   5.547   2.984   6.665
  289    H    LEU  54           H        LEU  54   5.091   2.382   3.832
  290    HA   LEU  54           HA       LEU  54   2.447   1.431   4.265
  291   1HB   LEU  54           HB2      LEU  54   3.514   2.911   2.297
  292   2HB   LEU  54           HB1      LEU  54   3.620   1.375   1.426
  293    HG   LEU  54           HG       LEU  54   0.896   1.939   2.658
  294   1HD1  LEU  54           HD11     LEU  54   2.139   3.947   0.743
  295   2HD1  LEU  54           HD13     LEU  54   0.377   3.672   0.835
  296   3HD1  LEU  54           HD12     LEU  54   1.310   4.216   2.236
  297   1HD2  LEU  54           HD22     LEU  54   1.724   1.266  -0.219
  298   2HD2  LEU  54           HD21     LEU  54   1.219   0.070   1.005
  299   3HD2  LEU  54           HD23     LEU  54   0.057   1.277   0.413
  300    H    LYS  55           H        LYS  55   5.371  -0.309   3.680
  301    HA   LYS  55           HA       LYS  55   4.048  -2.542   2.445
  302   1HB   LYS  55           HB2      LYS  55   6.323  -3.645   2.507
  303   2HB   LYS  55           HB1      LYS  55   6.307  -1.963   1.868
  304   1HG   LYS  55           HG2      LYS  55   8.290  -2.154   3.033
  305   2HG   LYS  55           HG1      LYS  55   7.299  -1.252   4.144
  306   1HD   LYS  55           HD2      LYS  55   7.691  -2.741   5.792
  307   2HD   LYS  55           HD1      LYS  55   6.916  -4.041   4.845
  308   1HE   LYS  55           HE2      LYS  55   9.868  -3.161   4.536
  309   2HE   LYS  55           HE1      LYS  55   9.333  -4.495   5.585
  310   1HZ   LYS  55           HZ1      LYS  55   8.845  -4.442   2.583
  311   2HZ   LYS  55           HZ3      LYS  55  10.117  -5.301   3.390
  312   3HZ   LYS  55           HZ2      LYS  55   8.458  -5.719   3.685
  313    H    LYS  56           H        LYS  56   5.183  -1.818   5.713
  314    HA   LYS  56           HA       LYS  56   3.918  -4.404   6.621
  315   1HB   LYS  56           HB2      LYS  56   5.129  -4.200   8.670
  316   2HB   LYS  56           HB1      LYS  56   6.228  -4.067   7.288
  317   1HG   LYS  56           HG2      LYS  56   6.114  -1.451   7.639
  318   2HG   LYS  56           HG1      LYS  56   5.277  -1.800   9.163
  319   1HD   LYS  56           HD2      LYS  56   8.051  -2.897   8.333
  320   2HD   LYS  56           HD1      LYS  56   7.841  -1.385   9.230
  321   1HE   LYS  56           HE2      LYS  56   7.498  -2.466  11.250
  322   2HE   LYS  56           HE1      LYS  56   6.418  -3.680  10.548
  323   1HZ   LYS  56           HZ1      LYS  56   9.438  -3.733  10.296
  324   2HZ   LYS  56           HZ3      LYS  56   8.491  -4.677  11.412
  325   3HZ   LYS  56           HZ2      LYS  56   8.321  -4.944   9.704
  326    H    LEU  57           H        LEU  57   3.076  -1.040   6.382
  327    HA   LEU  57           HA       LEU  57   1.049  -1.397   8.557
  328   1HB   LEU  57           HB2      LEU  57   2.788   0.588   8.383
  329   2HB   LEU  57           HB1      LEU  57   1.712   1.198   7.096
  330    HG   LEU  57           HG       LEU  57   1.164   0.765  10.103
  331   1HD1  LEU  57           HD12     LEU  57   2.335   2.907   9.285
  332   2HD1  LEU  57           HD11     LEU  57   0.858   3.264   8.338
  333   3HD1  LEU  57           HD13     LEU  57   0.782   3.204  10.115
  334   1HD2  LEU  57           HD22     LEU  57  -0.934   1.397   7.936
  335   2HD2  LEU  57           HD21     LEU  57  -0.931   0.048   9.130
  336   3HD2  LEU  57           HD23     LEU  57  -1.174   1.710   9.682
  337    H    GLY  58           H        GLY  58   1.441  -0.536   4.974
  338   1HA   GLY  58           HA1      GLY  58  -1.485  -0.134   4.751
  339   2HA   GLY  58           HA2      GLY  58  -0.269   0.094   3.483
  340    H    ALA  59           H        ALA  59   1.038  -1.975   2.829
  341    HA   ALA  59           HA       ALA  59  -0.950  -4.157   2.496
  342   1HB   ALA  59           HB3      ALA  59   0.187  -3.009   0.491
  343   2HB   ALA  59           HB2      ALA  59   1.723  -3.751   1.042
  344   3HB   ALA  59           HB1      ALA  59   0.351  -4.782   0.517
  345    H    ALA  60           H        ALA  60   1.022  -6.319   2.158
  346    HA   ALA  60           HA       ALA  60   2.448  -6.375   4.750
  347   1HB   ALA  60           HB3      ALA  60  -0.201  -7.464   4.542
  348   2HB   ALA  60           HB2      ALA  60   0.806  -8.877   4.420
  349   3HB   ALA  60           HB1      ALA  60   0.999  -7.808   5.811
  350    H    GLY  61           H        GLY  61   3.985  -6.071   2.749
  351   1HA   GLY  61           HA1      GLY  61   5.893  -7.700   2.467
  352   2HA   GLY  61           HA2      GLY  61   4.729  -8.829   1.755
  353    H    VAL  62           H        VAL  62   6.581  -5.809   1.116
  354    HA   VAL  62           HA       VAL  62   5.477  -5.982  -1.657
  355    HB   VAL  62           HB       VAL  62   5.554  -3.574  -1.891
  356   1HG1  VAL  62           HG11     VAL  62   4.739  -4.121   0.998
  357   2HG1  VAL  62           HG13     VAL  62   4.406  -2.590   0.111
  358   3HG1  VAL  62           HG12     VAL  62   3.676  -4.137  -0.367
  359   1HG2  VAL  62           HG22     VAL  62   7.529  -3.446   0.409
  360   2HG2  VAL  62           HG21     VAL  62   7.812  -3.170  -1.323
  361   3HG2  VAL  62           HG23     VAL  62   6.798  -2.032  -0.430
  362    H    VAL  63           H        VAL  63   7.012  -5.010  -3.293
  363    HA   VAL  63           HA       VAL  63   9.794  -5.757  -2.573
  364    HB   VAL  63           HB       VAL  63   9.845  -7.562  -3.949
  365   1HG1  VAL  63           HG12     VAL  63   7.551  -8.015  -3.085
  366   2HG1  VAL  63           HG11     VAL  63   6.842  -7.130  -4.470
  367   3HG1  VAL  63           HG13     VAL  63   7.764  -8.630  -4.745
  368   1HG2  VAL  63           HG21     VAL  63  10.265  -6.060  -5.873
  369   2HG2  VAL  63           HG23     VAL  63   9.304  -7.478  -6.369
  370   3HG2  VAL  63           HG22     VAL  63   8.512  -5.900  -6.165
  371    H    VAL  64           H        VAL  64  11.367  -4.430  -3.747
  372    HA   VAL  64           HA       VAL  64  10.045  -2.124  -5.151
  373    HB   VAL  64           HB       VAL  64  12.572  -2.046  -3.448
  374   1HG1  VAL  64           HG12     VAL  64  12.376  -0.287  -5.234
  375   2HG1  VAL  64           HG11     VAL  64  10.772   0.178  -4.615
  376   3HG1  VAL  64           HG13     VAL  64  12.215   0.448  -3.611
  377   1HG2  VAL  64           HG21     VAL  64  10.617  -2.566  -1.962
  378   2HG2  VAL  64           HG23     VAL  64  11.238  -0.918  -1.680
  379   3HG2  VAL  64           HG22     VAL  64   9.739  -1.152  -2.604
  380    H    ALA  65           H        ALA  65  10.828  -1.900  -7.309
  381    HA   ALA  65           HA       ALA  65  13.437  -3.262  -7.975
  382   1HB   ALA  65           HB2      ALA  65  10.702  -3.601  -9.361
  383   2HB   ALA  65           HB1      ALA  65  12.259  -4.242  -9.966
  384   3HB   ALA  65           HB3      ALA  65  11.569  -4.854  -8.433
  385    H    GLY  66           H        GLY  66  14.512  -1.153  -8.342
  386   1HA   GLY  66           HA1      GLY  66  13.607   1.173  -9.169
  387   2HA   GLY  66           HA2      GLY  66  15.069   0.515  -9.934
  388    H    SER  67           H        SER  67  11.960   1.757 -10.712
  389    HA   SER  67           HA       SER  67  11.256   1.851 -13.020
  390   1HB   SER  67           HB2      SER  67  11.872  -1.141 -13.261
  391   2HB   SER  67           HB1      SER  67  10.988  -0.145 -14.426
  392    HG   SER  67           HG       SER  67  13.720   0.353 -13.745
  393    H    GLY  68           H        GLY  68  10.497  -0.086 -10.119
  394   1HA   GLY  68           HA1      GLY  68   7.773   0.532 -10.396
  395   2HA   GLY  68           HA2      GLY  68   8.019  -1.139 -11.012
  396    H    VAL  69           H        VAL  69   6.387  -1.080  -8.847
  397    HA   VAL  69           HA       VAL  69   8.058  -2.093  -6.644
  398    HB   VAL  69           HB       VAL  69   6.020   0.125  -6.120
  399   1HG1  VAL  69           HG12     VAL  69   6.399  -1.631  -4.292
  400   2HG1  VAL  69           HG11     VAL  69   8.115  -1.156  -4.253
  401   3HG1  VAL  69           HG13     VAL  69   6.866   0.003  -3.785
  402   1HG2  VAL  69           HG22     VAL  69   9.066   0.324  -6.282
  403   2HG2  VAL  69           HG21     VAL  69   7.845   1.157  -7.289
  404   3HG2  VAL  69           HG23     VAL  69   8.031   1.579  -5.571
  405    H    GLN  70           H        GLN  70   6.986  -4.118  -6.411
  406    HA   GLN  70           HA       GLN  70   4.048  -4.150  -6.844
  407   1HB   GLN  70           HB2      GLN  70   5.190  -5.774  -8.076
  408   2HB   GLN  70           HB1      GLN  70   6.156  -6.337  -6.707
  409   1HG   GLN  70           HG2      GLN  70   4.453  -7.638  -5.798
  410   2HG   GLN  70           HG1      GLN  70   3.145  -6.591  -6.370
  411   1HE2  GLN  70           HE22     GLN  70   2.596  -8.331  -9.403
  412   2HE2  GLN  70           HE21     GLN  70   2.076  -7.052  -8.384
  413    H    ALA  71           H        ALA  71   2.526  -4.798  -5.120
  414    HA   ALA  71           HA       ALA  71   3.747  -4.954  -2.491
  415   1HB   ALA  71           HB2      ALA  71   2.012  -2.625  -3.415
  416   2HB   ALA  71           HB1      ALA  71   1.735  -3.284  -1.777
  417   3HB   ALA  71           HB3      ALA  71   3.330  -2.667  -2.301
  418    H    ILE  72           H        ILE  72   2.501  -6.180  -0.897
  419    HA   ILE  72           HA       ILE  72   0.304  -7.677  -2.145
  420    HB   ILE  72           HB       ILE  72   3.096  -8.556  -2.136
  421   1HG1  ILE  72           HG12     ILE  72   1.712 -10.821  -3.081
  422   2HG1  ILE  72           HG11     ILE  72   0.560  -9.546  -3.422
  423   1HG2  ILE  72           HG22     ILE  72   2.619  -9.511   0.159
  424   2HG2  ILE  72           HG21     ILE  72   1.348 -10.519  -0.613
  425   3HG2  ILE  72           HG23     ILE  72   3.056 -10.721  -1.066
  426   1HD1  ILE  72           HD11     ILE  72   3.544  -9.628  -4.258
  427   2HD1  ILE  72           HD13     ILE  72   2.174  -9.983  -5.327
  428   3HD1  ILE  72           HD12     ILE  72   2.397  -8.322  -4.689
  429    H    PHE  73           H        PHE  73  -1.024  -8.902  -0.464
  430    HA   PHE  73           HA       PHE  73  -0.050  -8.395   2.277
  431   1HB   PHE  73           HB2      PHE  73  -2.142  -7.298   3.018
  432   2HB   PHE  73           HB1      PHE  73  -1.257  -6.333   1.827
  433    HD1  PHE  73           HD2      PHE  73  -1.907  -6.502  -0.684
  434    HD2  PHE  73           HD1      PHE  73  -4.513  -7.537   2.592
  435    HE1  PHE  73           HE2      PHE  73  -3.885  -6.228  -2.146
  436    HE2  PHE  73           HE1      PHE  73  -6.479  -7.176   1.136
  437    HZ   PHE  73           HZ       PHE  73  -6.169  -6.488  -1.233
  438    H    GLY  74           H        GLY  74   0.187 -10.767   1.314
  439   1HA   GLY  74           HA1      GLY  74  -2.136 -12.340   2.220
  440   2HA   GLY  74           HA2      GLY  74  -0.564 -12.971   1.678
  441    H    THR  75           H        THR  75   1.141 -11.285   3.438
  442    HA   THR  75           HA       THR  75   1.000 -13.147   5.660
  443    HB   THR  75           HB       THR  75   2.972 -12.113   6.596
  444    HG1  THR  75           HG1      THR  75   2.918 -10.114   4.580
  445   1HG2  THR  75           HG22     THR  75   3.225 -12.484   3.544
  446   2HG2  THR  75           HG21     THR  75   4.580 -12.463   4.704
  447   3HG2  THR  75           HG23     THR  75   3.352 -13.764   4.787
  448    H    LYS  76           H        LYS  76  -1.054 -12.720   6.730
  449    HA   LYS  76           HA       LYS  76  -2.156 -11.806   8.496
  450   1HB   LYS  76           HB2      LYS  76   0.322 -10.736   9.027
  451   2HB   LYS  76           HB1      LYS  76  -0.594  -9.256   8.714
  452   1HG   LYS  76           HG2      LYS  76  -1.094  -9.409  10.972
  453   2HG   LYS  76           HG1      LYS  76  -2.366 -10.509  10.416
  454   1HD   LYS  76           HD2      LYS  76  -1.387 -11.856  12.074
  455   2HD   LYS  76           HD1      LYS  76  -0.285 -12.314  10.747
  456   1HE   LYS  76           HE2      LYS  76   1.303 -10.459  11.541
  457   2HE   LYS  76           HE1      LYS  76   0.153 -10.103  12.864
  458   1HZ   LYS  76           HZ2      LYS  76   0.473 -12.411  13.717
  459   2HZ   LYS  76           HZ1      LYS  76   1.664 -12.701  12.472
  460   3HZ   LYS  76           HZ3      LYS  76   1.952 -11.503  13.695
  461    H    SER  77           H        SER  77  -2.759 -11.358   5.600
  462    HA   SER  77           HA       SER  77  -3.486  -8.918   4.856
  463   1HB   SER  77           HB2      SER  77  -5.945 -10.652   4.553
  464   2HB   SER  77           HB1      SER  77  -4.957  -9.847   3.346
  465    HG   SER  77           HG       SER  77  -4.455 -12.411   4.501
  466    H    ASP  78           H        ASP  78  -5.675 -10.860   7.081
  467    HA   ASP  78           HA       ASP  78  -7.649  -8.891   7.271
  468   1HB   ASP  78           HB2      ASP  78  -6.708 -10.920   9.377
  469   2HB   ASP  78           HB1      ASP  78  -8.127  -9.866   9.607
  470    H    ASN  79           H        ASN  79  -4.604  -9.166   9.282
  471    HA   ASN  79           HA       ASN  79  -5.300  -7.052  11.043
  472   1HB   ASN  79           HB2      ASN  79  -3.326  -8.498  11.480
  473   2HB   ASN  79           HB1      ASN  79  -2.556  -7.882   9.979
  474   1HD2  ASN  79           HD22     ASN  79  -0.817  -5.581  12.075
  475   2HD2  ASN  79           HD21     ASN  79  -0.659  -6.900  10.985
  476    H    LEU  80           H        LEU  80  -3.566  -6.967   7.830
  477    HA   LEU  80           HA       LEU  80  -3.042  -4.111   8.087
  478   1HB   LEU  80           HB2      LEU  80  -2.993  -6.044   5.689
  479   2HB   LEU  80           HB1      LEU  80  -2.766  -4.293   5.503
  480    HG   LEU  80           HG       LEU  80  -0.663  -5.553   5.573
  481   1HD1  LEU  80           HD12     LEU  80  -0.645  -3.215   6.131
  482   2HD1  LEU  80           HD11     LEU  80  -0.825  -3.543   7.884
  483   3HD1  LEU  80           HD13     LEU  80   0.631  -4.067   7.013
  484   1HD2  LEU  80           HD21     LEU  80  -1.195  -7.352   7.241
  485   2HD2  LEU  80           HD23     LEU  80   0.271  -6.450   7.710
  486   3HD2  LEU  80           HD22     LEU  80  -1.264  -6.117   8.544
  487    H    LYS  81           H        LYS  81  -5.504  -6.111   6.354
  488    HA   LYS  81           HA       LYS  81  -6.921  -3.927   5.263
  489   1HB   LYS  81           HB2      LYS  81  -7.205  -6.370   4.673
  490   2HB   LYS  81           HB1      LYS  81  -8.012  -6.609   6.256
  491   1HG   LYS  81           HG2      LYS  81  -9.878  -5.142   5.575
  492   2HG   LYS  81           HG1      LYS  81  -9.012  -4.652   4.090
  493   1HD   LYS  81           HD2      LYS  81 -10.817  -6.374   3.673
  494   2HD   LYS  81           HD1      LYS  81  -9.200  -6.912   3.138
  495   1HE   LYS  81           HE2      LYS  81  -8.951  -8.390   5.059
  496   2HE   LYS  81           HE1      LYS  81 -10.388  -7.695   5.867
  497   1HZ   LYS  81           HZ1      LYS  81 -10.408  -9.269   3.253
  498   2HZ   LYS  81           HZ3      LYS  81 -10.845  -9.896   4.809
  499   3HZ   LYS  81           HZ2      LYS  81 -11.807  -8.651   4.080
  500    H    THR  82           H        THR  82  -6.934  -5.331   8.615
  501    HA   THR  82           HA       THR  82  -9.168  -3.775   9.541
  502    HB   THR  82           HB       THR  82  -6.854  -5.160  10.946
  503    HG1  THR  82           HG1      THR  82  -9.667  -5.345  11.310
  504   1HG2  THR  82           HG22     THR  82  -8.669  -3.129  12.349
  505   2HG2  THR  82           HG21     THR  82  -7.655  -4.366  13.154
  506   3HG2  THR  82           HG23     THR  82  -6.882  -3.071  12.203
  507    H    GLU  83           H        GLU  83  -5.572  -3.074   9.302
  508    HA   GLU  83           HA       GLU  83  -5.850  -0.496  10.525
  509   1HB   GLU  83           HB2      GLU  83  -3.775  -1.351   8.408
  510   2HB   GLU  83           HB1      GLU  83  -3.715   0.128   9.393
  511   1HG   GLU  83           HG2      GLU  83  -3.555  -2.754  10.488
  512   2HG   GLU  83           HG1      GLU  83  -2.225  -1.599  10.363
  513    H    MET  84           H        MET  84  -6.290  -1.644   7.078
  514    HA   MET  84           HA       MET  84  -6.627   1.039   6.092
  515   1HB   MET  84           HB2      MET  84  -7.802  -1.547   4.916
  516   2HB   MET  84           HB1      MET  84  -7.745   0.056   4.130
  517   1HG   MET  84           HG2      MET  84  -5.200   0.000   4.233
  518   2HG   MET  84           HG1      MET  84  -5.288  -1.658   4.907
  519   1HE   MET  84           HE2      MET  84  -3.573  -1.301   2.475
  520   2HE   MET  84           HE1      MET  84  -4.049  -2.973   2.957
  521   3HE   MET  84           HE3      MET  84  -4.175  -2.460   1.246
  522    H    ASP  85           H        ASP  85  -8.936  -1.497   7.402
  523    HA   ASP  85           HA       ASP  85 -11.328  -0.195   6.883
  524   1HB   ASP  85           HB2      ASP  85 -11.340  -2.394   7.935
  525   2HB   ASP  85           HB1      ASP  85 -10.622  -1.741   9.427
  526    H    GLU  86           H        GLU  86  -9.160   0.194   9.802
  527    HA   GLU  86           HA       GLU  86 -10.537   2.269  11.038
  528   1HB   GLU  86           HB2      GLU  86  -7.608   1.473  10.943
  529   2HB   GLU  86           HB1      GLU  86  -7.917   3.128  11.473
  530   1HG   GLU  86           HG2      GLU  86  -9.543   0.881  12.775
  531   2HG   GLU  86           HG1      GLU  86  -7.857   1.145  13.268
  532    H    TYR  87           H        TYR  87  -8.042   2.647   8.382
  533    HA   TYR  87           HA       TYR  87  -8.102   5.412   8.276
  534   1HB   TYR  87           HB1      TYR  87  -6.689   4.905   6.556
  535   2HB   TYR  87           HB2      TYR  87  -7.419   3.341   6.320
  536    HD1  TYR  87           HD2      TYR  87  -8.870   6.811   5.655
  537    HD2  TYR  87           HD1      TYR  87  -7.718   2.984   4.034
  538    HE1  TYR  87           HE2      TYR  87  -9.784   7.464   3.491
  539    HE2  TYR  87           HE1      TYR  87  -8.573   3.682   1.836
  540    HH   TYR  87           HH       TYR  87 -10.417   6.673   1.296
  541    H    ILE  88           H        ILE  88 -10.401   3.331   6.319
  542    HA   ILE  88           HA       ILE  88 -11.747   5.636   5.383
  543    HB   ILE  88           HB       ILE  88 -13.205   2.964   5.717
  544   1HG1  ILE  88           HG12     ILE  88 -12.310   3.122   3.001
  545   2HG1  ILE  88           HG11     ILE  88 -10.904   3.648   3.928
  546   1HG2  ILE  88           HG22     ILE  88 -14.613   4.966   5.116
  547   2HG2  ILE  88           HG21     ILE  88 -13.558   5.274   3.704
  548   3HG2  ILE  88           HG23     ILE  88 -14.543   3.784   3.785
  549   1HD1  ILE  88           HD12     ILE  88 -11.228   1.475   5.343
  550   2HD1  ILE  88           HD11     ILE  88 -12.444   0.978   4.158
  551   3HD1  ILE  88           HD13     ILE  88 -10.741   1.223   3.654
  552    H    ARG  89           H        ARG  89 -12.453   3.507   8.273
  553    HA   ARG  89           HA       ARG  89 -14.810   4.961   8.966
  554   1HB   ARG  89           HB2      ARG  89 -12.931   3.511  10.925
  555   2HB   ARG  89           HB1      ARG  89 -14.620   3.989  11.188
  556   1HG   ARG  89           HG2      ARG  89 -14.781   2.435   8.796
  557   2HG   ARG  89           HG1      ARG  89 -13.512   1.616   9.735
  558   1HD   ARG  89           HD2      ARG  89 -16.474   1.983  10.437
  559   2HD   ARG  89           HD1      ARG  89 -15.546   0.526  10.271
  560    HE   ARG  89           HE       ARG  89 -14.406   0.761  12.301
  561   1HH1  ARG  89           HH11     ARG  89 -16.850   3.450  11.949
  562   2HH1  ARG  89           HH12     ARG  89 -16.806   3.759  13.669
  563   1HH2  ARG  89           HH21     ARG  89 -14.450   1.296  14.454
  564   2HH2  ARG  89           HH22     ARG  89 -15.486   2.591  15.051
  565    H    ASN  90           H        ASN  90 -11.343   5.649   9.533
  566    HA   ASN  90           HA       ASN  90 -11.889   7.777  11.463
  567   1HB   ASN  90           HB2      ASN  90  -9.761   6.493  11.517
  568   2HB   ASN  90           HB1      ASN  90  -9.337   7.047   9.887
  569   1HD2  ASN  90           HD22     ASN  90  -8.122  10.226  10.962
  570   2HD2  ASN  90           HD21     ASN  90  -8.527   9.268   9.586
  571    H    PHE  91           H        PHE  91 -11.828   7.480   7.892
  572    HA   PHE  91           HA       PHE  91 -12.032  10.477   7.736
  573   1HB   PHE  91           HB2      PHE  91  -9.863   8.864   6.916
  574   2HB   PHE  91           HB1      PHE  91 -10.824   8.956   5.431
  575    HD1  PHE  91           HD1      PHE  91  -9.755  11.175   8.324
  576    HD2  PHE  91           HD2      PHE  91 -10.029  10.796   4.038
  577    HE1  PHE  91           HE1      PHE  91  -8.623  13.355   8.060
  578    HE2  PHE  91           HE2      PHE  91  -8.806  12.934   3.781
  579    HZ   PHE  91           HZ       PHE  91  -8.105  14.222   5.786
  580    H    GLY  92           H        GLY  92 -14.270   8.623   8.107
  581   1HA   GLY  92           HA1      GLY  92 -16.065   9.550   6.259
  582   2HA   GLY  92           HA2      GLY  92 -15.353   8.139   5.416
   
  No H/Q in entry =         582
  Start of MODEL    6
    1    H    MET  15           H        MET  15  -2.590   9.107  12.072
    2    HA   MET  15           HA       MET  15  -0.924   9.805   9.723
    3   1HB   MET  15           HB2      MET  15  -0.093   8.103  12.156
    4   2HB   MET  15           HB1      MET  15   0.969   8.686  10.844
    5   1HG   MET  15           HG2      MET  15   0.434  11.087  11.526
    6   2HG   MET  15           HG1      MET  15  -0.565  10.452  12.866
    7   1HE   MET  15           HE1      MET  15   2.987  10.909  11.379
    8   2HE   MET  15           HE3      MET  15   4.061  10.291  12.674
    9   3HE   MET  15           HE2      MET  15   3.188   9.139  11.623
   10    H    ALA  16           H        ALA  16  -2.260   6.852  11.460
   11    HA   ALA  16           HA       ALA  16  -1.301   5.054   9.562
   12   1HB   ALA  16           HB3      ALA  16  -2.392   4.453  11.789
   13   2HB   ALA  16           HB2      ALA  16  -3.981   4.664  10.996
   14   3HB   ALA  16           HB1      ALA  16  -2.821   3.434  10.416
   15    HA   PRO  17           HA       PRO  17  -4.929   5.815   6.627
   16   1HB   PRO  17           HB2      PRO  17  -6.317   8.250   6.685
   17   2HB   PRO  17           HB1      PRO  17  -6.831   6.798   7.578
   18   1HG   PRO  17           HG2      PRO  17  -5.363   9.188   8.676
   19   2HG   PRO  17           HG1      PRO  17  -6.690   8.245   9.425
   20   1HD   PRO  17           HD2      PRO  17  -4.010   7.931  10.083
   21   2HD   PRO  17           HD1      PRO  17  -5.185   6.581  10.245
   22    H    ALA  18           H        ALA  18  -2.932   8.695   7.724
   23    HA   ALA  18           HA       ALA  18  -2.580   9.726   5.087
   24   1HB   ALA  18           HB3      ALA  18  -1.701  10.911   7.155
   25   2HB   ALA  18           HB2      ALA  18  -0.427   9.656   7.292
   26   3HB   ALA  18           HB1      ALA  18  -0.471  10.725   5.866
   27    H    LEU  19           H        LEU  19  -1.138   6.890   6.850
   28    HA   LEU  19           HA       LEU  19   1.012   6.547   5.068
   29   1HB   LEU  19           HB2      LEU  19   1.046   5.468   7.169
   30   2HB   LEU  19           HB1      LEU  19  -0.436   4.551   6.866
   31    HG   LEU  19           HG       LEU  19   1.777   3.289   6.720
   32   1HD1  LEU  19           HD12     LEU  19  -0.407   2.441   5.827
   33   2HD1  LEU  19           HD11     LEU  19   0.089   2.969   4.208
   34   3HD1  LEU  19           HD13     LEU  19   1.014   1.731   5.077
   35   1HD2  LEU  19           HD21     LEU  19   3.086   5.014   5.585
   36   2HD2  LEU  19           HD23     LEU  19   3.219   3.450   4.773
   37   3HD2  LEU  19           HD22     LEU  19   2.220   4.729   4.051
   38    H    VAL  20           H        VAL  20  -2.159   4.534   4.921
   39    HA   VAL  20           HA       VAL  20  -1.589   3.550   2.408
   40    HB   VAL  20           HB       VAL  20  -3.649   2.877   3.602
   41   1HG1  VAL  20           HG12     VAL  20  -4.485   5.104   4.367
   42   2HG1  VAL  20           HG11     VAL  20  -4.834   5.594   2.684
   43   3HG1  VAL  20           HG13     VAL  20  -5.755   4.274   3.438
   44   1HG2  VAL  20           HG21     VAL  20  -3.440   2.376   1.148
   45   2HG2  VAL  20           HG23     VAL  20  -5.136   2.577   1.662
   46   3HG2  VAL  20           HG22     VAL  20  -4.318   3.891   0.777
   47    H    ALA  21           H        ALA  21  -2.703   6.919   3.192
   48    HA   ALA  21           HA       ALA  21  -3.300   7.499   0.529
   49   1HB   ALA  21           HB3      ALA  21  -4.022   8.991   2.397
   50   2HB   ALA  21           HB2      ALA  21  -2.332   9.549   2.597
   51   3HB   ALA  21           HB1      ALA  21  -3.210   9.899   1.086
   52    H    ALA  22           H        ALA  22  -0.181   7.611   2.346
   53    HA   ALA  22           HA       ALA  22   1.324   9.199   0.616
   54   1HB   ALA  22           HB3      ALA  22   2.142   8.371   2.847
   55   2HB   ALA  22           HB2      ALA  22   2.225   6.719   2.161
   56   3HB   ALA  22           HB1      ALA  22   3.332   7.999   1.562
   57    H    PHE  23           H        PHE  23   0.338   5.806  -0.049
   58    HA   PHE  23           HA       PHE  23   1.721   6.180  -2.649
   59   1HB   PHE  23           HB2      PHE  23   2.982   4.674  -0.965
   60   2HB   PHE  23           HB1      PHE  23   1.741   3.441  -1.429
   61    HD1  PHE  23           HD2      PHE  23   3.260   5.661  -4.138
   62    HD2  PHE  23           HD1      PHE  23   3.634   2.000  -1.878
   63    HE1  PHE  23           HE2      PHE  23   5.174   4.966  -5.463
   64    HE2  PHE  23           HE1      PHE  23   5.141   1.120  -3.590
   65    HZ   PHE  23           HZ       PHE  23   5.791   2.544  -5.533
   66    H    GLY  24           H        GLY  24  -0.946   4.233  -0.975
   67   1HA   GLY  24           HA1      GLY  24  -2.211   3.748  -3.525
   68   2HA   GLY  24           HA2      GLY  24  -2.959   3.598  -1.916
   69    H    GLY  25           H        GLY  25  -2.173   6.623  -1.365
   70   1HA   GLY  25           HA1      GLY  25  -4.600   7.705  -2.757
   71   2HA   GLY  25           HA2      GLY  25  -3.775   8.482  -1.408
   72    H    LYS  26           H        LYS  26  -1.446   7.342  -3.728
   73    HA   LYS  26           HA       LYS  26  -0.963  10.153  -4.561
   74   1HB   LYS  26           HB2      LYS  26   0.359   7.474  -5.164
   75   2HB   LYS  26           HB1      LYS  26   0.920   9.043  -5.819
   76   1HG   LYS  26           HG2      LYS  26   0.766   8.380  -2.809
   77   2HG   LYS  26           HG1      LYS  26   2.187   8.137  -3.875
   78   1HD   LYS  26           HD2      LYS  26   1.798  10.717  -4.493
   79   2HD   LYS  26           HD1      LYS  26   0.952  10.777  -2.935
   80   1HE   LYS  26           HE2      LYS  26   2.936  10.264  -1.722
   81   2HE   LYS  26           HE1      LYS  26   3.792   9.530  -3.092
   82   1HZ   LYS  26           HZ2      LYS  26   3.895  11.739  -4.226
   83   2HZ   LYS  26           HZ1      LYS  26   3.237  12.471  -2.787
   84   3HZ   LYS  26           HZ3      LYS  26   4.787  11.645  -2.780
   85    H    GLU  27           H        GLU  27  -3.221  10.273  -5.591
   86    HA   GLU  27           HA       GLU  27  -4.022   8.330  -7.476
   87   1HB   GLU  27           HB2      GLU  27  -5.938   9.547  -7.686
   88   2HB   GLU  27           HB1      GLU  27  -5.263  10.684  -6.508
   89   1HG   GLU  27           HG2      GLU  27  -4.248  11.993  -8.464
   90   2HG   GLU  27           HG1      GLU  27  -5.111  10.885  -9.575
   91    H    ASN  28           H        ASN  28  -1.841  11.157  -7.877
   92    HA   ASN  28           HA       ASN  28  -1.698  11.425 -10.596
   93   1HB   ASN  28           HB2      ASN  28  -0.265  12.712  -9.042
   94   2HB   ASN  28           HB1      ASN  28   0.630  11.244  -8.575
   95   1HD2  ASN  28           HD22     ASN  28   2.910  11.649 -11.317
   96   2HD2  ASN  28           HD21     ASN  28   2.620  10.914  -9.784
   97    H    ILE  29           H        ILE  29  -0.509   8.644  -8.741
   98    HA   ILE  29           HA       ILE  29   1.093   7.147  -9.967
   99    HB   ILE  29           HB       ILE  29  -1.752   6.711  -9.104
  100   1HG1  ILE  29           HG12     ILE  29  -0.932   5.575  -7.303
  101   2HG1  ILE  29           HG11     ILE  29   0.142   4.625  -8.285
  102   1HG2  ILE  29           HG21     ILE  29  -0.635   4.478 -10.822
  103   2HG2  ILE  29           HG23     ILE  29  -2.008   4.342  -9.693
  104   3HG2  ILE  29           HG22     ILE  29  -2.091   5.458 -11.061
  105   1HD1  ILE  29           HD11     ILE  29   0.901   7.424  -7.405
  106   2HD1  ILE  29           HD13     ILE  29   1.369   5.906  -6.564
  107   3HD1  ILE  29           HD12     ILE  29   1.997   6.318  -8.145
  108    H    THR  30           H        THR  30   1.529   5.484 -11.460
  109    HA   THR  30           HA       THR  30   0.520   6.204 -14.171
  110    HB   THR  30           HB       THR  30   2.568   5.274 -15.011
  111    HG1  THR  30           HG1      THR  30   4.033   4.199 -13.550
  112   1HG2  THR  30           HG22     THR  30   3.177   6.985 -12.499
  113   2HG2  THR  30           HG21     THR  30   4.308   6.691 -13.841
  114   3HG2  THR  30           HG23     THR  30   2.799   7.604 -14.136
  115    H    ASN  31           H        ASN  31   1.652   3.126 -12.431
  116    HA   ASN  31           HA       ASN  31  -0.657   1.666 -13.671
  117   1HB   ASN  31           HB2      ASN  31   2.346   1.178 -14.027
  118   2HB   ASN  31           HB1      ASN  31   1.195  -0.172 -14.111
  119   1HD2  ASN  31           HD22     ASN  31   1.480   2.137 -17.399
  120   2HD2  ASN  31           HD21     ASN  31   2.568   2.387 -16.082
  121    H    LEU  32           H        LEU  32  -1.707   1.005 -11.690
  122    HA   LEU  32           HA       LEU  32   0.013  -0.636  -9.803
  123   1HB   LEU  32           HB2      LEU  32  -2.515   1.051  -9.436
  124   2HB   LEU  32           HB1      LEU  32  -2.213  -0.326  -8.361
  125    HG   LEU  32           HG       LEU  32  -0.340   0.660  -7.358
  126   1HD1  LEU  32           HD12     LEU  32   0.984   1.376  -9.423
  127   2HD1  LEU  32           HD11     LEU  32  -0.163   2.677  -9.632
  128   3HD1  LEU  32           HD13     LEU  32   0.946   2.614  -8.230
  129   1HD2  LEU  32           HD21     LEU  32  -2.343   1.734  -6.562
  130   2HD2  LEU  32           HD23     LEU  32  -0.991   2.892  -6.568
  131   3HD2  LEU  32           HD22     LEU  32  -2.243   2.977  -7.826
  132    H    ASP  33           H        ASP  33  -1.045  -2.566  -8.936
  133    HA   ASP  33           HA       ASP  33  -3.044  -3.798 -10.810
  134   1HB   ASP  33           HB2      ASP  33  -0.219  -4.610 -10.298
  135   2HB   ASP  33           HB1      ASP  33  -1.404  -5.927 -10.186
  136    H    ALA  34           H        ALA  34  -4.316  -2.813  -8.891
  137    HA   ALA  34           HA       ALA  34  -3.955  -3.909  -6.298
  138   1HB   ALA  34           HB3      ALA  34  -5.250  -1.878  -6.608
  139   2HB   ALA  34           HB2      ALA  34  -6.520  -2.792  -7.478
  140   3HB   ALA  34           HB1      ALA  34  -6.208  -3.119  -5.746
  141    H    CYS  35           H        CYS  35  -4.980  -5.828  -5.232
  142    HA   CYS  35           HA       CYS  35  -6.995  -7.273  -6.744
  143   1HB   CYS  35           HB2      CYS  35  -4.531  -7.856  -7.726
  144   2HB   CYS  35           HB1      CYS  35  -4.515  -8.952  -6.309
  145    HG   CYS  35           HG       CYS  35  -5.393 -10.153  -8.377
  146    H    ILE  36           H        ILE  36  -7.553  -9.473  -5.608
  147    HA   ILE  36           HA       ILE  36  -8.570  -9.073  -3.289
  148    HB   ILE  36           HB       ILE  36  -8.515 -11.404  -2.582
  149   1HG1  ILE  36           HG12     ILE  36  -6.412 -12.443  -3.034
  150   2HG1  ILE  36           HG11     ILE  36  -7.561 -13.205  -4.103
  151   1HG2  ILE  36           HG22     ILE  36 -10.121 -10.575  -4.338
  152   2HG2  ILE  36           HG21     ILE  36  -9.062 -11.244  -5.610
  153   3HG2  ILE  36           HG23     ILE  36  -9.802 -12.322  -4.410
  154   1HD1  ILE  36           HD11     ILE  36  -5.605 -11.014  -5.086
  155   2HD1  ILE  36           HD13     ILE  36  -5.404 -12.769  -5.233
  156   3HD1  ILE  36           HD12     ILE  36  -6.752 -11.951  -6.073
  157    H    THR  37           H        THR  37  -5.219 -10.598  -2.907
  158    HA   THR  37           HA       THR  37  -4.943  -8.864  -0.503
  159    HB   THR  37           HB       THR  37  -3.925 -10.857   0.640
  160    HG1  THR  37           HG1      THR  37  -3.359 -12.090  -1.286
  161   1HG2  THR  37           HG23     THR  37  -6.364 -10.398   1.008
  162   2HG2  THR  37           HG22     THR  37  -6.766 -11.486  -0.355
  163   3HG2  THR  37           HG21     THR  37  -5.975 -12.142   1.106
  164    H    ARG  38           H        ARG  38  -4.165  -8.462  -3.329
  165    HA   ARG  38           HA       ARG  38  -1.255  -8.471  -2.988
  166   1HB   ARG  38           HB2      ARG  38  -1.586 -10.647  -3.905
  167   2HB   ARG  38           HB1      ARG  38  -2.812 -10.088  -5.029
  168   1HG   ARG  38           HG2      ARG  38  -0.086  -8.742  -5.332
  169   2HG   ARG  38           HG1      ARG  38  -0.057 -10.467  -5.619
  170   1HD   ARG  38           HD2      ARG  38  -2.335  -9.629  -7.200
  171   2HD   ARG  38           HD1      ARG  38  -1.139  -8.351  -7.369
  172    HE   ARG  38           HE       ARG  38  -0.052  -9.767  -8.816
  173   1HH1  ARG  38           HH11     ARG  38  -1.813 -11.817  -6.455
  174   2HH1  ARG  38           HH12     ARG  38  -1.169 -13.295  -7.148
  175   1HH2  ARG  38           HH21     ARG  38   0.689 -11.690  -9.673
  176   2HH2  ARG  38           HH22     ARG  38   0.208 -13.231  -8.967
  177    H    LEU  39           H        LEU  39  -0.984  -6.205  -3.183
  178    HA   LEU  39           HA       LEU  39  -2.219  -5.039  -5.603
  179   1HB   LEU  39           HB2      LEU  39  -2.624  -2.890  -4.465
  180   2HB   LEU  39           HB1      LEU  39  -3.476  -4.207  -3.654
  181    HG   LEU  39           HG       LEU  39  -1.273  -4.190  -2.052
  182   1HD1  LEU  39           HD12     LEU  39  -0.114  -2.383  -3.424
  183   2HD1  LEU  39           HD11     LEU  39  -1.431  -1.266  -2.974
  184   3HD1  LEU  39           HD13     LEU  39  -0.356  -1.937  -1.712
  185   1HD2  LEU  39           HD22     LEU  39  -3.535  -2.087  -1.809
  186   2HD2  LEU  39           HD21     LEU  39  -3.626  -3.756  -1.215
  187   3HD2  LEU  39           HD23     LEU  39  -2.467  -2.632  -0.488
  188    H    ARG  40           H        ARG  40  -0.843  -3.565  -6.837
  189    HA   ARG  40           HA       ARG  40   2.042  -3.767  -5.929
  190   1HB   ARG  40           HB2      ARG  40   1.156  -3.697  -8.792
  191   2HB   ARG  40           HB1      ARG  40   2.722  -4.240  -8.242
  192   1HG   ARG  40           HG2      ARG  40   0.055  -5.835  -8.003
  193   2HG   ARG  40           HG1      ARG  40   1.314  -5.990  -9.266
  194   1HD   ARG  40           HD2      ARG  40   2.864  -6.462  -7.266
  195   2HD   ARG  40           HD1      ARG  40   1.402  -7.079  -6.444
  196    HE   ARG  40           HE       ARG  40   1.579  -8.238  -9.043
  197   1HH1  ARG  40           HH11     ARG  40   3.575  -8.214  -6.058
  198   2HH1  ARG  40           HH12     ARG  40   4.314  -9.762  -6.446
  199   1HH2  ARG  40           HH21     ARG  40   2.588 -10.180  -9.483
  200   2HH2  ARG  40           HH22     ARG  40   3.755 -10.870  -8.356
  201    H    VAL  41           H        VAL  41   3.515  -2.052  -7.093
  202    HA   VAL  41           HA       VAL  41   1.857   0.317  -7.646
  203    HB   VAL  41           HB       VAL  41   3.975   0.579  -5.581
  204   1HG1  VAL  41           HG12     VAL  41   2.849   2.669  -6.572
  205   2HG1  VAL  41           HG11     VAL  41   1.253   2.031  -6.053
  206   3HG1  VAL  41           HG13     VAL  41   2.420   2.480  -4.851
  207   1HG2  VAL  41           HG21     VAL  41   2.598  -1.231  -4.599
  208   2HG2  VAL  41           HG23     VAL  41   2.355   0.290  -3.728
  209   3HG2  VAL  41           HG22     VAL  41   1.115  -0.265  -4.871
  210    H    SER  42           H        SER  42   2.960  -0.520  -9.827
  211    HA   SER  42           HA       SER  42   5.752   0.225 -10.050
  212   1HB   SER  42           HB2      SER  42   4.849  -1.517 -11.561
  213   2HB   SER  42           HB1      SER  42   3.646  -0.355 -12.200
  214    HG   SER  42           HG       SER  42   5.546  -0.494 -13.605
  215    H    VAL  43           H        VAL  43   6.108   2.434  -9.394
  216    HA   VAL  43           HA       VAL  43   5.265   4.331 -11.516
  217    HB   VAL  43           HB       VAL  43   4.220   5.821  -9.950
  218   1HG1  VAL  43           HG12     VAL  43   2.891   3.788 -10.659
  219   2HG1  VAL  43           HG11     VAL  43   3.295   2.990  -9.117
  220   3HG1  VAL  43           HG13     VAL  43   2.283   4.420  -9.154
  221   1HG2  VAL  43           HG21     VAL  43   5.794   5.527  -7.959
  222   2HG2  VAL  43           HG23     VAL  43   4.087   5.371  -7.527
  223   3HG2  VAL  43           HG22     VAL  43   5.108   3.924  -7.670
  224    H    ALA  44           H        ALA  44   6.528   6.337 -11.646
  225    HA   ALA  44           HA       ALA  44   9.243   5.994 -10.513
  226   1HB   ALA  44           HB3      ALA  44   8.961   6.850 -12.857
  227   2HB   ALA  44           HB2      ALA  44   8.092   8.279 -12.219
  228   3HB   ALA  44           HB1      ALA  44   9.811   8.015 -11.802
  229    H    ASP  45           H        ASP  45   6.229   7.384  -9.357
  230    HA   ASP  45           HA       ASP  45   7.412   9.592  -7.926
  231   1HB   ASP  45           HB2      ASP  45   4.944   9.264  -8.468
  232   2HB   ASP  45           HB1      ASP  45   4.891   7.997  -7.224
  233    H    VAL  46           H        VAL  46   9.462   8.162  -7.382
  234    HA   VAL  46           HA       VAL  46   8.948   6.689  -4.839
  235    HB   VAL  46           HB       VAL  46   9.868   5.328  -6.749
  236   1HG1  VAL  46           HG12     VAL  46  11.450   6.967  -7.761
  237   2HG1  VAL  46           HG11     VAL  46  12.475   6.931  -6.301
  238   3HG1  VAL  46           HG13     VAL  46  12.288   5.471  -7.296
  239   1HG2  VAL  46           HG22     VAL  46  11.594   5.458  -4.188
  240   2HG2  VAL  46           HG21     VAL  46  10.105   4.507  -4.437
  241   3HG2  VAL  46           HG23     VAL  46  11.568   4.118  -5.358
  242    H    SER  47           H        SER  47   8.977   9.631  -5.132
  243    HA   SER  47           HA       SER  47  11.706  10.505  -4.657
  244   1HB   SER  47           HB2      SER  47  10.333  12.040  -5.813
  245   2HB   SER  47           HB1      SER  47   9.038  11.986  -4.597
  246    HG   SER  47           HG       SER  47  10.451  13.842  -4.248
  247    H    LYS  48           H        LYS  48   8.973  11.375  -2.392
  248    HA   LYS  48           HA       LYS  48  10.781  10.493  -0.175
  249   1HB   LYS  48           HB2      LYS  48   9.416  11.861   1.303
  250   2HB   LYS  48           HB1      LYS  48  10.094  12.818  -0.035
  251   1HG   LYS  48           HG2      LYS  48   7.787  13.498   0.569
  252   2HG   LYS  48           HG1      LYS  48   7.873  12.985  -1.126
  253   1HD   LYS  48           HD2      LYS  48   6.760  10.876  -0.615
  254   2HD   LYS  48           HD1      LYS  48   6.942  11.129   1.158
  255   1HE   LYS  48           HE2      LYS  48   5.376  13.123   0.976
  256   2HE   LYS  48           HE1      LYS  48   5.138  12.736  -0.738
  257   1HZ   LYS  48           HZ2      LYS  48   4.441  10.377   0.091
  258   2HZ   LYS  48           HZ1      LYS  48   4.429  11.047   1.671
  259   3HZ   LYS  48           HZ3      LYS  48   3.343  11.680   0.455
  260    H    VAL  49           H        VAL  49   8.493   9.016  -2.086
  261    HA   VAL  49           HA       VAL  49   6.355   8.364  -0.654
  262    HB   VAL  49           HB       VAL  49   6.992   7.449  -2.931
  263   1HG1  VAL  49           HG12     VAL  49   9.284   6.704  -2.439
  264   2HG1  VAL  49           HG11     VAL  49   8.710   5.417  -1.368
  265   3HG1  VAL  49           HG13     VAL  49   8.301   5.355  -3.081
  266   1HG2  VAL  49           HG22     VAL  49   5.822   5.466  -0.876
  267   2HG2  VAL  49           HG21     VAL  49   4.980   6.604  -1.956
  268   3HG2  VAL  49           HG23     VAL  49   5.862   5.216  -2.641
  269    H    ASP  50           H        ASP  50   5.752   6.921   1.168
  270    HA   ASP  50           HA       ASP  50   8.134   6.125   2.821
  271   1HB   ASP  50           HB2      ASP  50   6.526   5.998   4.680
  272   2HB   ASP  50           HB1      ASP  50   6.487   7.592   3.884
  273    H    GLN  51           H        GLN  51   8.082   4.485   0.637
  274    HA   GLN  51           HA       GLN  51   6.187   2.352   0.840
  275   1HB   GLN  51           HB2      GLN  51   9.053   2.367  -0.313
  276   2HB   GLN  51           HB1      GLN  51   7.951   0.943  -0.417
  277   1HG   GLN  51           HG2      GLN  51   6.311   2.144  -1.683
  278   2HG   GLN  51           HG1      GLN  51   7.160   3.673  -1.445
  279   1HE2  GLN  51           HE22     GLN  51   9.572   1.655  -3.944
  280   2HE2  GLN  51           HE21     GLN  51   9.443   1.155  -2.328
  281    H    ALA  52           H        ALA  52   9.560   2.839   2.126
  282    HA   ALA  52           HA       ALA  52   9.971   0.379   3.262
  283   1HB   ALA  52           HB3      ALA  52  11.617   2.259   3.417
  284   2HB   ALA  52           HB2      ALA  52  10.551   3.100   4.588
  285   3HB   ALA  52           HB1      ALA  52  11.324   1.540   5.030
  286    H    GLY  53           H        GLY  53   7.663   2.909   4.472
  287   1HA   GLY  53           HA1      GLY  53   6.868   1.111   6.706
  288   2HA   GLY  53           HA2      GLY  53   6.200   2.713   6.332
  289    H    LEU  54           H        LEU  54   5.466   2.402   3.548
  290    HA   LEU  54           HA       LEU  54   2.955   1.282   4.053
  291   1HB   LEU  54           HB2      LEU  54   3.581   3.005   2.257
  292   2HB   LEU  54           HB1      LEU  54   3.970   1.638   1.188
  293    HG   LEU  54           HG       LEU  54   1.253   1.515   2.522
  294   1HD1  LEU  54           HD11     LEU  54   1.922   3.889   0.813
  295   2HD1  LEU  54           HD13     LEU  54   0.275   3.191   0.819
  296   3HD1  LEU  54           HD12     LEU  54   1.046   3.792   2.295
  297   1HD2  LEU  54           HD21     LEU  54   1.878  -0.159   0.752
  298   2HD2  LEU  54           HD23     LEU  54   0.448   0.796   0.302
  299   3HD2  LEU  54           HD22     LEU  54   2.027   1.174  -0.415
  300    H    LYS  55           H        LYS  55   5.900  -0.247   2.999
  301    HA   LYS  55           HA       LYS  55   4.592  -2.395   1.742
  302   1HB   LYS  55           HB2      LYS  55   6.917  -3.492   1.713
  303   2HB   LYS  55           HB1      LYS  55   6.842  -1.783   1.174
  304   1HG   LYS  55           HG2      LYS  55   8.821  -2.043   2.240
  305   2HG   LYS  55           HG1      LYS  55   7.881  -1.235   3.491
  306   1HD   LYS  55           HD2      LYS  55   8.207  -2.951   4.969
  307   2HD   LYS  55           HD1      LYS  55   7.745  -4.188   3.780
  308   1HE   LYS  55           HE2      LYS  55  10.077  -4.485   4.590
  309   2HE   LYS  55           HE1      LYS  55  10.075  -4.154   2.839
  310   1HZ   LYS  55           HZ1      LYS  55  10.530  -1.984   4.903
  311   2HZ   LYS  55           HZ3      LYS  55  11.821  -2.951   4.266
  312   3HZ   LYS  55           HZ2      LYS  55  10.912  -1.927   3.214
  313    H    LYS  56           H        LYS  56   5.894  -2.045   4.970
  314    HA   LYS  56           HA       LYS  56   4.887  -4.764   5.693
  315   1HB   LYS  56           HB2      LYS  56   5.939  -4.432   7.887
  316   2HB   LYS  56           HB1      LYS  56   7.075  -4.317   6.536
  317   1HG   LYS  56           HG2      LYS  56   6.956  -1.713   6.796
  318   2HG   LYS  56           HG1      LYS  56   5.980  -1.983   8.235
  319   1HD   LYS  56           HD2      LYS  56   8.853  -3.025   7.665
  320   2HD   LYS  56           HD1      LYS  56   8.477  -1.533   8.557
  321   1HE   LYS  56           HE2      LYS  56   7.779  -4.392   9.475
  322   2HE   LYS  56           HE1      LYS  56   9.069  -3.340  10.101
  323   1HZ   LYS  56           HZ2      LYS  56   7.262  -1.669  10.735
  324   2HZ   LYS  56           HZ1      LYS  56   6.087  -2.919  10.398
  325   3HZ   LYS  56           HZ3      LYS  56   7.268  -3.151  11.632
  326    H    LEU  57           H        LEU  57   4.170  -1.279   6.407
  327    HA   LEU  57           HA       LEU  57   2.160  -2.116   8.356
  328   1HB   LEU  57           HB2      LEU  57   3.759  -0.087   8.496
  329   2HB   LEU  57           HB1      LEU  57   2.702   0.699   7.316
  330    HG   LEU  57           HG       LEU  57   2.531   0.633  10.239
  331   1HD1  LEU  57           HD12     LEU  57   2.092   2.625   8.883
  332   2HD1  LEU  57           HD11     LEU  57   0.608   1.851   8.196
  333   3HD1  LEU  57           HD13     LEU  57   0.689   2.295   9.921
  334   1HD2  LEU  57           HD21     LEU  57   1.069  -1.396  10.193
  335   2HD2  LEU  57           HD23     LEU  57   0.219   0.054  10.750
  336   3HD2  LEU  57           HD22     LEU  57  -0.042  -0.506   9.095
  337    H    GLY  58           H        GLY  58   2.256  -0.741   4.948
  338   1HA   GLY  58           HA1      GLY  58  -0.697  -0.477   4.941
  339   2HA   GLY  58           HA2      GLY  58   0.380  -0.229   3.561
  340    H    ALA  59           H        ALA  59   1.861  -2.443   3.188
  341    HA   ALA  59           HA       ALA  59  -0.241  -4.457   2.628
  342   1HB   ALA  59           HB3      ALA  59   1.088  -3.321   0.712
  343   2HB   ALA  59           HB2      ALA  59   2.538  -4.177   1.311
  344   3HB   ALA  59           HB1      ALA  59   1.132  -5.098   0.695
  345    H    ALA  60           H        ALA  60   1.625  -6.681   2.362
  346    HA   ALA  60           HA       ALA  60   2.871  -6.817   5.080
  347   1HB   ALA  60           HB3      ALA  60   0.561  -8.017   4.952
  348   2HB   ALA  60           HB2      ALA  60   1.316  -9.144   3.783
  349   3HB   ALA  60           HB1      ALA  60   1.950  -9.032   5.448
  350    H    GLY  61           H        GLY  61   4.197  -6.132   2.568
  351   1HA   GLY  61           HA1      GLY  61   6.488  -7.377   2.511
  352   2HA   GLY  61           HA2      GLY  61   5.534  -8.714   1.833
  353    H    VAL  62           H        VAL  62   7.305  -5.921   0.840
  354    HA   VAL  62           HA       VAL  62   6.130  -6.379  -1.842
  355    HB   VAL  62           HB       VAL  62   5.780  -4.046  -2.314
  356   1HG1  VAL  62           HG11     VAL  62   5.206  -4.285   0.664
  357   2HG1  VAL  62           HG13     VAL  62   4.603  -2.980  -0.429
  358   3HG1  VAL  62           HG12     VAL  62   4.115  -4.675  -0.583
  359   1HG2  VAL  62           HG22     VAL  62   7.946  -3.346  -0.326
  360   2HG2  VAL  62           HG21     VAL  62   7.920  -3.176  -2.082
  361   3HG2  VAL  62           HG23     VAL  62   6.855  -2.151  -1.123
  362    H    VAL  63           H        VAL  63   7.589  -5.192  -3.537
  363    HA   VAL  63           HA       VAL  63  10.425  -5.473  -2.758
  364    HB   VAL  63           HB       VAL  63  10.427  -7.675  -3.393
  365   1HG1  VAL  63           HG11     VAL  63   7.822  -7.224  -4.949
  366   2HG1  VAL  63           HG13     VAL  63   8.644  -8.799  -4.783
  367   3HG1  VAL  63           HG12     VAL  63   8.007  -7.976  -3.340
  368   1HG2  VAL  63           HG21     VAL  63  11.623  -6.573  -5.280
  369   2HG2  VAL  63           HG23     VAL  63  10.817  -8.085  -5.805
  370   3HG2  VAL  63           HG22     VAL  63  10.098  -6.505  -6.218
  371    H    VAL  64           H        VAL  64  11.710  -4.008  -3.984
  372    HA   VAL  64           HA       VAL  64  10.038  -2.281  -5.765
  373    HB   VAL  64           HB       VAL  64  12.609  -1.647  -4.241
  374   1HG1  VAL  64           HG12     VAL  64  12.186  -0.215  -6.280
  375   2HG1  VAL  64           HG11     VAL  64  10.583   0.225  -5.630
  376   3HG1  VAL  64           HG13     VAL  64  12.053   0.729  -4.765
  377   1HG2  VAL  64           HG21     VAL  64  10.720  -2.147  -2.651
  378   2HG2  VAL  64           HG23     VAL  64  11.173  -0.426  -2.647
  379   3HG2  VAL  64           HG22     VAL  64   9.692  -0.969  -3.511
  380    H    ALA  65           H        ALA  65  10.761  -2.166  -7.998
  381    HA   ALA  65           HA       ALA  65  13.470  -3.334  -8.630
  382   1HB   ALA  65           HB2      ALA  65  10.759  -4.278  -9.734
  383   2HB   ALA  65           HB1      ALA  65  12.364  -4.825 -10.308
  384   3HB   ALA  65           HB3      ALA  65  11.824  -5.212  -8.647
  385    H    GLY  66           H        GLY  66  14.012  -1.020  -9.146
  386   1HA   GLY  66           HA1      GLY  66  12.870   0.900 -10.434
  387   2HA   GLY  66           HA2      GLY  66  14.438   0.347 -11.056
  388    H    SER  67           H        SER  67  11.191   0.955 -12.030
  389    HA   SER  67           HA       SER  67  10.575   0.539 -14.343
  390   1HB   SER  67           HB2      SER  67  10.604  -1.690 -15.342
  391   2HB   SER  67           HB1      SER  67  12.259  -1.126 -15.042
  392    HG   SER  67           HG       SER  67  10.788  -3.011 -13.394
  393    H    GLY  68           H        GLY  68  10.159  -1.161 -11.224
  394   1HA   GLY  68           HA1      GLY  68   7.430  -0.641 -11.342
  395   2HA   GLY  68           HA2      GLY  68   7.662  -2.363 -11.754
  396    H    VAL  69           H        VAL  69   6.211  -1.875  -9.445
  397    HA   VAL  69           HA       VAL  69   8.123  -2.670  -7.296
  398    HB   VAL  69           HB       VAL  69   5.835  -0.688  -6.887
  399   1HG1  VAL  69           HG11     VAL  69   7.883  -1.849  -4.908
  400   2HG1  VAL  69           HG13     VAL  69   6.846  -0.453  -4.553
  401   3HG1  VAL  69           HG12     VAL  69   6.114  -2.039  -4.912
  402   1HG2  VAL  69           HG22     VAL  69   8.853  -0.213  -7.109
  403   2HG2  VAL  69           HG21     VAL  69   7.539   0.540  -8.045
  404   3HG2  VAL  69           HG23     VAL  69   7.769   0.978  -6.330
  405    H    GLN  70           H        GLN  70   7.086  -4.334  -5.928
  406    HA   GLN  70           HA       GLN  70   4.390  -4.994  -6.884
  407   1HB   GLN  70           HB2      GLN  70   5.862  -7.431  -6.207
  408   2HB   GLN  70           HB1      GLN  70   5.037  -7.056  -7.727
  409   1HG   GLN  70           HG2      GLN  70   7.006  -5.885  -8.633
  410   2HG   GLN  70           HG1      GLN  70   7.916  -6.201  -7.148
  411   1HE2  GLN  70           HE22     GLN  70   7.679  -9.209  -9.849
  412   2HE2  GLN  70           HE21     GLN  70   7.135  -7.628 -10.249
  413    H    ALA  71           H        ALA  71   2.892  -5.619  -5.156
  414    HA   ALA  71           HA       ALA  71   4.117  -5.699  -2.536
  415   1HB   ALA  71           HB2      ALA  71   2.168  -3.445  -3.519
  416   2HB   ALA  71           HB1      ALA  71   2.208  -3.944  -1.819
  417   3HB   ALA  71           HB3      ALA  71   3.655  -3.310  -2.676
  418    H    ILE  72           H        ILE  72   2.928  -6.767  -0.850
  419    HA   ILE  72           HA       ILE  72   0.658  -8.246  -1.965
  420    HB   ILE  72           HB       ILE  72   3.355  -9.350  -1.516
  421   1HG1  ILE  72           HG12     ILE  72   2.064 -11.476  -2.623
  422   2HG1  ILE  72           HG11     ILE  72   0.792 -10.301  -2.950
  423   1HG2  ILE  72           HG22     ILE  72   2.438 -10.061   0.687
  424   2HG2  ILE  72           HG21     ILE  72   1.111 -10.925  -0.181
  425   3HG2  ILE  72           HG23     ILE  72   2.811 -11.424  -0.380
  426   1HD1  ILE  72           HD12     ILE  72   2.571  -8.883  -4.119
  427   2HD1  ILE  72           HD11     ILE  72   3.746 -10.193  -3.856
  428   3HD1  ILE  72           HD13     ILE  72   2.311 -10.470  -4.890
  429    H    PHE  73           H        PHE  73  -1.002  -8.709  -0.391
  430    HA   PHE  73           HA       PHE  73  -0.259  -8.014   2.434
  431   1HB   PHE  73           HB2      PHE  73  -2.251  -6.764   2.789
  432   2HB   PHE  73           HB1      PHE  73  -1.258  -6.043   1.488
  433    HD1  PHE  73           HD1      PHE  73  -1.823  -6.554  -0.964
  434    HD2  PHE  73           HD2      PHE  73  -4.632  -6.948   2.267
  435    HE1  PHE  73           HE1      PHE  73  -3.708  -6.229  -2.535
  436    HE2  PHE  73           HE2      PHE  73  -6.457  -6.202   0.723
  437    HZ   PHE  73           HZ       PHE  73  -6.016  -5.968  -1.686
  438    H    GLY  74           H        GLY  74   0.130 -10.432   1.848
  439   1HA   GLY  74           HA1      GLY  74  -2.398 -12.019   2.003
  440   2HA   GLY  74           HA2      GLY  74  -0.755 -12.600   1.691
  441    H    THR  75           H        THR  75  -0.613 -14.099   3.521
  442    HA   THR  75           HA       THR  75  -0.794 -14.716   5.787
  443    HB   THR  75           HB       THR  75   1.511 -14.346   5.557
  444    HG1  THR  75           HG1      THR  75   1.946 -13.431   7.678
  445   1HG2  THR  75           HG22     THR  75   0.965 -11.298   5.483
  446   2HG2  THR  75           HG21     THR  75   2.564 -12.039   5.733
  447   3HG2  THR  75           HG23     THR  75   1.666 -12.324   4.215
  448    H    LYS  76           H        LYS  76  -0.157 -11.731   7.378
  449    HA   LYS  76           HA       LYS  76  -2.808 -11.762   8.540
  450   1HB   LYS  76           HB2      LYS  76  -0.232 -10.521   9.201
  451   2HB   LYS  76           HB1      LYS  76  -1.369  -9.236   9.007
  452   1HG   LYS  76           HG2      LYS  76  -1.589  -9.651  11.237
  453   2HG   LYS  76           HG1      LYS  76  -2.920 -10.679  10.631
  454   1HD   LYS  76           HD2      LYS  76  -1.248 -12.645  10.679
  455   2HD   LYS  76           HD1      LYS  76  -0.063 -11.542  11.437
  456   1HE   LYS  76           HE2      LYS  76  -2.780 -12.415  12.591
  457   2HE   LYS  76           HE1      LYS  76  -1.155 -12.855  13.184
  458   1HZ   LYS  76           HZ2      LYS  76  -0.791 -10.397  13.674
  459   2HZ   LYS  76           HZ1      LYS  76  -2.491 -10.138  13.348
  460   3HZ   LYS  76           HZ3      LYS  76  -2.004 -11.175  14.639
  461    H    SER  77           H        SER  77  -3.759 -11.736   6.025
  462    HA   SER  77           HA       SER  77  -3.672  -9.099   4.835
  463   1HB   SER  77           HB2      SER  77  -5.315  -9.759   3.266
  464   2HB   SER  77           HB1      SER  77  -4.188 -11.142   3.437
  465    HG   SER  77           HG       SER  77  -5.887 -12.180   4.671
  466    H    ASP  78           H        ASP  78  -6.146 -11.074   6.708
  467    HA   ASP  78           HA       ASP  78  -8.146  -9.108   6.669
  468   1HB   ASP  78           HB2      ASP  78  -7.511 -11.183   8.850
  469   2HB   ASP  78           HB1      ASP  78  -9.033 -10.254   8.743
  470    H    ASN  79           H        ASN  79  -5.308  -9.428   8.926
  471    HA   ASN  79           HA       ASN  79  -6.287  -7.343  10.660
  472   1HB   ASN  79           HB2      ASN  79  -4.569  -9.034  11.349
  473   2HB   ASN  79           HB1      ASN  79  -3.416  -8.299  10.200
  474   1HD2  ASN  79           HD22     ASN  79  -2.392  -5.939  12.676
  475   2HD2  ASN  79           HD21     ASN  79  -1.935  -6.842  11.280
  476    H    LEU  80           H        LEU  80  -4.038  -7.394   7.790
  477    HA   LEU  80           HA       LEU  80  -3.404  -4.557   8.081
  478   1HB   LEU  80           HB2      LEU  80  -2.877  -6.617   5.898
  479   2HB   LEU  80           HB1      LEU  80  -2.635  -4.898   5.580
  480    HG   LEU  80           HG       LEU  80  -0.605  -6.359   6.395
  481   1HD1  LEU  80           HD12     LEU  80  -0.453  -3.928   5.973
  482   2HD1  LEU  80           HD11     LEU  80  -1.180  -3.608   7.577
  483   3HD1  LEU  80           HD13     LEU  80   0.450  -4.333   7.454
  484   1HD2  LEU  80           HD21     LEU  80  -1.821  -7.089   8.611
  485   2HD2  LEU  80           HD23     LEU  80  -0.160  -6.466   8.764
  486   3HD2  LEU  80           HD22     LEU  80  -1.549  -5.445   9.206
  487    H    LYS  81           H        LYS  81  -6.010  -6.429   6.408
  488    HA   LYS  81           HA       LYS  81  -6.900  -4.032   4.978
  489   1HB   LYS  81           HB2      LYS  81  -8.335  -6.683   5.518
  490   2HB   LYS  81           HB1      LYS  81  -8.958  -5.373   4.471
  491   1HG   LYS  81           HG2      LYS  81  -6.887  -5.564   3.038
  492   2HG   LYS  81           HG1      LYS  81  -6.366  -6.967   3.994
  493   1HD   LYS  81           HD2      LYS  81  -8.786  -6.781   2.131
  494   2HD   LYS  81           HD1      LYS  81  -7.377  -7.881   2.034
  495   1HE   LYS  81           HE2      LYS  81  -8.151  -8.978   4.197
  496   2HE   LYS  81           HE1      LYS  81  -9.650  -8.003   4.080
  497   1HZ   LYS  81           HZ2      LYS  81 -10.047  -9.005   1.807
  498   2HZ   LYS  81           HZ1      LYS  81  -8.677 -10.030   2.043
  499   3HZ   LYS  81           HZ3      LYS  81 -10.051 -10.184   3.084
  500    H    THR  82           H        THR  82  -7.477  -5.622   8.207
  501    HA   THR  82           HA       THR  82  -9.920  -4.241   8.762
  502    HB   THR  82           HB       THR  82  -7.754  -5.398  10.591
  503    HG1  THR  82           HG1      THR  82  -9.328  -6.835   9.537
  504   1HG2  THR  82           HG22     THR  82 -10.303  -3.906  11.431
  505   2HG2  THR  82           HG21     THR  82  -9.355  -4.989  12.497
  506   3HG2  THR  82           HG23     THR  82  -8.610  -3.493  11.868
  507    H    GLU  83           H        GLU  83  -6.447  -3.407   9.708
  508    HA   GLU  83           HA       GLU  83  -7.183  -0.884  10.718
  509   1HB   GLU  83           HB2      GLU  83  -4.860  -0.168  10.511
  510   2HB   GLU  83           HB1      GLU  83  -4.887  -1.882  11.006
  511   1HG   GLU  83           HG2      GLU  83  -4.535  -2.546   8.620
  512   2HG   GLU  83           HG1      GLU  83  -4.466  -0.826   8.127
  513    H    MET  84           H        MET  84  -6.542  -1.881   7.202
  514    HA   MET  84           HA       MET  84  -6.645   0.824   6.330
  515   1HB   MET  84           HB2      MET  84  -7.488  -1.640   4.697
  516   2HB   MET  84           HB1      MET  84  -7.400   0.038   4.090
  517   1HG   MET  84           HG2      MET  84  -4.892   0.039   4.823
  518   2HG   MET  84           HG1      MET  84  -5.042  -1.740   4.841
  519   1HE   MET  84           HE2      MET  84  -6.044  -3.093   2.606
  520   2HE   MET  84           HE1      MET  84  -7.344  -1.912   2.216
  521   3HE   MET  84           HE3      MET  84  -6.115  -2.329   0.985
  522    H    ASP  85           H        ASP  85  -9.216  -1.692   6.946
  523    HA   ASP  85           HA       ASP  85 -11.312  -0.293   5.822
  524   1HB   ASP  85           HB2      ASP  85 -11.542  -2.583   6.840
  525   2HB   ASP  85           HB1      ASP  85 -11.537  -1.835   8.463
  526    H    GLU  86           H        GLU  86  -9.885   0.074   9.201
  527    HA   GLU  86           HA       GLU  86 -11.651   2.157   9.933
  528   1HB   GLU  86           HB2      GLU  86  -8.743   1.707  10.852
  529   2HB   GLU  86           HB1      GLU  86  -9.758   3.067  11.403
  530   1HG   GLU  86           HG2      GLU  86 -11.538   1.343  12.150
  531   2HG   GLU  86           HG1      GLU  86 -10.272   0.099  11.943
  532    H    TYR  87           H        TYR  87  -8.528   2.274   8.020
  533    HA   TYR  87           HA       TYR  87  -8.214   5.053   8.228
  534   1HB   TYR  87           HB1      TYR  87  -7.670   3.343   5.731
  535   2HB   TYR  87           HB2      TYR  87  -6.984   4.944   6.025
  536    HD1  TYR  87           HD2      TYR  87  -6.696   3.692   9.291
  537    HD2  TYR  87           HD1      TYR  87  -5.202   2.893   5.338
  538    HE1  TYR  87           HE2      TYR  87  -4.940   2.296  10.226
  539    HE2  TYR  87           HE1      TYR  87  -3.188   1.838   6.316
  540    HH   TYR  87           HH       TYR  87  -2.870   1.132   9.799
  541    H    ILE  88           H        ILE  88 -10.265   3.247   5.811
  542    HA   ILE  88           HA       ILE  88 -10.893   5.741   4.449
  543    HB   ILE  88           HB       ILE  88 -12.559   3.185   4.301
  544   1HG1  ILE  88           HG12     ILE  88 -10.818   3.324   1.983
  545   2HG1  ILE  88           HG11     ILE  88  -9.761   3.605   3.372
  546   1HG2  ILE  88           HG22     ILE  88 -13.594   5.246   3.333
  547   2HG2  ILE  88           HG21     ILE  88 -12.160   5.488   2.293
  548   3HG2  ILE  88           HG23     ILE  88 -13.205   4.057   2.064
  549   1HD1  ILE  88           HD12     ILE  88 -10.801   1.471   4.419
  550   2HD1  ILE  88           HD11     ILE  88 -11.619   1.188   2.873
  551   3HD1  ILE  88           HD13     ILE  88  -9.828   1.191   2.956
  552    H    ARG  89           H        ARG  89 -12.512   3.630   6.945
  553    HA   ARG  89           HA       ARG  89 -14.872   5.250   7.117
  554   1HB   ARG  89           HB2      ARG  89 -13.497   3.484   9.229
  555   2HB   ARG  89           HB1      ARG  89 -15.095   4.237   9.441
  556   1HG   ARG  89           HG2      ARG  89 -16.037   2.986   7.551
  557   2HG   ARG  89           HG1      ARG  89 -14.462   2.290   7.126
  558   1HD   ARG  89           HD2      ARG  89 -14.650   0.613   8.797
  559   2HD   ARG  89           HD1      ARG  89 -15.228   1.779   9.962
  560    HE   ARG  89           HE       ARG  89 -17.403   1.247   9.571
  561   1HH1  ARG  89           HH11     ARG  89 -15.490   0.091   6.745
  562   2HH1  ARG  89           HH12     ARG  89 -16.861  -0.791   6.090
  563   1HH2  ARG  89           HH21     ARG  89 -19.097   0.123   8.645
  564   2HH2  ARG  89           HH22     ARG  89 -18.877  -0.761   7.135
  565    H    ASN  90           H        ASN  90 -11.568   5.647   8.464
  566    HA   ASN  90           HA       ASN  90 -12.379   7.772  10.303
  567   1HB   ASN  90           HB2      ASN  90 -10.350   6.329  10.731
  568   2HB   ASN  90           HB1      ASN  90  -9.590   6.967   9.258
  569   1HD2  ASN  90           HD22     ASN  90  -9.841   9.343  12.672
  570   2HD2  ASN  90           HD21     ASN  90 -10.850   7.948  12.556
  571    H    PHE  91           H        PHE  91 -11.328   7.499   6.856
  572    HA   PHE  91           HA       PHE  91 -11.280  10.512   6.719
  573   1HB   PHE  91           HB2      PHE  91  -9.127   8.712   6.410
  574   2HB   PHE  91           HB1      PHE  91  -9.668   8.913   4.738
  575    HD1  PHE  91           HD2      PHE  91  -9.023  10.836   7.927
  576    HD2  PHE  91           HD1      PHE  91  -8.651  10.862   3.633
  577    HE1  PHE  91           HE2      PHE  91  -7.665  12.903   8.057
  578    HE2  PHE  91           HE1      PHE  91  -7.240  12.894   3.773
  579    HZ   PHE  91           HZ       PHE  91  -6.737  13.914   5.983
  580    H    GLY  92           H        GLY  92 -13.715   8.975   6.516
  581   1HA   GLY  92           HA1      GLY  92 -14.647   9.909   3.977
  582   2HA   GLY  92           HA2      GLY  92 -14.244   8.168   3.845
   
  No H/Q in entry =         582
  Start of MODEL    7
    1    H    MET  15           H        MET  15  -2.538   8.028  12.058
    2    HA   MET  15           HA       MET  15  -1.370   8.531  10.019
    3   1HB   MET  15           HB2      MET  15   1.022   7.746  11.794
    4   2HB   MET  15           HB1      MET  15   1.184   7.852  10.028
    5   1HG   MET  15           HG2      MET  15   0.327  10.260  10.099
    6   2HG   MET  15           HG1      MET  15   0.351  10.150  11.883
    7   1HE   MET  15           HE1      MET  15   2.344  10.506   8.538
    8   2HE   MET  15           HE3      MET  15   4.050  10.272   9.027
    9   3HE   MET  15           HE2      MET  15   2.965   8.863   8.900
   10    H    ALA  16           H        ALA  16  -2.282   5.668  11.547
   11    HA   ALA  16           HA       ALA  16  -0.856   3.826  10.122
   12   1HB   ALA  16           HB3      ALA  16  -2.571   3.250  11.876
   13   2HB   ALA  16           HB2      ALA  16  -3.852   3.406  10.643
   14   3HB   ALA  16           HB1      ALA  16  -2.547   2.223  10.443
   15    HA   PRO  17           HA       PRO  17  -3.309   4.504   6.125
   16   1HB   PRO  17           HB2      PRO  17  -5.122   6.509   5.817
   17   2HB   PRO  17           HB1      PRO  17  -5.492   5.018   6.728
   18   1HG   PRO  17           HG2      PRO  17  -4.611   7.750   7.845
   19   2HG   PRO  17           HG1      PRO  17  -5.980   6.838   8.495
   20   1HD   PRO  17           HD2      PRO  17  -3.603   6.685   9.703
   21   2HD   PRO  17           HD1      PRO  17  -4.695   5.254   9.615
   22    H    ALA  18           H        ALA  18  -2.245   7.613   7.802
   23    HA   ALA  18           HA       ALA  18  -1.824   9.166   5.506
   24   1HB   ALA  18           HB2      ALA  18   0.135   8.764   7.870
   25   2HB   ALA  18           HB1      ALA  18   0.207  10.104   6.689
   26   3HB   ALA  18           HB3      ALA  18  -1.181   9.980   7.812
   27    H    LEU  19           H        LEU  19  -0.093   6.264   6.815
   28    HA   LEU  19           HA       LEU  19   1.989   6.470   4.936
   29   1HB   LEU  19           HB2      LEU  19   1.672   4.839   7.105
   30   2HB   LEU  19           HB1      LEU  19   1.123   3.712   5.838
   31    HG   LEU  19           HG       LEU  19   3.427   3.224   6.102
   32   1HD1  LEU  19           HD12     LEU  19   2.827   3.678   3.690
   33   2HD1  LEU  19           HD11     LEU  19   3.550   5.309   3.829
   34   3HD1  LEU  19           HD13     LEU  19   4.563   3.916   4.060
   35   1HD2  LEU  19           HD22     LEU  19   4.038   6.246   6.264
   36   2HD2  LEU  19           HD21     LEU  19   4.082   5.067   7.606
   37   3HD2  LEU  19           HD23     LEU  19   5.249   4.938   6.267
   38    H    VAL  20           H        VAL  20  -1.108   4.384   4.924
   39    HA   VAL  20           HA       VAL  20  -0.570   3.277   2.462
   40    HB   VAL  20           HB       VAL  20  -2.697   2.822   3.995
   41   1HG1  VAL  20           HG12     VAL  20  -3.866   5.059   3.528
   42   2HG1  VAL  20           HG11     VAL  20  -3.993   4.591   1.811
   43   3HG1  VAL  20           HG13     VAL  20  -4.840   3.652   3.064
   44   1HG2  VAL  20           HG22     VAL  20  -2.691   2.510   0.932
   45   2HG2  VAL  20           HG21     VAL  20  -2.033   1.351   2.123
   46   3HG2  VAL  20           HG23     VAL  20  -3.788   1.637   2.029
   47    H    ALA  21           H        ALA  21  -1.782   6.575   3.200
   48    HA   ALA  21           HA       ALA  21  -2.478   7.157   0.512
   49   1HB   ALA  21           HB3      ALA  21  -3.310   8.537   2.415
   50   2HB   ALA  21           HB2      ALA  21  -1.646   9.112   2.742
   51   3HB   ALA  21           HB1      ALA  21  -2.455   9.551   1.210
   52    H    ALA  22           H        ALA  22   0.629   7.440   2.428
   53    HA   ALA  22           HA       ALA  22   2.097   9.089   0.859
   54   1HB   ALA  22           HB3      ALA  22   3.048   7.798   2.856
   55   2HB   ALA  22           HB2      ALA  22   3.209   6.376   1.770
   56   3HB   ALA  22           HB1      ALA  22   4.144   7.858   1.446
   57    H    PHE  23           H        PHE  23   1.155   5.712  -0.073
   58    HA   PHE  23           HA       PHE  23   2.353   6.268  -2.780
   59   1HB   PHE  23           HB2      PHE  23   3.317   4.436  -1.107
   60   2HB   PHE  23           HB1      PHE  23   2.014   3.447  -1.917
   61    HD1  PHE  23           HD2      PHE  23   2.315   4.667  -4.725
   62    HD2  PHE  23           HD1      PHE  23   5.155   3.176  -1.857
   63    HE1  PHE  23           HE2      PHE  23   3.769   3.871  -6.525
   64    HE2  PHE  23           HE1      PHE  23   6.747   2.698  -3.700
   65    HZ   PHE  23           HZ       PHE  23   6.024   2.977  -6.055
   66    H    GLY  24           H        GLY  24  -0.306   4.311  -1.049
   67   1HA   GLY  24           HA1      GLY  24  -1.750   4.049  -3.556
   68   2HA   GLY  24           HA2      GLY  24  -2.319   3.609  -1.933
   69    H    GLY  25           H        GLY  25  -1.256   6.947  -1.790
   70   1HA   GLY  25           HA1      GLY  25  -4.107   7.798  -2.122
   71   2HA   GLY  25           HA2      GLY  25  -2.849   8.657  -1.225
   72    H    LYS  26           H        LYS  26  -1.161   7.835  -4.062
   73    HA   LYS  26           HA       LYS  26  -1.774  10.580  -5.050
   74   1HB   LYS  26           HB2      LYS  26   0.371   8.748  -6.256
   75   2HB   LYS  26           HB1      LYS  26   0.081  10.476  -6.472
   76   1HG   LYS  26           HG2      LYS  26   1.767  10.687  -4.905
   77   2HG   LYS  26           HG1      LYS  26   0.422  10.502  -3.780
   78   1HD   LYS  26           HD2      LYS  26   1.545   8.773  -2.871
   79   2HD   LYS  26           HD1      LYS  26   1.179   7.801  -4.287
   80   1HE   LYS  26           HE2      LYS  26   3.700   9.541  -4.316
   81   2HE   LYS  26           HE1      LYS  26   3.712   7.997  -3.482
   82   1HZ   LYS  26           HZ2      LYS  26   2.964   6.842  -5.565
   83   2HZ   LYS  26           HZ1      LYS  26   3.152   8.350  -6.412
   84   3HZ   LYS  26           HZ3      LYS  26   4.512   7.571  -5.604
   85    H    GLU  27           H        GLU  27  -4.060   9.904  -5.700
   86    HA   GLU  27           HA       GLU  27  -4.569   7.691  -7.268
   87   1HB   GLU  27           HB2      GLU  27  -6.660   8.554  -7.791
   88   2HB   GLU  27           HB1      GLU  27  -6.242   9.673  -6.480
   89   1HG   GLU  27           HG2      GLU  27  -5.378  11.295  -8.314
   90   2HG   GLU  27           HG1      GLU  27  -6.033  10.156  -9.525
   91    H    ASN  28           H        ASN  28  -2.913  10.711  -8.260
   92    HA   ASN  28           HA       ASN  28  -2.930  10.577 -10.985
   93   1HB   ASN  28           HB2      ASN  28  -1.636  12.257  -9.669
   94   2HB   ASN  28           HB1      ASN  28  -0.487  10.997  -9.153
   95   1HD2  ASN  28           HD22     ASN  28   1.462  11.492 -12.135
   96   2HD2  ASN  28           HD21     ASN  28   1.438  10.905 -10.515
   97    H    ILE  29           H        ILE  29  -1.406   8.119  -8.898
   98    HA   ILE  29           HA       ILE  29   0.205   6.589  -9.890
   99    HB   ILE  29           HB       ILE  29  -2.529   6.072  -8.964
  100   1HG1  ILE  29           HG12     ILE  29  -1.503   4.025  -7.963
  101   2HG1  ILE  29           HG11     ILE  29   0.016   4.407  -8.850
  102   1HG2  ILE  29           HG22     ILE  29  -3.049   5.052 -11.129
  103   2HG2  ILE  29           HG21     ILE  29  -1.656   3.944 -10.998
  104   3HG2  ILE  29           HG23     ILE  29  -3.006   3.828  -9.845
  105   1HD1  ILE  29           HD12     ILE  29   0.148   6.548  -7.455
  106   2HD1  ILE  29           HD11     ILE  29  -1.315   5.991  -6.567
  107   3HD1  ILE  29           HD13     ILE  29   0.192   5.051  -6.490
  108    H    THR  30           H        THR  30   0.742   4.890 -11.381
  109    HA   THR  30           HA       THR  30  -0.089   5.551 -14.177
  110    HB   THR  30           HB       THR  30   2.573   5.441 -12.815
  111    HG1  THR  30           HG1      THR  30   1.707   7.329 -13.912
  112   1HG2  THR  30           HG22     THR  30   2.240   4.176 -15.586
  113   2HG2  THR  30           HG21     THR  30   3.783   4.699 -14.848
  114   3HG2  THR  30           HG23     THR  30   2.865   3.364 -14.105
  115    H    ASN  31           H        ASN  31   1.238   2.685 -12.151
  116    HA   ASN  31           HA       ASN  31  -0.796   1.086 -13.581
  117   1HB   ASN  31           HB2      ASN  31   2.103   1.021 -14.301
  118   2HB   ASN  31           HB1      ASN  31   1.470  -0.572 -13.864
  119   1HD2  ASN  31           HD22     ASN  31   0.098   1.181 -17.324
  120   2HD2  ASN  31           HD21     ASN  31   0.952   2.172 -16.197
  121    H    LEU  32           H        LEU  32  -1.854   0.099 -11.829
  122    HA   LEU  32           HA       LEU  32  -0.105  -1.144  -9.692
  123   1HB   LEU  32           HB2      LEU  32  -2.906   0.132  -9.711
  124   2HB   LEU  32           HB1      LEU  32  -2.559  -1.164  -8.558
  125    HG   LEU  32           HG       LEU  32  -0.886   0.064  -7.420
  126   1HD1  LEU  32           HD12     LEU  32   0.378   1.112  -9.351
  127   2HD1  LEU  32           HD11     LEU  32  -0.991   2.208  -9.592
  128   3HD1  LEU  32           HD13     LEU  32   0.002   2.252  -8.081
  129   1HD2  LEU  32           HD21     LEU  32  -3.195   0.688  -6.835
  130   2HD2  LEU  32           HD23     LEU  32  -2.054   2.030  -6.589
  131   3HD2  LEU  32           HD22     LEU  32  -3.136   2.026  -8.011
  132    H    ASP  33           H        ASP  33  -1.118  -3.173  -8.762
  133    HA   ASP  33           HA       ASP  33  -2.712  -4.669 -10.801
  134   1HB   ASP  33           HB2      ASP  33  -0.247  -5.831  -9.436
  135   2HB   ASP  33           HB1      ASP  33  -1.268  -6.653 -10.606
  136    H    ALA  34           H        ALA  34  -4.317  -3.883  -9.051
  137    HA   ALA  34           HA       ALA  34  -4.076  -4.891  -6.406
  138   1HB   ALA  34           HB3      ALA  34  -5.711  -3.135  -6.944
  139   2HB   ALA  34           HB2      ALA  34  -6.654  -4.288  -7.939
  140   3HB   ALA  34           HB1      ALA  34  -6.517  -4.534  -6.170
  141    H    CYS  35           H        CYS  35  -4.979  -6.901  -5.422
  142    HA   CYS  35           HA       CYS  35  -6.385  -8.760  -7.113
  143   1HB   CYS  35           HB2      CYS  35  -3.546  -8.826  -7.453
  144   2HB   CYS  35           HB1      CYS  35  -3.873 -10.163  -6.317
  145    HG   CYS  35           HG       CYS  35  -3.993 -10.960  -8.696
  146    H    ILE  36           H        ILE  36  -6.480 -11.055  -5.934
  147    HA   ILE  36           HA       ILE  36  -8.018 -10.702  -3.839
  148    HB   ILE  36           HB       ILE  36  -7.641 -12.914  -2.908
  149   1HG1  ILE  36           HG12     ILE  36  -5.278 -13.368  -2.897
  150   2HG1  ILE  36           HG11     ILE  36  -6.085 -14.586  -3.868
  151   1HG2  ILE  36           HG22     ILE  36  -9.031 -12.610  -4.970
  152   2HG2  ILE  36           HG21     ILE  36  -7.641 -13.079  -5.985
  153   3HG2  ILE  36           HG23     ILE  36  -8.326 -14.239  -4.826
  154   1HD1  ILE  36           HD11     ILE  36  -4.517 -12.248  -5.152
  155   2HD1  ILE  36           HD13     ILE  36  -3.937 -13.889  -4.825
  156   3HD1  ILE  36           HD12     ILE  36  -5.269 -13.625  -5.984
  157    H    THR  37           H        THR  37  -4.491 -11.248  -3.127
  158    HA   THR  37           HA       THR  37  -4.769  -9.419  -0.834
  159    HB   THR  37           HB       THR  37  -4.709 -12.436  -0.638
  160    HG1  THR  37           HG1      THR  37  -6.435 -11.084   0.226
  161   1HG2  THR  37           HG22     THR  37  -2.887 -10.679   1.021
  162   2HG2  THR  37           HG21     THR  37  -3.548 -12.181   1.678
  163   3HG2  THR  37           HG23     THR  37  -2.512 -12.248   0.231
  164    H    ARG  38           H        ARG  38  -3.805  -8.947  -3.318
  165    HA   ARG  38           HA       ARG  38  -0.953  -8.618  -2.707
  166   1HB   ARG  38           HB2      ARG  38  -1.783  -9.584  -5.496
  167   2HB   ARG  38           HB1      ARG  38  -0.165  -9.341  -4.870
  168   1HG   ARG  38           HG2      ARG  38  -0.826 -11.301  -3.138
  169   2HG   ARG  38           HG1      ARG  38  -2.198 -11.552  -4.228
  170   1HD   ARG  38           HD2      ARG  38  -0.039 -11.573  -6.065
  171   2HD   ARG  38           HD1      ARG  38   0.729 -12.158  -4.620
  172    HE   ARG  38           HE       ARG  38  -0.511 -14.102  -4.530
  173   1HH1  ARG  38           HH11     ARG  38  -1.900 -11.979  -7.124
  174   2HH1  ARG  38           HH12     ARG  38  -2.750 -13.333  -7.845
  175   1HH2  ARG  38           HH21     ARG  38  -1.706 -15.719  -5.507
  176   2HH2  ARG  38           HH22     ARG  38  -2.677 -15.389  -6.938
  177    H    LEU  39           H        LEU  39  -0.300  -6.464  -3.448
  178    HA   LEU  39           HA       LEU  39  -2.063  -5.141  -5.416
  179   1HB   LEU  39           HB2      LEU  39  -2.623  -3.263  -3.909
  180   2HB   LEU  39           HB1      LEU  39  -3.322  -4.843  -3.478
  181    HG   LEU  39           HG       LEU  39  -1.058  -4.846  -1.818
  182   1HD1  LEU  39           HD12     LEU  39  -0.567  -2.408  -2.367
  183   2HD1  LEU  39           HD11     LEU  39  -2.186  -1.971  -1.764
  184   3HD1  LEU  39           HD13     LEU  39  -0.970  -2.667  -0.653
  185   1HD2  LEU  39           HD22     LEU  39  -3.874  -3.815  -1.099
  186   2HD2  LEU  39           HD21     LEU  39  -3.347  -5.528  -1.113
  187   3HD2  LEU  39           HD23     LEU  39  -2.629  -4.385   0.051
  188    H    ARG  40           H        ARG  40  -0.432  -4.637  -6.857
  189    HA   ARG  40           HA       ARG  40   2.213  -3.931  -5.841
  190   1HB   ARG  40           HB2      ARG  40   1.190  -4.172  -8.756
  191   2HB   ARG  40           HB1      ARG  40   2.867  -3.991  -8.272
  192   1HG   ARG  40           HG2      ARG  40   2.653  -6.142  -6.924
  193   2HG   ARG  40           HG1      ARG  40   1.024  -6.402  -7.507
  194   1HD   ARG  40           HD2      ARG  40   1.919  -6.607  -9.796
  195   2HD   ARG  40           HD1      ARG  40   3.585  -6.304  -9.240
  196    HE   ARG  40           HE       ARG  40   3.008  -8.308  -7.553
  197   1HH1  ARG  40           HH11     ARG  40   2.501  -8.211 -11.138
  198   2HH1  ARG  40           HH12     ARG  40   2.600  -9.959 -11.239
  199   1HH2  ARG  40           HH21     ARG  40   3.176 -10.499  -7.823
  200   2HH2  ARG  40           HH22     ARG  40   2.999 -11.227  -9.418
  201    H    VAL  41           H        VAL  41   3.419  -1.871  -6.941
  202    HA   VAL  41           HA       VAL  41   1.426   0.211  -7.469
  203    HB   VAL  41           HB       VAL  41   3.440   1.082  -5.426
  204   1HG1  VAL  41           HG12     VAL  41   1.607   2.618  -6.299
  205   2HG1  VAL  41           HG11     VAL  41   0.380   1.477  -5.685
  206   3HG1  VAL  41           HG13     VAL  41   1.423   2.331  -4.546
  207   1HG2  VAL  41           HG21     VAL  41   2.947  -1.082  -4.433
  208   2HG2  VAL  41           HG23     VAL  41   2.241   0.237  -3.476
  209   3HG2  VAL  41           HG22     VAL  41   1.186  -0.756  -4.506
  210    H    SER  42           H        SER  42   2.524  -0.318  -9.685
  211    HA   SER  42           HA       SER  42   5.259   0.638  -9.812
  212   1HB   SER  42           HB2      SER  42   3.493   0.096 -12.255
  213   2HB   SER  42           HB1      SER  42   5.248   0.284 -12.210
  214    HG   SER  42           HG       SER  42   3.809  -1.874 -10.968
  215    H    VAL  43           H        VAL  43   5.898   2.819  -9.807
  216    HA   VAL  43           HA       VAL  43   4.337   4.641 -11.515
  217    HB   VAL  43           HB       VAL  43   4.014   6.317  -9.766
  218   1HG1  VAL  43           HG11     VAL  43   3.109   3.570  -8.652
  219   2HG1  VAL  43           HG13     VAL  43   2.465   5.166  -8.167
  220   3HG1  VAL  43           HG12     VAL  43   2.273   4.572  -9.824
  221   1HG2  VAL  43           HG22     VAL  43   5.646   4.463  -7.955
  222   2HG2  VAL  43           HG21     VAL  43   6.120   6.092  -8.478
  223   3HG2  VAL  43           HG23     VAL  43   4.757   5.904  -7.370
  224    H    ALA  44           H        ALA  44   5.474   6.801 -11.786
  225    HA   ALA  44           HA       ALA  44   8.363   6.321 -11.997
  226   1HB   ALA  44           HB3      ALA  44   7.159   7.635 -13.745
  227   2HB   ALA  44           HB2      ALA  44   6.718   8.874 -12.531
  228   3HB   ALA  44           HB1      ALA  44   8.436   8.610 -12.955
  229    H    ASP  45           H        ASP  45   6.105   8.240  -9.868
  230    HA   ASP  45           HA       ASP  45   7.859   9.988  -8.721
  231   1HB   ASP  45           HB2      ASP  45   5.544  10.125  -8.160
  232   2HB   ASP  45           HB1      ASP  45   5.536   8.496  -7.488
  233    H    VAL  46           H        VAL  46   7.219   7.336  -6.315
  234    HA   VAL  46           HA       VAL  46   8.686   6.840  -4.660
  235    HB   VAL  46           HB       VAL  46   9.882   4.950  -5.204
  236   1HG1  VAL  46           HG12     VAL  46   7.624   4.881  -6.353
  237   2HG1  VAL  46           HG11     VAL  46   8.429   5.397  -7.876
  238   3HG1  VAL  46           HG13     VAL  46   8.832   3.826  -7.134
  239   1HG2  VAL  46           HG22     VAL  46  10.948   6.351  -7.724
  240   2HG2  VAL  46           HG21     VAL  46  11.874   5.779  -6.302
  241   3HG2  VAL  46           HG23     VAL  46  11.158   4.607  -7.406
  242    H    SER  47           H        SER  47   9.208   9.675  -5.568
  243    HA   SER  47           HA       SER  47  12.080   9.887  -5.738
  244   1HB   SER  47           HB2      SER  47  10.576  11.625  -6.659
  245   2HB   SER  47           HB1      SER  47  10.005  12.034  -5.009
  246    HG   SER  47           HG       SER  47  11.831  13.404  -5.694
  247    H    LYS  48           H        LYS  48   9.633  10.390  -3.128
  248    HA   LYS  48           HA       LYS  48  11.759   9.726  -1.141
  249   1HB   LYS  48           HB2      LYS  48  11.405  11.644   0.174
  250   2HB   LYS  48           HB1      LYS  48  11.341  12.300  -1.478
  251   1HG   LYS  48           HG2      LYS  48   9.019  11.826   0.492
  252   2HG   LYS  48           HG1      LYS  48   9.602  13.359  -0.178
  253   1HD   LYS  48           HD2      LYS  48   8.836  12.584  -2.479
  254   2HD   LYS  48           HD1      LYS  48   8.058  11.169  -1.687
  255   1HE   LYS  48           HE2      LYS  48   7.355  14.094  -1.090
  256   2HE   LYS  48           HE1      LYS  48   6.448  12.999  -2.163
  257   1HZ   LYS  48           HZ2      LYS  48   6.055  11.476  -0.228
  258   2HZ   LYS  48           HZ1      LYS  48   6.808  12.645   0.829
  259   3HZ   LYS  48           HZ3      LYS  48   5.363  13.054  -0.020
  260    H    VAL  49           H        VAL  49   9.394   8.194  -2.358
  261    HA   VAL  49           HA       VAL  49   7.285   8.402  -0.461
  262    HB   VAL  49           HB       VAL  49   7.168   7.451  -2.826
  263   1HG1  VAL  49           HG12     VAL  49   9.165   5.811  -2.527
  264   2HG1  VAL  49           HG11     VAL  49   8.114   4.869  -1.453
  265   3HG1  VAL  49           HG13     VAL  49   7.687   5.037  -3.176
  266   1HG2  VAL  49           HG21     VAL  49   5.289   7.217  -1.117
  267   2HG2  VAL  49           HG23     VAL  49   5.298   6.007  -2.418
  268   3HG2  VAL  49           HG22     VAL  49   5.854   5.558  -0.784
  269    H    ASP  50           H        ASP  50   6.619   6.684   1.205
  270    HA   ASP  50           HA       ASP  50   9.110   5.667   2.546
  271   1HB   ASP  50           HB2      ASP  50   7.677   7.376   3.692
  272   2HB   ASP  50           HB1      ASP  50   6.305   6.238   3.661
  273    H    GLN  51           H        GLN  51   8.829   3.836   0.640
  274    HA   GLN  51           HA       GLN  51   6.690   1.980   1.042
  275   1HB   GLN  51           HB2      GLN  51   9.538   1.195   0.152
  276   2HB   GLN  51           HB1      GLN  51   8.059   0.219   0.051
  277   1HG   GLN  51           HG2      GLN  51   7.681   1.046  -2.042
  278   2HG   GLN  51           HG1      GLN  51   7.339   2.616  -1.287
  279   1HE2  GLN  51           HE22     GLN  51  10.307   2.713  -3.805
  280   2HE2  GLN  51           HE21     GLN  51   8.952   1.667  -3.914
  281    H    ALA  52           H        ALA  52  10.023   2.317   2.529
  282    HA   ALA  52           HA       ALA  52  10.187  -0.012   3.919
  283   1HB   ALA  52           HB3      ALA  52  11.886   1.815   4.134
  284   2HB   ALA  52           HB2      ALA  52  10.733   2.792   5.093
  285   3HB   ALA  52           HB1      ALA  52  11.373   1.253   5.752
  286    H    GLY  53           H        GLY  53   7.852   2.672   4.685
  287   1HA   GLY  53           HA1      GLY  53   6.827   1.102   7.001
  288   2HA   GLY  53           HA2      GLY  53   6.235   2.674   6.432
  289    H    LEU  54           H        LEU  54   5.744   2.065   3.594
  290    HA   LEU  54           HA       LEU  54   3.108   1.138   4.169
  291   1HB   LEU  54           HB2      LEU  54   4.058   2.499   2.037
  292   2HB   LEU  54           HB1      LEU  54   4.101   0.923   1.263
  293    HG   LEU  54           HG       LEU  54   1.485   1.794   2.679
  294   1HD1  LEU  54           HD11     LEU  54   2.531   2.677   0.049
  295   2HD1  LEU  54           HD13     LEU  54   0.829   2.970   0.520
  296   3HD1  LEU  54           HD12     LEU  54   2.158   3.822   1.355
  297   1HD2  LEU  54           HD21     LEU  54   1.643  -0.545   1.508
  298   2HD2  LEU  54           HD23     LEU  54   0.391   0.538   0.850
  299   3HD2  LEU  54           HD22     LEU  54   1.932   0.318  -0.018
  300    H    LYS  55           H        LYS  55   6.079  -0.452   3.025
  301    HA   LYS  55           HA       LYS  55   4.851  -2.729   2.181
  302   1HB   LYS  55           HB2      LYS  55   7.144  -3.869   2.436
  303   2HB   LYS  55           HB1      LYS  55   7.202  -2.198   1.784
  304   1HG   LYS  55           HG2      LYS  55   8.989  -2.083   3.208
  305   2HG   LYS  55           HG1      LYS  55   7.714  -1.505   4.263
  306   1HD   LYS  55           HD2      LYS  55   8.490  -3.048   5.766
  307   2HD   LYS  55           HD1      LYS  55   7.648  -4.276   4.789
  308   1HE   LYS  55           HE2      LYS  55  10.597  -3.363   4.508
  309   2HE   LYS  55           HE1      LYS  55  10.054  -4.850   5.316
  310   1HZ   LYS  55           HZ2      LYS  55   9.166  -5.692   3.178
  311   2HZ   LYS  55           HZ1      LYS  55   9.711  -4.262   2.348
  312   3HZ   LYS  55           HZ3      LYS  55  10.867  -5.326   3.072
  313    H    LYS  56           H        LYS  56   5.885  -2.095   5.490
  314    HA   LYS  56           HA       LYS  56   4.814  -4.755   6.314
  315   1HB   LYS  56           HB2      LYS  56   5.710  -4.262   8.555
  316   2HB   LYS  56           HB1      LYS  56   6.954  -4.286   7.282
  317   1HG   LYS  56           HG2      LYS  56   6.996  -1.728   7.306
  318   2HG   LYS  56           HG1      LYS  56   5.805  -1.744   8.617
  319   1HD   LYS  56           HD2      LYS  56   8.621  -3.013   8.668
  320   2HD   LYS  56           HD1      LYS  56   8.226  -1.384   9.268
  321   1HE   LYS  56           HE2      LYS  56   7.182  -4.032  10.446
  322   2HE   LYS  56           HE1      LYS  56   8.391  -2.931  11.138
  323   1HZ   LYS  56           HZ2      LYS  56   6.572  -1.134  11.157
  324   2HZ   LYS  56           HZ1      LYS  56   5.419  -2.409  10.827
  325   3HZ   LYS  56           HZ3      LYS  56   6.360  -2.451  12.267
  326    H    LEU  57           H        LEU  57   4.290  -1.218   6.896
  327    HA   LEU  57           HA       LEU  57   2.099  -1.810   8.725
  328   1HB   LEU  57           HB2      LEU  57   3.705  -0.080   9.198
  329   2HB   LEU  57           HB1      LEU  57   3.337   0.796   7.696
  330    HG   LEU  57           HG       LEU  57   2.387   1.739   9.858
  331   1HD1  LEU  57           HD11     LEU  57   0.554   1.292   7.406
  332   2HD1  LEU  57           HD13     LEU  57   0.228   2.399   8.749
  333   3HD1  LEU  57           HD12     LEU  57   1.705   2.591   7.785
  334   1HD2  LEU  57           HD21     LEU  57   1.545  -0.402  10.873
  335   2HD2  LEU  57           HD23     LEU  57   0.313   0.894  10.794
  336   3HD2  LEU  57           HD22     LEU  57   0.249  -0.456   9.644
  337    H    GLY  58           H        GLY  58   2.468  -1.084   5.198
  338   1HA   GLY  58           HA1      GLY  58  -0.475  -0.591   5.014
  339   2HA   GLY  58           HA2      GLY  58   0.693  -0.388   3.717
  340    H    ALA  59           H        ALA  59   1.985  -2.583   3.134
  341    HA   ALA  59           HA       ALA  59  -0.093  -4.666   2.818
  342   1HB   ALA  59           HB3      ALA  59   1.063  -3.598   0.824
  343   2HB   ALA  59           HB2      ALA  59   2.592  -4.340   1.382
  344   3HB   ALA  59           HB1      ALA  59   1.211  -5.373   0.878
  345    H    ALA  60           H        ALA  60   2.226  -6.769   2.461
  346    HA   ALA  60           HA       ALA  60   3.973  -6.481   4.749
  347   1HB   ALA  60           HB3      ALA  60   1.970  -7.288   6.032
  348   2HB   ALA  60           HB2      ALA  60   1.972  -8.760   5.006
  349   3HB   ALA  60           HB1      ALA  60   3.347  -8.414   6.072
  350    H    GLY  61           H        GLY  61   4.916  -6.537   2.364
  351   1HA   GLY  61           HA1      GLY  61   6.835  -8.370   2.241
  352   2HA   GLY  61           HA2      GLY  61   5.506  -9.364   1.593
  353    H    VAL  62           H        VAL  62   7.180  -6.144   1.045
  354    HA   VAL  62           HA       VAL  62   6.191  -6.366  -1.781
  355    HB   VAL  62           HB       VAL  62   6.085  -3.995  -1.910
  356   1HG1  VAL  62           HG12     VAL  62   4.335  -4.795  -0.262
  357   2HG1  VAL  62           HG11     VAL  62   5.468  -4.490   1.013
  358   3HG1  VAL  62           HG13     VAL  62   4.867  -3.126  -0.010
  359   1HG2  VAL  62           HG22     VAL  62   8.144  -3.734   0.260
  360   2HG2  VAL  62           HG21     VAL  62   8.307  -3.356  -1.464
  361   3HG2  VAL  62           HG23     VAL  62   7.221  -2.372  -0.491
  362    H    VAL  63           H        VAL  63   7.660  -5.110  -3.346
  363    HA   VAL  63           HA       VAL  63  10.482  -5.344  -2.570
  364    HB   VAL  63           HB       VAL  63  10.721  -7.433  -3.475
  365   1HG1  VAL  63           HG11     VAL  63   7.992  -7.090  -4.761
  366   2HG1  VAL  63           HG13     VAL  63   8.961  -8.570  -4.928
  367   3HG1  VAL  63           HG12     VAL  63   8.391  -8.047  -3.324
  368   1HG2  VAL  63           HG21     VAL  63  11.732  -6.076  -5.280
  369   2HG2  VAL  63           HG23     VAL  63  11.002  -7.566  -5.945
  370   3HG2  VAL  63           HG22     VAL  63  10.180  -6.001  -6.157
  371    H    VAL  64           H        VAL  64  11.743  -3.763  -3.680
  372    HA   VAL  64           HA       VAL  64  10.061  -1.910  -5.343
  373    HB   VAL  64           HB       VAL  64  12.563  -1.424  -3.640
  374   1HG1  VAL  64           HG12     VAL  64  12.478   0.085  -5.623
  375   2HG1  VAL  64           HG11     VAL  64  10.810   0.567  -5.209
  376   3HG1  VAL  64           HG13     VAL  64  12.164   1.002  -4.125
  377   1HG2  VAL  64           HG22     VAL  64   9.615  -0.651  -3.139
  378   2HG2  VAL  64           HG21     VAL  64  10.572  -1.839  -2.213
  379   3HG2  VAL  64           HG23     VAL  64  10.998  -0.108  -2.149
  380    H    ALA  65           H        ALA  65  10.826  -1.513  -7.519
  381    HA   ALA  65           HA       ALA  65  13.577  -2.496  -8.171
  382   1HB   ALA  65           HB2      ALA  65  10.961  -3.475  -9.494
  383   2HB   ALA  65           HB1      ALA  65  12.617  -3.830 -10.068
  384   3HB   ALA  65           HB3      ALA  65  12.059  -4.455  -8.487
  385    H    GLY  66           H        GLY  66  14.158  -0.205  -8.632
  386   1HA   GLY  66           HA1      GLY  66  12.803   1.797  -9.666
  387   2HA   GLY  66           HA2      GLY  66  14.407   1.433 -10.334
  388    H    SER  67           H        SER  67  11.161   1.892 -11.306
  389    HA   SER  67           HA       SER  67  10.640   1.643 -13.675
  390   1HB   SER  67           HB2      SER  67  10.777  -0.545 -14.820
  391   2HB   SER  67           HB1      SER  67  12.392   0.071 -14.437
  392    HG   SER  67           HG       SER  67  10.993  -1.962 -12.924
  393    H    GLY  68           H        GLY  68  10.114  -0.221 -10.672
  394   1HA   GLY  68           HA1      GLY  68   7.351   0.105 -10.896
  395   2HA   GLY  68           HA2      GLY  68   7.715  -1.548 -11.479
  396    H    VAL  69           H        VAL  69   6.185  -1.292  -9.138
  397    HA   VAL  69           HA       VAL  69   8.107  -2.202  -7.027
  398    HB   VAL  69           HB       VAL  69   5.826  -0.193  -6.632
  399   1HG1  VAL  69           HG11     VAL  69   7.751  -1.459  -4.594
  400   2HG1  VAL  69           HG13     VAL  69   6.684  -0.087  -4.226
  401   3HG1  VAL  69           HG12     VAL  69   5.985  -1.644  -4.681
  402   1HG2  VAL  69           HG22     VAL  69   8.888   0.163  -6.589
  403   2HG2  VAL  69           HG21     VAL  69   7.709   0.954  -7.684
  404   3HG2  VAL  69           HG23     VAL  69   7.746   1.378  -5.952
  405    H    GLN  70           H        GLN  70   7.214  -4.066  -5.951
  406    HA   GLN  70           HA       GLN  70   4.455  -4.751  -6.852
  407   1HB   GLN  70           HB2      GLN  70   5.873  -6.983  -5.628
  408   2HB   GLN  70           HB1      GLN  70   5.003  -6.938  -7.160
  409   1HG   GLN  70           HG2      GLN  70   7.922  -6.041  -6.821
  410   2HG   GLN  70           HG1      GLN  70   7.379  -7.569  -7.500
  411   1HE2  GLN  70           HE22     GLN  70   6.371  -6.152 -10.651
  412   2HE2  GLN  70           HE21     GLN  70   6.089  -7.494  -9.609
  413    H    ALA  71           H        ALA  71   3.222  -5.906  -4.854
  414    HA   ALA  71           HA       ALA  71   4.340  -5.335  -2.402
  415   1HB   ALA  71           HB2      ALA  71   2.543  -3.199  -3.423
  416   2HB   ALA  71           HB1      ALA  71   2.308  -3.625  -1.696
  417   3HB   ALA  71           HB3      ALA  71   3.873  -3.020  -2.307
  418    H    ILE  72           H        ILE  72   3.691  -6.972  -1.025
  419    HA   ILE  72           HA       ILE  72   1.119  -8.251  -1.750
  420    HB   ILE  72           HB       ILE  72   3.948  -9.174  -2.181
  421   1HG1  ILE  72           HG12     ILE  72   2.699 -11.084  -3.465
  422   2HG1  ILE  72           HG11     ILE  72   1.254 -10.117  -3.148
  423   1HG2  ILE  72           HG22     ILE  72   3.597 -10.370   0.007
  424   2HG2  ILE  72           HG21     ILE  72   2.180 -11.197  -0.713
  425   3HG2  ILE  72           HG23     ILE  72   3.810 -11.450  -1.375
  426   1HD1  ILE  72           HD12     ILE  72   2.412  -8.186  -4.415
  427   2HD1  ILE  72           HD11     ILE  72   3.825  -9.247  -4.670
  428   3HD1  ILE  72           HD13     ILE  72   2.259  -9.652  -5.416
  429    H    PHE  73           H        PHE  73   0.344  -9.764  -0.024
  430    HA   PHE  73           HA       PHE  73   1.515  -9.013   2.651
  431   1HB   PHE  73           HB2      PHE  73  -1.025  -8.348   1.793
  432   2HB   PHE  73           HB1      PHE  73  -1.325  -9.970   2.474
  433    HD1  PHE  73           HD1      PHE  73  -0.397 -10.523   4.845
  434    HD2  PHE  73           HD2      PHE  73  -1.129  -6.577   3.327
  435    HE1  PHE  73           HE1      PHE  73  -0.058  -9.564   7.113
  436    HE2  PHE  73           HE2      PHE  73  -0.875  -5.639   5.585
  437    HZ   PHE  73           HZ       PHE  73  -0.524  -7.209   7.540
  438    H    GLY  74           H        GLY  74  -0.385 -11.681   0.992
  439   1HA   GLY  74           HA1      GLY  74   0.552 -13.963   1.239
  440   2HA   GLY  74           HA2      GLY  74   0.874 -13.594   2.947
  441    H    THR  75           H        THR  75  -1.166 -12.679   4.163
  442    HA   THR  75           HA       THR  75  -3.751 -13.802   3.335
  443    HB   THR  75           HB       THR  75  -2.074 -15.290   5.400
  444    HG1  THR  75           HG1      THR  75  -2.723 -17.019   3.879
  445   1HG2  THR  75           HG22     THR  75  -5.126 -15.391   4.900
  446   2HG2  THR  75           HG21     THR  75  -4.219 -16.632   5.813
  447   3HG2  THR  75           HG23     THR  75  -4.312 -14.969   6.439
  448    H    LYS  76           H        LYS  76  -1.842 -12.763   6.332
  449    HA   LYS  76           HA       LYS  76  -4.199 -11.705   7.584
  450   1HB   LYS  76           HB2      LYS  76  -1.222 -11.217   8.027
  451   2HB   LYS  76           HB1      LYS  76  -2.433 -10.244   8.880
  452   1HG   LYS  76           HG2      LYS  76  -1.707 -11.987  10.326
  453   2HG   LYS  76           HG1      LYS  76  -3.397 -12.327   9.876
  454   1HD   LYS  76           HD2      LYS  76  -2.658 -14.121   8.339
  455   2HD   LYS  76           HD1      LYS  76  -0.941 -13.660   8.534
  456   1HE   LYS  76           HE2      LYS  76  -0.910 -14.360  10.871
  457   2HE   LYS  76           HE1      LYS  76  -2.681 -14.584  10.898
  458   1HZ   LYS  76           HZ1      LYS  76  -0.766 -16.204   9.187
  459   2HZ   LYS  76           HZ3      LYS  76  -1.466 -16.724  10.697
  460   3HZ   LYS  76           HZ2      LYS  76  -2.493 -16.436   9.322
  461    H    SER  77           H        SER  77  -3.244 -10.515   4.494
  462    HA   SER  77           HA       SER  77  -3.226  -7.790   4.853
  463   1HB   SER  77           HB2      SER  77  -3.415  -9.009   2.544
  464   2HB   SER  77           HB1      SER  77  -5.150  -9.116   2.866
  465    HG   SER  77           HG       SER  77  -3.662  -6.642   2.681
  466    H    ASP  78           H        ASP  78  -6.199  -9.965   4.938
  467    HA   ASP  78           HA       ASP  78  -8.067  -7.929   5.118
  468   1HB   ASP  78           HB2      ASP  78  -8.099 -10.534   6.750
  469   2HB   ASP  78           HB1      ASP  78  -9.522  -9.513   6.390
  470    H    ASN  79           H        ASN  79  -5.979  -9.198   7.822
  471    HA   ASN  79           HA       ASN  79  -7.276  -7.694   9.870
  472   1HB   ASN  79           HB2      ASN  79  -5.631  -9.476  10.396
  473   2HB   ASN  79           HB1      ASN  79  -4.319  -8.533   9.656
  474   1HD2  ASN  79           HD22     ASN  79  -3.879  -6.419  12.519
  475   2HD2  ASN  79           HD21     ASN  79  -3.368  -6.737  10.903
  476    H    LEU  80           H        LEU  80  -4.435  -6.842   7.723
  477    HA   LEU  80           HA       LEU  80  -4.204  -4.323   9.152
  478   1HB   LEU  80           HB2      LEU  80  -2.415  -5.787   7.598
  479   2HB   LEU  80           HB1      LEU  80  -2.818  -4.471   6.470
  480    HG   LEU  80           HG       LEU  80  -1.819  -4.166   9.375
  481   1HD1  LEU  80           HD12     LEU  80   0.036  -5.012   7.901
  482   2HD1  LEU  80           HD11     LEU  80  -0.214  -3.636   6.794
  483   3HD1  LEU  80           HD13     LEU  80   0.307  -3.374   8.480
  484   1HD2  LEU  80           HD21     LEU  80  -3.273  -2.268   8.573
  485   2HD2  LEU  80           HD23     LEU  80  -1.590  -1.787   8.855
  486   3HD2  LEU  80           HD22     LEU  80  -2.200  -2.015   7.175
  487    H    LYS  81           H        LYS  81  -5.200  -5.306   5.840
  488    HA   LYS  81           HA       LYS  81  -6.117  -2.916   4.842
  489   1HB   LYS  81           HB2      LYS  81  -6.150  -5.305   3.759
  490   2HB   LYS  81           HB1      LYS  81  -7.737  -5.499   4.559
  491   1HG   LYS  81           HG2      LYS  81  -8.569  -3.515   3.220
  492   2HG   LYS  81           HG1      LYS  81  -6.929  -3.287   2.551
  493   1HD   LYS  81           HD2      LYS  81  -8.376  -4.433   0.910
  494   2HD   LYS  81           HD1      LYS  81  -7.023  -5.489   1.384
  495   1HE   LYS  81           HE2      LYS  81  -8.468  -6.876   2.780
  496   2HE   LYS  81           HE1      LYS  81  -9.800  -5.686   2.689
  497   1HZ   LYS  81           HZ1      LYS  81  -8.699  -7.295   0.353
  498   2HZ   LYS  81           HZ3      LYS  81 -10.168  -7.639   1.219
  499   3HZ   LYS  81           HZ2      LYS  81 -10.039  -6.180   0.285
  500    H    THR  82           H        THR  82  -7.788  -5.003   7.337
  501    HA   THR  82           HA       THR  82 -10.206  -3.476   7.395
  502    HB   THR  82           HB       THR  82  -8.811  -5.202   9.495
  503    HG1  THR  82           HG1      THR  82 -10.176  -6.155   7.786
  504   1HG2  THR  82           HG22     THR  82 -11.314  -3.493   9.963
  505   2HG2  THR  82           HG21     THR  82 -10.798  -4.870  10.982
  506   3HG2  THR  82           HG23     THR  82  -9.768  -3.418  10.874
  507    H    GLU  83           H        GLU  83  -7.009  -2.933   9.135
  508    HA   GLU  83           HA       GLU  83  -7.932  -0.676  10.534
  509   1HB   GLU  83           HB2      GLU  83  -5.754  -0.269  11.155
  510   2HB   GLU  83           HB1      GLU  83  -5.366  -1.784  10.319
  511   1HG   GLU  83           HG2      GLU  83  -4.910  -0.366   8.207
  512   2HG   GLU  83           HG1      GLU  83  -5.158   1.096   9.207
  513    H    MET  84           H        MET  84  -7.012  -1.048   7.055
  514    HA   MET  84           HA       MET  84  -6.898   1.783   6.584
  515   1HB   MET  84           HB2      MET  84  -7.499  -0.430   4.537
  516   2HB   MET  84           HB1      MET  84  -7.116   1.266   4.167
  517   1HG   MET  84           HG2      MET  84  -4.834   1.031   5.109
  518   2HG   MET  84           HG1      MET  84  -5.191  -0.619   5.695
  519   1HE   MET  84           HE2      MET  84  -2.707  -0.176   4.127
  520   2HE   MET  84           HE1      MET  84  -3.249  -1.849   4.492
  521   3HE   MET  84           HE3      MET  84  -2.717  -1.418   2.831
  522    H    ASP  85           H        ASP  85  -9.558  -0.754   6.155
  523    HA   ASP  85           HA       ASP  85 -11.565   0.912   5.262
  524   1HB   ASP  85           HB2      ASP  85 -12.050  -1.446   5.660
  525   2HB   ASP  85           HB1      ASP  85 -11.839  -1.257   7.416
  526    H    GLU  86           H        GLU  86 -10.563   0.438   8.750
  527    HA   GLU  86           HA       GLU  86 -12.334   2.238   9.895
  528   1HB   GLU  86           HB2      GLU  86  -9.594   1.253  10.686
  529   2HB   GLU  86           HB1      GLU  86 -10.018   2.809  11.400
  530   1HG   GLU  86           HG2      GLU  86 -11.955   0.426  11.552
  531   2HG   GLU  86           HG1      GLU  86 -10.643   0.655  12.731
  532    H    TYR  87           H        TYR  87  -9.102   3.158   8.411
  533    HA   TYR  87           HA       TYR  87  -9.185   5.823   9.138
  534   1HB   TYR  87           HB1      TYR  87  -7.338   4.969   7.926
  535   2HB   TYR  87           HB2      TYR  87  -8.280   4.555   6.486
  536    HD1  TYR  87           HD2      TYR  87  -8.248   7.890   8.342
  537    HD2  TYR  87           HD1      TYR  87  -7.736   5.845   4.595
  538    HE1  TYR  87           HE2      TYR  87  -7.424   9.975   7.307
  539    HE2  TYR  87           HE1      TYR  87  -6.999   7.944   3.552
  540    HH   TYR  87           HH       TYR  87  -5.820  10.053   4.223
  541    H    ILE  88           H        ILE  88 -10.758   4.402   6.169
  542    HA   ILE  88           HA       ILE  88 -11.523   7.028   5.269
  543    HB   ILE  88           HB       ILE  88 -12.872   4.397   4.474
  544   1HG1  ILE  88           HG12     ILE  88 -11.032   5.248   2.392
  545   2HG1  ILE  88           HG11     ILE  88 -10.114   5.356   3.898
  546   1HG2  ILE  88           HG22     ILE  88 -14.127   6.482   3.844
  547   2HG2  ILE  88           HG21     ILE  88 -12.670   7.114   3.025
  548   3HG2  ILE  88           HG23     ILE  88 -13.490   5.651   2.403
  549   1HD1  ILE  88           HD12     ILE  88 -10.769   2.935   4.384
  550   2HD1  ILE  88           HD11     ILE  88 -11.611   2.875   2.821
  551   3HD1  ILE  88           HD13     ILE  88  -9.838   3.111   2.882
  552    H    ARG  89           H        ARG  89 -13.143   4.408   7.226
  553    HA   ARG  89           HA       ARG  89 -15.612   5.845   7.440
  554   1HB   ARG  89           HB2      ARG  89 -14.432   3.915   9.524
  555   2HB   ARG  89           HB1      ARG  89 -16.119   4.420   9.333
  556   1HG   ARG  89           HG2      ARG  89 -15.439   3.380   6.738
  557   2HG   ARG  89           HG1      ARG  89 -14.569   2.316   7.866
  558   1HD   ARG  89           HD2      ARG  89 -17.590   2.730   7.571
  559   2HD   ARG  89           HD1      ARG  89 -16.651   1.276   7.430
  560    HE   ARG  89           HE       ARG  89 -16.286   1.019   9.722
  561   1HH1  ARG  89           HH11     ARG  89 -18.465   3.891   9.150
  562   2HH1  ARG  89           HH12     ARG  89 -19.012   3.846  10.811
  563   1HH2  ARG  89           HH21     ARG  89 -17.064   1.117  11.799
  564   2HH2  ARG  89           HH22     ARG  89 -18.243   2.338  12.274
  565    H    ASN  90           H        ASN  90 -12.475   6.077   9.204
  566    HA   ASN  90           HA       ASN  90 -13.554   7.841  11.262
  567   1HB   ASN  90           HB2      ASN  90 -11.542   6.369  11.655
  568   2HB   ASN  90           HB1      ASN  90 -10.654   7.267  10.403
  569   1HD2  ASN  90           HD22     ASN  90 -11.371   9.093  14.069
  570   2HD2  ASN  90           HD21     ASN  90 -12.422   7.816  13.574
  571    H    PHE  91           H        PHE  91 -12.289   8.265   7.923
  572    HA   PHE  91           HA       PHE  91 -12.325  11.239   8.376
  573   1HB   PHE  91           HB2      PHE  91 -10.078   9.591   7.841
  574   2HB   PHE  91           HB1      PHE  91 -10.497  10.173   6.235
  575    HD1  PHE  91           HD1      PHE  91  -9.613  11.081   9.743
  576    HD2  PHE  91           HD2      PHE  91 -10.130  12.618   5.753
  577    HE1  PHE  91           HE1      PHE  91  -8.371  13.126  10.373
  578    HE2  PHE  91           HE2      PHE  91  -8.904  14.675   6.395
  579    HZ   PHE  91           HZ       PHE  91  -8.004  14.924   8.697
  580    H    GLY  92           H        GLY  92 -14.641   9.614   7.662
  581   1HA   GLY  92           HA1      GLY  92 -15.638  10.949   5.443
  582   2HA   GLY  92           HA2      GLY  92 -14.792   9.523   4.759
   
  No H/Q in entry =         582
  Start of MODEL    8
    1    H    MET  15           H        MET  15  -2.822   9.301  11.005
    2    HA   MET  15           HA       MET  15  -1.716   9.823   8.943
    3   1HB   MET  15           HB2      MET  15   0.686   9.083  10.682
    4   2HB   MET  15           HB1      MET  15   0.857   8.953   8.910
    5   1HG   MET  15           HG2      MET  15   0.016  11.376   8.702
    6   2HG   MET  15           HG1      MET  15   0.268  11.529  10.466
    7   1HE   MET  15           HE2      MET  15   2.785  11.156  11.559
    8   2HE   MET  15           HE1      MET  15   3.041   9.568  10.752
    9   3HE   MET  15           HE3      MET  15   4.254  10.867  10.569
   10    H    ALA  16           H        ALA  16  -2.251   6.817  10.654
   11    HA   ALA  16           HA       ALA  16  -1.216   5.068   8.727
   12   1HB   ALA  16           HB3      ALA  16  -2.249   4.216  10.782
   13   2HB   ALA  16           HB2      ALA  16  -3.864   4.750  10.248
   14   3HB   ALA  16           HB1      ALA  16  -2.999   3.485   9.344
   15    HA   PRO  17           HA       PRO  17  -4.796   5.871   5.731
   16   1HB   PRO  17           HB2      PRO  17  -6.178   8.320   5.874
   17   2HB   PRO  17           HB1      PRO  17  -6.757   6.810   6.591
   18   1HG   PRO  17           HG2      PRO  17  -5.393   9.131   7.953
   19   2HG   PRO  17           HG1      PRO  17  -6.610   8.017   8.669
   20   1HD   PRO  17           HD2      PRO  17  -3.940   7.920   9.235
   21   2HD   PRO  17           HD1      PRO  17  -5.040   6.500   9.382
   22    H    ALA  18           H        ALA  18  -2.942   8.803   6.928
   23    HA   ALA  18           HA       ALA  18  -2.524   9.886   4.292
   24   1HB   ALA  18           HB3      ALA  18  -1.847  11.116   6.408
   25   2HB   ALA  18           HB2      ALA  18  -0.546   9.904   6.655
   26   3HB   ALA  18           HB1      ALA  18  -0.507  10.977   5.228
   27    H    LEU  19           H        LEU  19  -1.133   7.075   6.112
   28    HA   LEU  19           HA       LEU  19   1.186   6.890   4.476
   29   1HB   LEU  19           HB2      LEU  19   0.500   5.599   6.787
   30   2HB   LEU  19           HB1      LEU  19   0.064   4.355   5.584
   31    HG   LEU  19           HG       LEU  19   2.260   3.887   6.413
   32   1HD1  LEU  19           HD12     LEU  19   1.933   3.563   3.989
   33   2HD1  LEU  19           HD11     LEU  19   2.654   5.165   3.628
   34   3HD1  LEU  19           HD13     LEU  19   3.639   3.896   4.387
   35   1HD2  LEU  19           HD21     LEU  19   2.875   6.114   7.365
   36   2HD2  LEU  19           HD23     LEU  19   4.178   5.379   6.405
   37   3HD2  LEU  19           HD22     LEU  19   3.220   6.718   5.717
   38    H    VAL  20           H        VAL  20  -1.894   4.733   4.397
   39    HA   VAL  20           HA       VAL  20  -1.305   3.534   2.049
   40    HB   VAL  20           HB       VAL  20  -3.347   2.966   3.277
   41   1HG1  VAL  20           HG12     VAL  20  -4.163   5.270   3.671
   42   2HG1  VAL  20           HG11     VAL  20  -4.670   5.439   1.973
   43   3HG1  VAL  20           HG13     VAL  20  -5.457   4.233   3.037
   44   1HG2  VAL  20           HG21     VAL  20  -3.079   2.177   0.885
   45   2HG2  VAL  20           HG23     VAL  20  -4.793   2.401   1.342
   46   3HG2  VAL  20           HG22     VAL  20  -3.978   3.622   0.330
   47    H    ALA  21           H        ALA  21  -2.527   6.931   2.436
   48    HA   ALA  21           HA       ALA  21  -3.034   7.289  -0.310
   49   1HB   ALA  21           HB3      ALA  21  -3.853   8.914   1.394
   50   2HB   ALA  21           HB2      ALA  21  -2.172   9.456   1.692
   51   3HB   ALA  21           HB1      ALA  21  -2.928   9.735   0.097
   52    H    ALA  22           H        ALA  22  -0.034   7.758   1.705
   53    HA   ALA  22           HA       ALA  22   1.606   9.078   0.002
   54   1HB   ALA  22           HB3      ALA  22   2.291   8.140   2.281
   55   2HB   ALA  22           HB2      ALA  22   2.539   6.550   1.494
   56   3HB   ALA  22           HB1      ALA  22   3.517   7.962   1.004
   57    H    PHE  23           H        PHE  23   0.523   5.662  -0.646
   58    HA   PHE  23           HA       PHE  23   2.191   5.828  -3.156
   59   1HB   PHE  23           HB2      PHE  23   3.073   4.321  -1.386
   60   2HB   PHE  23           HB1      PHE  23   1.677   3.193  -1.695
   61    HD1  PHE  23           HD2      PHE  23   2.650   4.404  -4.922
   62    HD2  PHE  23           HD1      PHE  23   3.952   1.934  -1.613
   63    HE1  PHE  23           HE2      PHE  23   4.246   3.239  -6.372
   64    HE2  PHE  23           HE1      PHE  23   5.691   0.953  -3.025
   65    HZ   PHE  23           HZ       PHE  23   5.978   1.753  -5.392
   66    H    GLY  24           H        GLY  24  -0.595   3.863  -1.641
   67   1HA   GLY  24           HA1      GLY  24  -1.797   3.327  -4.152
   68   2HA   GLY  24           HA2      GLY  24  -2.634   3.330  -2.574
   69    H    GLY  25           H        GLY  25  -1.780   6.341  -2.169
   70   1HA   GLY  25           HA1      GLY  25  -4.056   7.426  -3.790
   71   2HA   GLY  25           HA2      GLY  25  -3.327   8.186  -2.376
   72    H    LYS  26           H        LYS  26  -0.729   7.063  -4.439
   73    HA   LYS  26           HA       LYS  26  -0.131   9.837  -5.188
   74   1HB   LYS  26           HB2      LYS  26   1.036   7.147  -6.109
   75   2HB   LYS  26           HB1      LYS  26   1.596   8.728  -6.697
   76   1HG   LYS  26           HG2      LYS  26   1.519   7.930  -3.748
   77   2HG   LYS  26           HG1      LYS  26   2.962   7.713  -4.792
   78   1HD   LYS  26           HD2      LYS  26   2.590  10.344  -5.234
   79   2HD   LYS  26           HD1      LYS  26   1.747  10.288  -3.663
   80   1HE   LYS  26           HE2      LYS  26   3.826   9.551  -2.532
   81   2HE   LYS  26           HE1      LYS  26   4.636   9.259  -4.080
   82   1HZ   LYS  26           HZ2      LYS  26   4.448  11.739  -4.531
   83   2HZ   LYS  26           HZ1      LYS  26   3.743  11.928  -2.947
   84   3HZ   LYS  26           HZ3      LYS  26   5.371  11.352  -3.115
   85    H    GLU  27           H        GLU  27  -2.240  10.441  -6.260
   86    HA   GLU  27           HA       GLU  27  -3.481   8.737  -8.068
   87   1HB   GLU  27           HB2      GLU  27  -4.956  10.422  -8.612
   88   2HB   GLU  27           HB1      GLU  27  -4.220  11.196  -7.192
   89   1HG   GLU  27           HG2      GLU  27  -2.595  12.372  -8.838
   90   2HG   GLU  27           HG1      GLU  27  -3.572  11.684 -10.170
   91    H    ASN  28           H        ASN  28  -0.539  10.698  -8.604
   92    HA   ASN  28           HA       ASN  28  -0.386  10.797 -11.332
   93   1HB   ASN  28           HB2      ASN  28   1.473  11.503  -9.728
   94   2HB   ASN  28           HB1      ASN  28   1.857   9.777  -9.476
   95   1HD2  ASN  28           HD22     ASN  28   2.701  11.598 -13.151
   96   2HD2  ASN  28           HD21     ASN  28   1.427  12.238 -12.182
   97    H    ILE  29           H        ILE  29  -0.257   7.815  -9.350
   98    HA   ILE  29           HA       ILE  29   0.345   5.710 -10.283
   99    HB   ILE  29           HB       ILE  29  -2.263   6.631  -9.618
  100   1HG1  ILE  29           HG12     ILE  29  -2.559   4.011  -9.079
  101   2HG1  ILE  29           HG11     ILE  29  -0.814   4.006  -9.386
  102   1HG2  ILE  29           HG21     ILE  29  -2.589   4.813 -12.070
  103   2HG2  ILE  29           HG23     ILE  29  -3.801   5.052 -10.803
  104   3HG2  ILE  29           HG22     ILE  29  -3.197   6.433 -11.749
  105   1HD1  ILE  29           HD11     ILE  29  -2.128   5.811  -7.314
  106   2HD1  ILE  29           HD13     ILE  29  -1.315   4.263  -6.981
  107   3HD1  ILE  29           HD12     ILE  29  -0.367   5.617  -7.632
  108    H    THR  30           H        THR  30   1.098   4.523 -12.073
  109    HA   THR  30           HA       THR  30   0.132   5.381 -14.755
  110    HB   THR  30           HB       THR  30   2.159   6.424 -14.853
  111    HG1  THR  30           HG1      THR  30   3.063   3.786 -15.439
  112   1HG2  THR  30           HG22     THR  30   3.431   4.361 -12.969
  113   2HG2  THR  30           HG21     THR  30   4.274   5.741 -13.715
  114   3HG2  THR  30           HG23     THR  30   2.958   6.044 -12.546
  115    H    ASN  31           H        ASN  31   1.878   2.484 -13.143
  116    HA   ASN  31           HA       ASN  31   0.135   0.831 -14.963
  117   1HB   ASN  31           HB2      ASN  31   2.343   1.386 -16.062
  118   2HB   ASN  31           HB1      ASN  31   3.186   0.554 -14.736
  119   1HD2  ASN  31           HD22     ASN  31   2.162  -2.739 -15.916
  120   2HD2  ASN  31           HD21     ASN  31   2.804  -1.896 -14.552
  121    H    LEU  32           H        LEU  32  -1.084  -0.222 -13.180
  122    HA   LEU  32           HA       LEU  32   0.684  -1.338 -10.988
  123   1HB   LEU  32           HB2      LEU  32  -2.104  -0.244 -10.549
  124   2HB   LEU  32           HB1      LEU  32  -0.804  -0.504  -9.373
  125    HG   LEU  32           HG       LEU  32  -1.159   1.778  -9.475
  126   1HD1  LEU  32           HD11     LEU  32   1.416   1.135 -10.957
  127   2HD1  LEU  32           HD13     LEU  32   0.936   2.806 -10.674
  128   3HD1  LEU  32           HD12     LEU  32   1.205   1.789  -9.319
  129   1HD2  LEU  32           HD21     LEU  32  -2.481   1.969 -11.584
  130   2HD2  LEU  32           HD23     LEU  32  -1.218   3.215 -11.478
  131   3HD2  LEU  32           HD22     LEU  32  -0.984   1.903 -12.561
  132    H    ASP  33           H        ASP  33  -1.234  -2.885  -9.613
  133    HA   ASP  33           HA       ASP  33  -3.044  -4.065 -11.572
  134   1HB   ASP  33           HB2      ASP  33  -0.399  -5.060 -11.632
  135   2HB   ASP  33           HB1      ASP  33  -1.202  -6.185 -10.511
  136    H    ALA  34           H        ALA  34  -4.757  -3.636 -10.005
  137    HA   ALA  34           HA       ALA  34  -4.266  -4.343  -7.229
  138   1HB   ALA  34           HB3      ALA  34  -5.730  -2.435  -7.741
  139   2HB   ALA  34           HB2      ALA  34  -6.903  -3.528  -8.540
  140   3HB   ALA  34           HB1      ALA  34  -6.591  -3.678  -6.783
  141    H    CYS  35           H        CYS  35  -5.422  -6.096  -5.990
  142    HA   CYS  35           HA       CYS  35  -7.150  -7.877  -7.426
  143   1HB   CYS  35           HB2      CYS  35  -4.423  -8.385  -8.005
  144   2HB   CYS  35           HB1      CYS  35  -4.762  -9.482  -6.643
  145    HG   CYS  35           HG       CYS  35  -5.254 -10.689  -8.782
  146    H    ILE  36           H        ILE  36  -7.471 -10.019  -6.098
  147    HA   ILE  36           HA       ILE  36  -8.702  -9.404  -3.878
  148    HB   ILE  36           HB       ILE  36  -8.674 -11.697  -3.051
  149   1HG1  ILE  36           HG12     ILE  36  -6.645 -12.883  -3.383
  150   2HG1  ILE  36           HG11     ILE  36  -7.667 -13.524  -4.625
  151   1HG2  ILE  36           HG22     ILE  36 -10.197 -10.911  -4.924
  152   2HG2  ILE  36           HG21     ILE  36  -9.090 -11.673  -6.099
  153   3HG2  ILE  36           HG23     ILE  36  -9.908 -12.660  -4.875
  154   1HD1  ILE  36           HD11     ILE  36  -5.528 -11.348  -5.185
  155   2HD1  ILE  36           HD13     ILE  36  -5.339 -13.096  -5.383
  156   3HD1  ILE  36           HD12     ILE  36  -6.523 -12.215  -6.386
  157    H    THR  37           H        THR  37  -5.530 -11.033  -2.952
  158    HA   THR  37           HA       THR  37  -5.390  -9.043  -0.711
  159    HB   THR  37           HB       THR  37  -5.688 -11.102   0.414
  160    HG1  THR  37           HG1      THR  37  -2.832 -10.952   0.075
  161   1HG2  THR  37           HG22     THR  37  -3.920 -12.488  -1.676
  162   2HG2  THR  37           HG21     THR  37  -4.371 -13.207  -0.102
  163   3HG2  THR  37           HG23     THR  37  -5.646 -12.822  -1.279
  164    H    ARG  38           H        ARG  38  -4.584  -8.780  -3.651
  165    HA   ARG  38           HA       ARG  38  -1.721  -8.384  -3.092
  166   1HB   ARG  38           HB2      ARG  38  -2.804  -9.815  -5.575
  167   2HB   ARG  38           HB1      ARG  38  -1.118  -9.468  -5.258
  168   1HG   ARG  38           HG2      ARG  38  -1.381 -11.019  -3.143
  169   2HG   ARG  38           HG1      ARG  38  -3.017 -11.368  -3.747
  170   1HD   ARG  38           HD2      ARG  38  -2.007 -12.136  -5.928
  171   2HD   ARG  38           HD1      ARG  38  -0.369 -11.990  -5.184
  172    HE   ARG  38           HE       ARG  38  -1.946 -13.590  -3.436
  173   1HH1  ARG  38           HH11     ARG  38  -0.694 -13.778  -6.811
  174   2HH1  ARG  38           HH12     ARG  38  -0.781 -15.534  -6.819
  175   1HH2  ARG  38           HH21     ARG  38  -2.009 -15.833  -3.538
  176   2HH2  ARG  38           HH22     ARG  38  -1.493 -16.684  -4.996
  177    H    LEU  39           H        LEU  39  -1.345  -6.189  -3.614
  178    HA   LEU  39           HA       LEU  39  -2.528  -5.336  -6.169
  179   1HB   LEU  39           HB2      LEU  39  -3.379  -3.141  -5.281
  180   2HB   LEU  39           HB1      LEU  39  -4.228  -4.539  -4.612
  181    HG   LEU  39           HG       LEU  39  -2.219  -4.172  -2.744
  182   1HD1  LEU  39           HD12     LEU  39  -1.522  -1.972  -3.769
  183   2HD1  LEU  39           HD11     LEU  39  -3.168  -1.337  -3.480
  184   3HD1  LEU  39           HD13     LEU  39  -2.131  -1.796  -2.098
  185   1HD2  LEU  39           HD22     LEU  39  -5.087  -3.032  -2.764
  186   2HD2  LEU  39           HD21     LEU  39  -4.566  -4.638  -2.160
  187   3HD2  LEU  39           HD23     LEU  39  -4.106  -3.152  -1.286
  188    H    ARG  40           H        ARG  40  -0.924  -4.342  -7.424
  189    HA   ARG  40           HA       ARG  40   1.572  -3.708  -5.900
  190   1HB   ARG  40           HB2      ARG  40   2.474  -3.942  -8.425
  191   2HB   ARG  40           HB1      ARG  40   2.321  -5.356  -7.303
  192   1HG   ARG  40           HG2      ARG  40   0.256  -4.858  -9.322
  193   2HG   ARG  40           HG1      ARG  40   1.745  -5.746  -9.670
  194   1HD   ARG  40           HD2      ARG  40   0.819  -7.036  -7.245
  195   2HD   ARG  40           HD1      ARG  40  -0.572  -6.788  -8.230
  196    HE   ARG  40           HE       ARG  40   0.251  -8.001 -10.075
  197   1HH1  ARG  40           HH11     ARG  40   2.627  -8.218  -7.337
  198   2HH1  ARG  40           HH12     ARG  40   3.388  -9.623  -8.052
  199   1HH2  ARG  40           HH21     ARG  40   1.346  -9.750 -10.885
  200   2HH2  ARG  40           HH22     ARG  40   2.697 -10.460 -10.010
  201    H    VAL  41           H        VAL  41   3.004  -1.927  -6.864
  202    HA   VAL  41           HA       VAL  41   1.217   0.046  -8.062
  203    HB   VAL  41           HB       VAL  41   2.685   0.816  -5.508
  204   1HG1  VAL  41           HG11     VAL  41   0.246   2.060  -7.023
  205   2HG1  VAL  41           HG13     VAL  41   0.951   2.674  -5.514
  206   3HG1  VAL  41           HG12     VAL  41   1.893   2.726  -7.018
  207   1HG2  VAL  41           HG21     VAL  41   1.131  -0.959  -4.829
  208   2HG2  VAL  41           HG23     VAL  41   0.627   0.626  -4.213
  209   3HG2  VAL  41           HG22     VAL  41  -0.221  -0.079  -5.617
  210    H    SER  42           H        SER  42   2.941  -0.402  -9.917
  211    HA   SER  42           HA       SER  42   5.637   0.649  -9.443
  212   1HB   SER  42           HB2      SER  42   5.347  -1.069 -11.207
  213   2HB   SER  42           HB1      SER  42   4.188  -0.059 -12.069
  214    HG   SER  42           HG       SER  42   5.904   1.432 -12.530
  215    H    VAL  43           H        VAL  43   6.032   2.904  -9.092
  216    HA   VAL  43           HA       VAL  43   4.963   4.650 -11.218
  217    HB   VAL  43           HB       VAL  43   4.138   6.370  -9.706
  218   1HG1  VAL  43           HG12     VAL  43   2.536   4.557 -10.201
  219   2HG1  VAL  43           HG11     VAL  43   3.067   3.646  -8.770
  220   3HG1  VAL  43           HG13     VAL  43   2.236   5.218  -8.572
  221   1HG2  VAL  43           HG22     VAL  43   5.443   4.704  -7.506
  222   2HG2  VAL  43           HG21     VAL  43   5.699   6.399  -7.835
  223   3HG2  VAL  43           HG23     VAL  43   4.158   5.894  -7.115
  224    H    ALA  44           H        ALA  44   6.000   6.834 -11.292
  225    HA   ALA  44           HA       ALA  44   8.843   6.621 -10.450
  226   1HB   ALA  44           HB3      ALA  44   8.321   7.374 -12.770
  227   2HB   ALA  44           HB2      ALA  44   7.409   8.772 -12.120
  228   3HB   ALA  44           HB1      ALA  44   9.170   8.637 -11.827
  229    H    ASP  45           H        ASP  45   5.801   8.231  -9.318
  230    HA   ASP  45           HA       ASP  45   7.088  10.261  -7.766
  231   1HB   ASP  45           HB2      ASP  45   4.598   8.619  -7.034
  232   2HB   ASP  45           HB1      ASP  45   5.198  10.093  -6.220
  233    H    VAL  46           H        VAL  46   9.191   9.059  -7.236
  234    HA   VAL  46           HA       VAL  46   8.795   7.154  -4.958
  235    HB   VAL  46           HB       VAL  46  10.100   6.146  -6.688
  236   1HG1  VAL  46           HG11     VAL  46  12.135   8.452  -6.454
  237   2HG1  VAL  46           HG13     VAL  46  12.412   6.890  -7.258
  238   3HG1  VAL  46           HG12     VAL  46  11.162   7.984  -7.878
  239   1HG2  VAL  46           HG21     VAL  46  10.566   5.633  -4.265
  240   2HG2  VAL  46           HG23     VAL  46  12.009   5.423  -5.288
  241   3HG2  VAL  46           HG22     VAL  46  11.863   6.859  -4.247
  242    H    SER  47           H        SER  47   7.930   9.424  -4.088
  243    HA   SER  47           HA       SER  47  10.285  11.034  -3.091
  244   1HB   SER  47           HB2      SER  47   9.150  12.018  -5.098
  245   2HB   SER  47           HB1      SER  47   7.614  12.030  -4.198
  246    HG   SER  47           HG       SER  47   9.977  13.487  -3.413
  247    H    LYS  48           H        LYS  48  10.235  10.222  -0.883
  248    HA   LYS  48           HA       LYS  48   9.347   9.830   1.202
  249   1HB   LYS  48           HB2      LYS  48   7.510  12.240   0.762
  250   2HB   LYS  48           HB1      LYS  48   8.185  11.592   2.276
  251   1HG   LYS  48           HG2      LYS  48   9.332  13.655   1.713
  252   2HG   LYS  48           HG1      LYS  48  10.501  12.331   1.510
  253   1HD   LYS  48           HD2      LYS  48  10.598  12.632  -0.847
  254   2HD   LYS  48           HD1      LYS  48   8.899  13.176  -0.955
  255   1HE   LYS  48           HE2      LYS  48  10.916  15.009   0.375
  256   2HE   LYS  48           HE1      LYS  48  10.862  14.900  -1.402
  257   1HZ   LYS  48           HZ1      LYS  48   8.422  15.516   0.274
  258   2HZ   LYS  48           HZ3      LYS  48   9.401  16.701  -0.563
  259   3HZ   LYS  48           HZ2      LYS  48   8.538  15.504  -1.465
  260    H    VAL  49           H        VAL  49   8.406   8.218  -0.667
  261    HA   VAL  49           HA       VAL  49   5.449   8.175  -0.577
  262    HB   VAL  49           HB       VAL  49   6.171   7.651  -2.706
  263   1HG1  VAL  49           HG11     VAL  49   8.402   5.981  -1.488
  264   2HG1  VAL  49           HG13     VAL  49   7.853   5.661  -3.165
  265   3HG1  VAL  49           HG12     VAL  49   8.458   7.261  -2.701
  266   1HG2  VAL  49           HG21     VAL  49   4.427   6.129  -1.890
  267   2HG2  VAL  49           HG23     VAL  49   5.420   5.343  -3.135
  268   3HG2  VAL  49           HG22     VAL  49   5.618   4.908  -1.418
  269    H    ASP  50           H        ASP  50   8.117   7.051   1.463
  270    HA   ASP  50           HA       ASP  50   8.042   5.610   3.273
  271   1HB   ASP  50           HB2      ASP  50   5.818   7.497   3.331
  272   2HB   ASP  50           HB1      ASP  50   5.220   5.971   3.990
  273    H    GLN  51           H        GLN  51   8.345   4.159   1.270
  274    HA   GLN  51           HA       GLN  51   6.108   2.305   0.789
  275   1HB   GLN  51           HB2      GLN  51   9.097   2.005   0.127
  276   2HB   GLN  51           HB1      GLN  51   7.790   0.976  -0.518
  277   1HG   GLN  51           HG2      GLN  51   6.888   2.769  -1.866
  278   2HG   GLN  51           HG1      GLN  51   7.669   3.989  -0.891
  279   1HE2  GLN  51           HE22     GLN  51   9.836   2.300  -3.930
  280   2HE2  GLN  51           HE21     GLN  51   8.379   1.526  -3.407
  281    H    ALA  52           H        ALA  52   9.275   2.412   2.628
  282    HA   ALA  52           HA       ALA  52   9.105  -0.126   3.764
  283   1HB   ALA  52           HB3      ALA  52  11.121   1.330   3.990
  284   2HB   ALA  52           HB2      ALA  52  10.205   2.442   5.055
  285   3HB   ALA  52           HB1      ALA  52  10.554   0.767   5.592
  286    H    GLY  53           H        GLY  53   7.191   2.845   4.537
  287   1HA   GLY  53           HA1      GLY  53   6.015   1.547   6.925
  288   2HA   GLY  53           HA2      GLY  53   5.464   3.053   6.156
  289    H    LEU  54           H        LEU  54   5.167   2.138   3.407
  290    HA   LEU  54           HA       LEU  54   2.501   1.293   3.911
  291   1HB   LEU  54           HB2      LEU  54   3.494   2.756   1.979
  292   2HB   LEU  54           HB1      LEU  54   3.581   1.249   1.060
  293    HG   LEU  54           HG       LEU  54   0.893   1.890   2.394
  294   1HD1  LEU  54           HD11     LEU  54   2.129   3.798   0.464
  295   2HD1  LEU  54           HD13     LEU  54   0.366   3.537   0.469
  296   3HD1  LEU  54           HD12     LEU  54   1.249   4.095   1.899
  297   1HD2  LEU  54           HD22     LEU  54   1.577   1.028  -0.477
  298   2HD2  LEU  54           HD21     LEU  54   1.068  -0.085   0.816
  299   3HD2  LEU  54           HD23     LEU  54  -0.056   1.154   0.227
  300    H    LYS  55           H        LYS  55   5.370  -0.667   3.512
  301    HA   LYS  55           HA       LYS  55   3.817  -2.852   2.430
  302   1HB   LYS  55           HB2      LYS  55   5.708  -4.174   2.399
  303   2HB   LYS  55           HB1      LYS  55   6.483  -2.564   2.321
  304   1HG   LYS  55           HG2      LYS  55   6.156  -4.326   4.866
  305   2HG   LYS  55           HG1      LYS  55   7.473  -4.503   3.736
  306   1HD   LYS  55           HD2      LYS  55   7.356  -1.684   4.329
  307   2HD   LYS  55           HD1      LYS  55   7.293  -2.555   5.873
  308   1HE   LYS  55           HE2      LYS  55   9.600  -2.026   5.261
  309   2HE   LYS  55           HE1      LYS  55   9.401  -3.794   5.275
  310   1HZ   LYS  55           HZ1      LYS  55   9.168  -2.236   2.686
  311   2HZ   LYS  55           HZ3      LYS  55  10.699  -2.730   3.315
  312   3HZ   LYS  55           HZ2      LYS  55   9.565  -3.937   2.919
  313    H    LYS  56           H        LYS  56   4.954  -1.926   5.619
  314    HA   LYS  56           HA       LYS  56   3.781  -4.397   6.764
  315   1HB   LYS  56           HB2      LYS  56   4.744  -3.708   8.883
  316   2HB   LYS  56           HB1      LYS  56   5.958  -3.684   7.580
  317   1HG   LYS  56           HG2      LYS  56   5.630  -1.078   7.485
  318   2HG   LYS  56           HG1      LYS  56   4.583  -1.255   8.907
  319   1HD   LYS  56           HD2      LYS  56   7.566  -2.063   8.655
  320   2HD   LYS  56           HD1      LYS  56   6.954  -0.544   9.359
  321   1HE   LYS  56           HE2      LYS  56   5.637  -1.959  11.065
  322   2HE   LYS  56           HE1      LYS  56   6.543  -3.382  10.469
  323   1HZ   LYS  56           HZ2      LYS  56   8.662  -2.215  11.039
  324   2HZ   LYS  56           HZ1      LYS  56   7.755  -0.858  11.656
  325   3HZ   LYS  56           HZ3      LYS  56   7.635  -2.405  12.436
  326    H    LEU  57           H        LEU  57   3.179  -0.840   6.763
  327    HA   LEU  57           HA       LEU  57   0.859  -1.258   8.521
  328   1HB   LEU  57           HB2      LEU  57   2.477   0.552   8.903
  329   2HB   LEU  57           HB1      LEU  57   2.134   1.279   7.309
  330    HG   LEU  57           HG       LEU  57   1.101   2.371   9.408
  331   1HD1  LEU  57           HD11     LEU  57  -0.380   1.778   6.782
  332   2HD1  LEU  57           HD13     LEU  57  -1.282   2.560   8.093
  333   3HD1  LEU  57           HD12     LEU  57   0.230   3.269   7.527
  334   1HD2  LEU  57           HD21     LEU  57   0.316   0.277  10.550
  335   2HD2  LEU  57           HD23     LEU  57  -0.985   1.484  10.325
  336   3HD2  LEU  57           HD22     LEU  57  -0.864   0.084   9.217
  337    H    GLY  58           H        GLY  58   1.588  -0.487   5.046
  338   1HA   GLY  58           HA1      GLY  58  -1.236   0.155   4.504
  339   2HA   GLY  58           HA2      GLY  58   0.077   0.075   3.334
  340    H    ALA  59           H        ALA  59   1.226  -2.396   3.585
  341    HA   ALA  59           HA       ALA  59  -1.037  -4.237   2.926
  342   1HB   ALA  59           HB3      ALA  59   0.073  -3.152   0.903
  343   2HB   ALA  59           HB2      ALA  59   1.634  -3.846   1.437
  344   3HB   ALA  59           HB1      ALA  59   0.306  -4.918   0.902
  345    H    ALA  60           H        ALA  60   1.086  -6.410   2.463
  346    HA   ALA  60           HA       ALA  60   2.588  -6.456   4.963
  347   1HB   ALA  60           HB2      ALA  60   0.262  -8.480   4.771
  348   2HB   ALA  60           HB1      ALA  60   1.607  -8.507   5.940
  349   3HB   ALA  60           HB3      ALA  60   0.428  -7.172   5.964
  350    H    GLY  61           H        GLY  61   3.789  -6.325   2.718
  351   1HA   GLY  61           HA1      GLY  61   5.610  -8.135   2.406
  352   2HA   GLY  61           HA2      GLY  61   4.291  -9.120   1.737
  353    H    VAL  62           H        VAL  62   6.234  -6.108   1.151
  354    HA   VAL  62           HA       VAL  62   5.168  -6.199  -1.655
  355    HB   VAL  62           HB       VAL  62   5.184  -3.797  -1.782
  356   1HG1  VAL  62           HG11     VAL  62   4.116  -4.522   0.950
  357   2HG1  VAL  62           HG13     VAL  62   3.969  -2.880   0.191
  358   3HG1  VAL  62           HG12     VAL  62   3.203  -4.302  -0.478
  359   1HG2  VAL  62           HG22     VAL  62   7.160  -3.793   0.504
  360   2HG2  VAL  62           HG21     VAL  62   7.338  -3.229  -1.160
  361   3HG2  VAL  62           HG23     VAL  62   6.305  -2.310  -0.057
  362    H    VAL  63           H        VAL  63   6.870  -5.009  -3.156
  363    HA   VAL  63           HA       VAL  63   9.607  -5.631  -2.249
  364    HB   VAL  63           HB       VAL  63   9.574  -7.759  -3.053
  365   1HG1  VAL  63           HG11     VAL  63   6.979  -7.097  -4.525
  366   2HG1  VAL  63           HG13     VAL  63   7.741  -8.704  -4.565
  367   3HG1  VAL  63           HG12     VAL  63   7.182  -8.016  -3.018
  368   1HG2  VAL  63           HG21     VAL  63  10.842  -6.626  -4.856
  369   2HG2  VAL  63           HG23     VAL  63   9.987  -8.079  -5.462
  370   3HG2  VAL  63           HG22     VAL  63   9.348  -6.458  -5.825
  371    H    VAL  64           H        VAL  64  11.051  -4.107  -3.144
  372    HA   VAL  64           HA       VAL  64   9.739  -2.234  -5.059
  373    HB   VAL  64           HB       VAL  64  12.119  -1.856  -3.194
  374   1HG1  VAL  64           HG12     VAL  64  12.177  -0.358  -5.223
  375   2HG1  VAL  64           HG11     VAL  64  10.529   0.207  -4.832
  376   3HG1  VAL  64           HG13     VAL  64  11.875   0.577  -3.730
  377   1HG2  VAL  64           HG22     VAL  64   9.187  -0.929  -2.902
  378   2HG2  VAL  64           HG21     VAL  64  10.010  -2.148  -1.891
  379   3HG2  VAL  64           HG23     VAL  64  10.535  -0.443  -1.838
  380    H    ALA  65           H        ALA  65  10.756  -1.874  -7.147
  381    HA   ALA  65           HA       ALA  65  13.419  -3.154  -7.643
  382   1HB   ALA  65           HB2      ALA  65  10.794  -3.874  -9.086
  383   2HB   ALA  65           HB1      ALA  65  12.427  -4.427  -9.562
  384   3HB   ALA  65           HB3      ALA  65  11.717  -4.953  -8.007
  385    H    GLY  66           H        GLY  66  14.140  -0.848  -7.962
  386   1HA   GLY  66           HA1      GLY  66  13.129   1.214  -9.172
  387   2HA   GLY  66           HA2      GLY  66  14.744   0.681  -9.684
  388    H    SER  67           H        SER  67  11.736   1.584 -10.988
  389    HA   SER  67           HA       SER  67  11.271   1.354 -13.351
  390   1HB   SER  67           HB2      SER  67  11.341  -0.762 -14.538
  391   2HB   SER  67           HB1      SER  67  12.991  -0.384 -13.974
  392    HG   SER  67           HG       SER  67  12.333  -2.624 -13.481
  393    H    GLY  68           H        GLY  68  10.503  -0.458 -10.369
  394   1HA   GLY  68           HA1      GLY  68   7.826   0.093 -10.604
  395   2HA   GLY  68           HA2      GLY  68   8.012  -1.545 -11.328
  396    H    VAL  69           H        VAL  69   6.446  -1.477  -9.153
  397    HA   VAL  69           HA       VAL  69   8.114  -2.578  -6.948
  398    HB   VAL  69           HB       VAL  69   6.074  -0.279  -6.689
  399   1HG1  VAL  69           HG11     VAL  69   7.526  -1.974  -4.559
  400   2HG1  VAL  69           HG13     VAL  69   7.105  -0.314  -4.216
  401   3HG1  VAL  69           HG12     VAL  69   5.830  -1.466  -4.662
  402   1HG2  VAL  69           HG22     VAL  69   9.113  -0.238  -6.593
  403   2HG2  VAL  69           HG21     VAL  69   7.995   0.723  -7.596
  404   3HG2  VAL  69           HG23     VAL  69   8.155   1.062  -5.860
  405    H    GLN  70           H        GLN  70   6.725  -4.033  -5.579
  406    HA   GLN  70           HA       GLN  70   4.048  -4.248  -6.755
  407   1HB   GLN  70           HB2      GLN  70   4.974  -6.744  -5.519
  408   2HB   GLN  70           HB1      GLN  70   4.224  -6.558  -7.114
  409   1HG   GLN  70           HG2      GLN  70   6.309  -5.821  -8.138
  410   2HG   GLN  70           HG1      GLN  70   7.203  -6.087  -6.635
  411   1HE2  GLN  70           HE22     GLN  70   6.316  -9.858  -7.322
  412   2HE2  GLN  70           HE21     GLN  70   5.477  -8.848  -6.224
  413    H    ALA  71           H        ALA  71   2.612  -5.709  -5.044
  414    HA   ALA  71           HA       ALA  71   3.407  -5.124  -2.498
  415   1HB   ALA  71           HB2      ALA  71   1.603  -2.953  -3.592
  416   2HB   ALA  71           HB1      ALA  71   1.271  -3.501  -1.928
  417   3HB   ALA  71           HB3      ALA  71   2.861  -2.829  -2.396
  418    H    ILE  72           H        ILE  72   2.500  -6.509  -0.970
  419    HA   ILE  72           HA       ILE  72   0.120  -7.930  -1.879
  420    HB   ILE  72           HB       ILE  72   2.959  -8.828  -2.252
  421   1HG1  ILE  72           HG12     ILE  72   1.382 -10.842  -3.431
  422   2HG1  ILE  72           HG11     ILE  72   0.348  -9.430  -3.508
  423   1HG2  ILE  72           HG22     ILE  72   2.626 -10.032  -0.109
  424   2HG2  ILE  72           HG21     ILE  72   1.150 -10.813  -0.773
  425   3HG2  ILE  72           HG23     ILE  72   2.760 -11.144  -1.484
  426   1HD1  ILE  72           HD12     ILE  72   2.193  -8.139  -4.700
  427   2HD1  ILE  72           HD11     ILE  72   3.205  -9.609  -4.625
  428   3HD1  ILE  72           HD13     ILE  72   1.677  -9.622  -5.554
  429    H    PHE  73           H        PHE  73  -0.820  -9.344  -0.220
  430    HA   PHE  73           HA       PHE  73   0.136  -8.434   2.500
  431   1HB   PHE  73           HB2      PHE  73  -2.727  -8.973   1.582
  432   2HB   PHE  73           HB1      PHE  73  -2.091  -8.680   3.223
  433    HD1  PHE  73           HD2      PHE  73  -1.649  -6.951  -0.248
  434    HD2  PHE  73           HD1      PHE  73  -2.833  -6.503   3.832
  435    HE1  PHE  73           HE2      PHE  73  -2.049  -4.526  -0.546
  436    HE2  PHE  73           HE1      PHE  73  -4.069  -4.412   3.228
  437    HZ   PHE  73           HZ       PHE  73  -3.527  -3.324   1.061
  438    H    GLY  74           H        GLY  74   1.653 -10.306   2.045
  439   1HA   GLY  74           HA1      GLY  74   1.138 -12.744   1.161
  440   2HA   GLY  74           HA2      GLY  74   2.159 -12.550   2.600
  441    H    THR  75           H        THR  75   1.174 -12.702   4.804
  442    HA   THR  75           HA       THR  75  -1.452 -14.200   4.734
  443    HB   THR  75           HB       THR  75  -0.490 -15.667   6.543
  444    HG1  THR  75           HG1      THR  75   1.332 -14.306   7.100
  445   1HG2  THR  75           HG22     THR  75   1.015 -15.701   3.862
  446   2HG2  THR  75           HG21     THR  75   0.922 -17.077   4.996
  447   3HG2  THR  75           HG23     THR  75  -0.562 -16.502   4.179
  448    H    LYS  76           H        LYS  76  -0.964 -11.288   5.153
  449    HA   LYS  76           HA       LYS  76  -2.598 -11.285   7.622
  450   1HB   LYS  76           HB2      LYS  76  -0.087  -9.525   7.350
  451   2HB   LYS  76           HB1      LYS  76  -1.426  -9.262   8.492
  452   1HG   LYS  76           HG2      LYS  76  -0.008 -10.346   9.930
  453   2HG   LYS  76           HG1      LYS  76  -1.000 -11.677   9.352
  454   1HD   LYS  76           HD2      LYS  76   1.098 -12.673   9.042
  455   2HD   LYS  76           HD1      LYS  76   1.033 -11.804   7.489
  456   1HE   LYS  76           HE2      LYS  76   3.216 -11.384   8.427
  457   2HE   LYS  76           HE1      LYS  76   2.311  -9.863   8.648
  458   1HZ   LYS  76           HZ1      LYS  76   2.749 -12.010  10.772
  459   2HZ   LYS  76           HZ3      LYS  76   3.660 -10.550  10.627
  460   3HZ   LYS  76           HZ2      LYS  76   1.989 -10.476  11.051
  461    H    SER  77           H        SER  77  -3.624 -11.252   5.099
  462    HA   SER  77           HA       SER  77  -4.011  -8.416   4.356
  463   1HB   SER  77           HB2      SER  77  -4.166 -10.576   2.826
  464   2HB   SER  77           HB1      SER  77  -5.864 -10.608   3.349
  465    HG   SER  77           HG       SER  77  -5.953  -8.330   2.575
  466    H    ASP  78           H        ASP  78  -5.839 -11.087   6.055
  467    HA   ASP  78           HA       ASP  78  -8.200  -9.536   6.252
  468   1HB   ASP  78           HB2      ASP  78  -7.966 -12.036   6.710
  469   2HB   ASP  78           HB1      ASP  78  -7.268 -11.627   8.300
  470    H    ASN  79           H        ASN  79  -5.348  -9.932   8.533
  471    HA   ASN  79           HA       ASN  79  -6.417  -8.178  10.509
  472   1HB   ASN  79           HB2      ASN  79  -4.460  -9.630  11.007
  473   2HB   ASN  79           HB1      ASN  79  -3.465  -8.749   9.827
  474   1HD2  ASN  79           HD22     ASN  79  -2.621  -6.249  12.266
  475   2HD2  ASN  79           HD21     ASN  79  -2.185  -7.025  10.790
  476    H    LEU  80           H        LEU  80  -4.091  -7.522   7.767
  477    HA   LEU  80           HA       LEU  80  -3.855  -4.754   8.294
  478   1HB   LEU  80           HB2      LEU  80  -3.569  -6.394   5.876
  479   2HB   LEU  80           HB1      LEU  80  -3.705  -4.652   5.609
  480    HG   LEU  80           HG       LEU  80  -1.368  -5.599   5.786
  481   1HD1  LEU  80           HD11     LEU  80  -2.233  -3.114   7.405
  482   2HD1  LEU  80           HD13     LEU  80  -0.538  -3.449   6.969
  483   3HD1  LEU  80           HD12     LEU  80  -1.751  -3.194   5.697
  484   1HD2  LEU  80           HD21     LEU  80  -1.693  -6.871   8.036
  485   2HD2  LEU  80           HD23     LEU  80  -0.268  -5.805   7.977
  486   3HD2  LEU  80           HD22     LEU  80  -1.713  -5.289   8.854
  487    H    LYS  81           H        LYS  81  -6.355  -6.550   6.324
  488    HA   LYS  81           HA       LYS  81  -7.673  -4.296   5.328
  489   1HB   LYS  81           HB2      LYS  81  -8.492  -7.117   5.710
  490   2HB   LYS  81           HB1      LYS  81  -9.878  -6.054   5.968
  491   1HG   LYS  81           HG2      LYS  81  -9.425  -4.913   3.767
  492   2HG   LYS  81           HG1      LYS  81  -8.159  -6.136   3.443
  493   1HD   LYS  81           HD2      LYS  81 -11.193  -6.612   3.849
  494   2HD   LYS  81           HD1      LYS  81 -10.254  -6.807   2.345
  495   1HE   LYS  81           HE2      LYS  81  -8.909  -8.657   3.559
  496   2HE   LYS  81           HE1      LYS  81 -10.109  -8.542   4.882
  497   1HZ   LYS  81           HZ2      LYS  81 -11.919  -9.081   3.282
  498   2HZ   LYS  81           HZ1      LYS  81 -10.749  -9.268   2.011
  499   3HZ   LYS  81           HZ3      LYS  81 -10.729 -10.341   3.370
  500    H    THR  82           H        THR  82  -7.959  -5.786   8.619
  501    HA   THR  82           HA       THR  82 -10.396  -4.356   9.232
  502    HB   THR  82           HB       THR  82  -9.859  -4.920  11.631
  503    HG1  THR  82           HG1      THR  82  -7.832  -6.032  11.986
  504   1HG2  THR  82           HG22     THR  82  -9.794  -7.069   9.424
  505   2HG2  THR  82           HG21     THR  82  -9.487  -7.559  11.108
  506   3HG2  THR  82           HG23     THR  82 -11.019  -6.747  10.670
  507    H    GLU  83           H        GLU  83  -6.997  -3.896  10.476
  508    HA   GLU  83           HA       GLU  83  -7.398  -1.285  11.363
  509   1HB   GLU  83           HB2      GLU  83  -4.983  -0.965  11.333
  510   2HB   GLU  83           HB1      GLU  83  -5.380  -2.593  11.909
  511   1HG   GLU  83           HG2      GLU  83  -4.957  -3.510   9.673
  512   2HG   GLU  83           HG1      GLU  83  -4.432  -1.952   9.023
  513    H    MET  84           H        MET  84  -6.834  -2.328   7.873
  514    HA   MET  84           HA       MET  84  -6.315   0.337   6.990
  515   1HB   MET  84           HB2      MET  84  -7.722  -1.812   5.305
  516   2HB   MET  84           HB1      MET  84  -7.092  -0.237   4.775
  517   1HG   MET  84           HG2      MET  84  -4.780  -1.376   5.921
  518   2HG   MET  84           HG1      MET  84  -5.605  -2.798   5.223
  519   1HE   MET  84           HE1      MET  84  -3.594   0.337   4.636
  520   2HE   MET  84           HE3      MET  84  -3.596   0.541   2.859
  521   3HE   MET  84           HE2      MET  84  -5.014   1.069   3.833
  522    H    ASP  85           H        ASP  85  -9.360  -1.660   7.370
  523    HA   ASP  85           HA       ASP  85 -11.170   0.185   6.428
  524   1HB   ASP  85           HB2      ASP  85 -11.819  -2.096   7.236
  525   2HB   ASP  85           HB1      ASP  85 -11.656  -1.535   8.922
  526    H    GLU  86           H        GLU  86  -9.768  -0.038   9.805
  527    HA   GLU  86           HA       GLU  86 -11.084   2.190  10.856
  528   1HB   GLU  86           HB2      GLU  86  -8.365   0.959  11.471
  529   2HB   GLU  86           HB1      GLU  86  -8.712   2.545  12.160
  530   1HG   GLU  86           HG2      GLU  86 -10.697   0.235  12.515
  531   2HG   GLU  86           HG1      GLU  86  -9.327   0.500  13.625
  532    H    TYR  87           H        TYR  87  -8.117   2.160   8.734
  533    HA   TYR  87           HA       TYR  87  -7.475   4.879   9.328
  534   1HB   TYR  87           HB1      TYR  87  -6.871   3.531   6.651
  535   2HB   TYR  87           HB2      TYR  87  -5.958   4.837   7.461
  536    HD1  TYR  87           HD2      TYR  87  -6.237   3.217  10.328
  537    HD2  TYR  87           HD1      TYR  87  -4.579   2.517   6.392
  538    HE1  TYR  87           HE2      TYR  87  -4.783   1.500  11.257
  539    HE2  TYR  87           HE1      TYR  87  -3.186   0.697   7.337
  540    HH   TYR  87           HH       TYR  87  -2.902   0.030  10.778
  541    H    ILE  88           H        ILE  88  -9.448   3.450   6.593
  542    HA   ILE  88           HA       ILE  88  -9.877   6.049   5.430
  543    HB   ILE  88           HB       ILE  88 -11.820   3.701   5.151
  544   1HG1  ILE  88           HG12     ILE  88 -10.108   3.761   2.819
  545   2HG1  ILE  88           HG11     ILE  88  -9.000   3.878   4.193
  546   1HG2  ILE  88           HG22     ILE  88 -12.624   5.920   4.310
  547   2HG2  ILE  88           HG21     ILE  88 -11.175   6.055   3.272
  548   3HG2  ILE  88           HG23     ILE  88 -12.378   4.766   2.976
  549   1HD1  ILE  88           HD12     ILE  88 -10.208   1.819   5.170
  550   2HD1  ILE  88           HD11     ILE  88 -11.121   1.686   3.658
  551   3HD1  ILE  88           HD13     ILE  88  -9.339   1.492   3.657
  552    H    ARG  89           H        ARG  89 -11.711   3.993   7.812
  553    HA   ARG  89           HA       ARG  89 -13.895   5.825   8.093
  554   1HB   ARG  89           HB2      ARG  89 -12.672   3.814  10.090
  555   2HB   ARG  89           HB1      ARG  89 -14.172   4.723  10.389
  556   1HG   ARG  89           HG2      ARG  89 -15.286   3.710   8.457
  557   2HG   ARG  89           HG1      ARG  89 -13.807   2.865   7.938
  558   1HD   ARG  89           HD2      ARG  89 -13.861   1.430   9.956
  559   2HD   ARG  89           HD1      ARG  89 -15.202   2.442  10.616
  560    HE   ARG  89           HE       ARG  89 -15.856   1.306   7.998
  561   1HH1  ARG  89           HH11     ARG  89 -15.662   0.424  11.490
  562   2HH1  ARG  89           HH12     ARG  89 -17.004  -0.702  11.346
  563   1HH2  ARG  89           HH21     ARG  89 -17.528  -0.177   7.910
  564   2HH2  ARG  89           HH22     ARG  89 -18.024  -1.065   9.352
  565    H    ASN  90           H        ASN  90 -10.589   5.786   9.502
  566    HA   ASN  90           HA       ASN  90 -11.168   7.928  11.389
  567   1HB   ASN  90           HB2      ASN  90  -9.342   6.260  11.767
  568   2HB   ASN  90           HB1      ASN  90  -8.502   6.851  10.310
  569   1HD2  ASN  90           HD22     ASN  90  -6.554   8.733  12.612
  570   2HD2  ASN  90           HD21     ASN  90  -6.568   7.366  11.566
  571    H    PHE  91           H        PHE  91 -10.451   7.841   7.899
  572    HA   PHE  91           HA       PHE  91 -10.047  10.832   7.979
  573   1HB   PHE  91           HB2      PHE  91  -8.185   8.809   7.310
  574   2HB   PHE  91           HB1      PHE  91  -8.718   9.337   5.738
  575    HD1  PHE  91           HD2      PHE  91  -7.519  10.607   9.098
  576    HD2  PHE  91           HD1      PHE  91  -7.680  11.379   4.864
  577    HE1  PHE  91           HE2      PHE  91  -5.777  12.352   9.348
  578    HE2  PHE  91           HE1      PHE  91  -5.965  13.145   5.124
  579    HZ   PHE  91           HZ       PHE  91  -4.980  13.609   7.357
  580    H    GLY  92           H        GLY  92 -12.603   9.289   7.639
  581   1HA   GLY  92           HA1      GLY  92 -13.735  10.580   5.472
  582   2HA   GLY  92           HA2      GLY  92 -13.021   9.100   4.754
   
  No H/Q in entry =         582
  Start of MODEL    9
    1    H    MET  15           H        MET  15  -2.734   6.139  11.351
    2    HA   MET  15           HA       MET  15  -1.750   7.336   9.585
    3   1HB   MET  15           HB2      MET  15   0.681   5.780  10.534
    4   2HB   MET  15           HB1      MET  15   0.690   6.396   8.865
    5   1HG   MET  15           HG2      MET  15   0.234   8.710   9.593
    6   2HG   MET  15           HG1      MET  15   0.152   8.171  11.303
    7   1HE   MET  15           HE2      MET  15   1.875  10.513  10.644
    8   2HE   MET  15           HE1      MET  15   2.049   9.705  12.239
    9   3HE   MET  15           HE3      MET  15   3.507  10.128  11.283
   10    H    ALA  16           H        ALA  16  -2.699   3.977   9.724
   11    HA   ALA  16           HA       ALA  16  -1.891   3.326   7.107
   12   1HB   ALA  16           HB3      ALA  16  -3.133   1.753   8.782
   13   2HB   ALA  16           HB2      ALA  16  -4.632   2.461   8.080
   14   3HB   ALA  16           HB1      ALA  16  -3.475   1.584   7.045
   15    HA   PRO  17           HA       PRO  17  -5.503   5.372   5.044
   16   1HB   PRO  17           HB2      PRO  17  -6.881   7.422   6.064
   17   2HB   PRO  17           HB1      PRO  17  -7.062   5.745   6.666
   18   1HG   PRO  17           HG2      PRO  17  -5.577   7.964   8.056
   19   2HG   PRO  17           HG1      PRO  17  -6.618   6.702   8.770
   20   1HD   PRO  17           HD2      PRO  17  -3.827   6.624   8.605
   21   2HD   PRO  17           HD1      PRO  17  -4.748   5.169   8.931
   22    H    ALA  18           H        ALA  18  -3.543   7.985   6.843
   23    HA   ALA  18           HA       ALA  18  -3.078   9.520   4.464
   24   1HB   ALA  18           HB3      ALA  18  -2.640  10.407   6.788
   25   2HB   ALA  18           HB2      ALA  18  -1.344   9.189   7.007
   26   3HB   ALA  18           HB1      ALA  18  -1.163  10.476   5.774
   27    H    LEU  19           H        LEU  19  -1.499   6.626   6.052
   28    HA   LEU  19           HA       LEU  19   0.838   6.931   4.473
   29   1HB   LEU  19           HB2      LEU  19   0.646   5.542   6.696
   30   2HB   LEU  19           HB1      LEU  19   0.087   4.217   5.654
   31    HG   LEU  19           HG       LEU  19   2.395   3.815   5.879
   32   1HD1  LEU  19           HD12     LEU  19   1.855   4.098   3.493
   33   2HD1  LEU  19           HD11     LEU  19   2.513   5.770   3.483
   34   3HD1  LEU  19           HD13     LEU  19   3.569   4.418   3.860
   35   1HD2  LEU  19           HD22     LEU  19   2.987   6.840   5.876
   36   2HD2  LEU  19           HD21     LEU  19   2.988   5.758   7.304
   37   3HD2  LEU  19           HD23     LEU  19   4.191   5.528   6.017
   38    H    VAL  20           H        VAL  20  -1.970   4.455   4.314
   39    HA   VAL  20           HA       VAL  20  -1.240   3.359   1.915
   40    HB   VAL  20           HB       VAL  20  -3.260   2.725   3.188
   41   1HG1  VAL  20           HG12     VAL  20  -4.427   4.963   3.069
   42   2HG1  VAL  20           HG11     VAL  20  -4.726   4.728   1.323
   43   3HG1  VAL  20           HG13     VAL  20  -5.506   3.666   2.517
   44   1HG2  VAL  20           HG22     VAL  20  -3.393   2.812   0.101
   45   2HG2  VAL  20           HG21     VAL  20  -2.678   1.524   1.118
   46   3HG2  VAL  20           HG23     VAL  20  -4.440   1.774   1.090
   47    H    ALA  21           H        ALA  21  -2.747   6.615   2.540
   48    HA   ALA  21           HA       ALA  21  -3.443   7.018  -0.121
   49   1HB   ALA  21           HB3      ALA  21  -4.405   8.471   1.610
   50   2HB   ALA  21           HB2      ALA  21  -2.796   9.193   1.933
   51   3HB   ALA  21           HB1      ALA  21  -3.595   9.454   0.355
   52    H    ALA  22           H        ALA  22  -0.359   7.616   1.693
   53    HA   ALA  22           HA       ALA  22   0.923   9.286  -0.089
   54   1HB   ALA  22           HB3      ALA  22   1.866   8.523   2.154
   55   2HB   ALA  22           HB2      ALA  22   2.330   6.981   1.370
   56   3HB   ALA  22           HB1      ALA  22   3.046   8.522   0.815
   57    H    PHE  23           H        PHE  23   0.218   5.836  -0.776
   58    HA   PHE  23           HA       PHE  23   1.791   6.201  -3.327
   59   1HB   PHE  23           HB2      PHE  23   2.792   4.694  -1.533
   60   2HB   PHE  23           HB1      PHE  23   1.553   3.465  -2.153
   61    HD1  PHE  23           HD2      PHE  23   2.798   5.150  -5.051
   62    HD2  PHE  23           HD1      PHE  23   3.874   2.387  -1.893
   63    HE1  PHE  23           HE2      PHE  23   4.368   3.980  -6.520
   64    HE2  PHE  23           HE1      PHE  23   5.698   1.520  -3.275
   65    HZ   PHE  23           HZ       PHE  23   5.954   2.309  -5.653
   66    H    GLY  24           H        GLY  24  -0.705   3.948  -1.691
   67   1HA   GLY  24           HA1      GLY  24  -1.949   3.312  -4.172
   68   2HA   GLY  24           HA2      GLY  24  -2.650   3.078  -2.547
   69    H    GLY  25           H        GLY  25  -2.309   6.161  -1.993
   70   1HA   GLY  25           HA1      GLY  25  -4.835   6.919  -3.429
   71   2HA   GLY  25           HA2      GLY  25  -4.135   7.789  -2.065
   72    H    LYS  26           H        LYS  26  -1.652   6.943  -4.399
   73    HA   LYS  26           HA       LYS  26  -1.636   9.792  -5.298
   74   1HB   LYS  26           HB2      LYS  26   0.200   7.454  -5.923
   75   2HB   LYS  26           HB1      LYS  26   0.499   9.165  -6.372
   76   1HG   LYS  26           HG2      LYS  26   0.355   7.987  -3.548
   77   2HG   LYS  26           HG1      LYS  26   1.857   8.230  -4.489
   78   1HD   LYS  26           HD2      LYS  26   0.466  10.787  -4.335
   79   2HD   LYS  26           HD1      LYS  26   0.444  10.083  -2.713
   80   1HE   LYS  26           HE2      LYS  26   2.512  11.089  -2.483
   81   2HE   LYS  26           HE1      LYS  26   3.158   9.690  -3.341
   82   1HZ   LYS  26           HZ2      LYS  26   2.862  10.952  -5.484
   83   2HZ   LYS  26           HZ1      LYS  26   2.379  12.345  -4.545
   84   3HZ   LYS  26           HZ3      LYS  26   3.977  11.699  -4.372
   85    H    GLU  27           H        GLU  27  -3.925   9.271  -6.267
   86    HA   GLU  27           HA       GLU  27  -4.261   7.050  -7.941
   87   1HB   GLU  27           HB2      GLU  27  -6.384   7.799  -8.388
   88   2HB   GLU  27           HB1      GLU  27  -6.036   9.007  -7.138
   89   1HG   GLU  27           HG2      GLU  27  -5.232  10.569  -9.047
   90   2HG   GLU  27           HG1      GLU  27  -5.835   9.341 -10.202
   91    H    ASN  28           H        ASN  28  -2.699  10.189  -8.640
   92    HA   ASN  28           HA       ASN  28  -2.621  10.160 -11.399
   93   1HB   ASN  28           HB2      ASN  28  -1.577  11.946  -9.988
   94   2HB   ASN  28           HB1      ASN  28  -0.357  10.788  -9.397
   95   1HD2  ASN  28           HD22     ASN  28  -0.065  12.153 -13.336
   96   2HD2  ASN  28           HD21     ASN  28  -1.638  12.003 -12.642
   97    H    ILE  29           H        ILE  29  -1.129   7.701  -9.315
   98    HA   ILE  29           HA       ILE  29   1.051   6.947 -10.603
   99    HB   ILE  29           HB       ILE  29  -1.274   5.346  -9.465
  100   1HG1  ILE  29           HG12     ILE  29  -0.165   5.509  -7.469
  101   2HG1  ILE  29           HG11     ILE  29   1.178   4.609  -8.138
  102   1HG2  ILE  29           HG22     ILE  29  -0.563   3.751 -11.165
  103   2HG2  ILE  29           HG21     ILE  29   1.107   3.767 -10.525
  104   3HG2  ILE  29           HG23     ILE  29  -0.217   3.183  -9.518
  105   1HD1  ILE  29           HD12     ILE  29   2.334   6.770  -8.856
  106   2HD1  ILE  29           HD11     ILE  29   0.970   7.668  -8.191
  107   3HD1  ILE  29           HD13     ILE  29   2.011   6.661  -7.133
  108    H    THR  30           H        THR  30   1.872   5.389 -12.014
  109    HA   THR  30           HA       THR  30   0.521   5.697 -14.620
  110    HB   THR  30           HB       THR  30   2.620   5.878 -15.432
  111    HG1  THR  30           HG1      THR  30   3.708   3.811 -15.719
  112   1HG2  THR  30           HG23     THR  30   3.617   6.407 -13.187
  113   2HG2  THR  30           HG22     THR  30   3.817   4.634 -12.932
  114   3HG2  THR  30           HG21     THR  30   4.716   5.464 -14.222
  115    H    ASN  31           H        ASN  31   1.925   2.867 -12.658
  116    HA   ASN  31           HA       ASN  31  -0.402   1.310 -13.738
  117   1HB   ASN  31           HB2      ASN  31   2.566   0.740 -13.935
  118   2HB   ASN  31           HB1      ASN  31   1.477  -0.634 -13.612
  119   1HD2  ASN  31           HD22     ASN  31   1.174   1.374 -17.246
  120   2HD2  ASN  31           HD21     ASN  31   1.798   2.234 -15.890
  121    H    LEU  32           H        LEU  32  -1.257  -0.363 -12.440
  122    HA   LEU  32           HA       LEU  32  -0.101  -0.778  -9.764
  123   1HB   LEU  32           HB2      LEU  32  -1.796   1.347 -10.050
  124   2HB   LEU  32           HB1      LEU  32  -3.050   0.104  -9.905
  125    HG   LEU  32           HG       LEU  32  -0.791   0.509  -7.859
  126   1HD1  LEU  32           HD12     LEU  32  -2.012   2.665  -7.970
  127   2HD1  LEU  32           HD11     LEU  32  -3.562   1.814  -7.732
  128   3HD1  LEU  32           HD13     LEU  32  -2.327   1.820  -6.438
  129   1HD2  LEU  32           HD21     LEU  32  -2.179  -1.699  -7.794
  130   2HD2  LEU  32           HD23     LEU  32  -2.194  -0.742  -6.289
  131   3HD2  LEU  32           HD22     LEU  32  -3.592  -0.695  -7.401
  132    H    ASP  33           H        ASP  33  -0.700  -3.022  -9.121
  133    HA   ASP  33           HA       ASP  33  -2.587  -4.412 -11.026
  134   1HB   ASP  33           HB2      ASP  33  -0.009  -5.456  -9.815
  135   2HB   ASP  33           HB1      ASP  33  -1.221  -6.480 -10.599
  136    H    ALA  34           H        ALA  34  -4.092  -3.489  -9.225
  137    HA   ALA  34           HA       ALA  34  -3.885  -4.540  -6.591
  138   1HB   ALA  34           HB3      ALA  34  -5.362  -2.650  -7.098
  139   2HB   ALA  34           HB2      ALA  34  -6.419  -3.712  -8.076
  140   3HB   ALA  34           HB1      ALA  34  -6.271  -3.973  -6.311
  141    H    CYS  35           H        CYS  35  -4.863  -6.500  -5.578
  142    HA   CYS  35           HA       CYS  35  -6.504  -8.202  -7.227
  143   1HB   CYS  35           HB2      CYS  35  -3.751  -8.468  -7.801
  144   2HB   CYS  35           HB1      CYS  35  -4.014  -9.755  -6.591
  145    HG   CYS  35           HG       CYS  35  -4.405 -10.615  -8.958
  146    H    ILE  36           H        ILE  36  -6.745 -10.522  -6.146
  147    HA   ILE  36           HA       ILE  36  -8.147 -10.158  -3.990
  148    HB   ILE  36           HB       ILE  36  -7.913 -12.447  -3.153
  149   1HG1  ILE  36           HG12     ILE  36  -5.688 -13.280  -3.384
  150   2HG1  ILE  36           HG11     ILE  36  -6.663 -14.186  -4.511
  151   1HG2  ILE  36           HG22     ILE  36  -9.462 -11.858  -5.021
  152   2HG2  ILE  36           HG21     ILE  36  -8.229 -12.364  -6.209
  153   3HG2  ILE  36           HG23     ILE  36  -8.918 -13.548  -5.073
  154   1HD1  ILE  36           HD12     ILE  36  -5.824 -12.864  -6.457
  155   2HD1  ILE  36           HD11     ILE  36  -4.808 -11.872  -5.382
  156   3HD1  ILE  36           HD13     ILE  36  -4.495 -13.611  -5.531
  157    H    THR  37           H        THR  37  -4.719 -11.302  -3.192
  158    HA   THR  37           HA       THR  37  -4.969  -9.532  -0.839
  159    HB   THR  37           HB       THR  37  -3.724 -11.301   0.497
  160    HG1  THR  37           HG1      THR  37  -3.170 -12.704  -1.319
  161   1HG2  THR  37           HG22     THR  37  -6.570 -11.992  -0.432
  162   2HG2  THR  37           HG21     THR  37  -5.761 -12.664   1.013
  163   3HG2  THR  37           HG23     THR  37  -6.130 -10.918   0.933
  164    H    ARG  38           H        ARG  38  -3.927  -8.904  -3.420
  165    HA   ARG  38           HA       ARG  38  -1.064  -8.605  -2.802
  166   1HB   ARG  38           HB2      ARG  38  -2.099  -9.965  -5.372
  167   2HB   ARG  38           HB1      ARG  38  -0.479  -9.322  -5.116
  168   1HG   ARG  38           HG2      ARG  38   0.125 -11.417  -4.531
  169   2HG   ARG  38           HG1      ARG  38  -0.751 -11.153  -2.995
  170   1HD   ARG  38           HD2      ARG  38  -2.529 -12.619  -3.699
  171   2HD   ARG  38           HD1      ARG  38  -2.167 -12.307  -5.404
  172    HE   ARG  38           HE       ARG  38  -0.661 -14.004  -5.483
  173   1HH1  ARG  38           HH11     ARG  38  -0.980 -13.122  -1.986
  174   2HH1  ARG  38           HH12     ARG  38   0.160 -14.362  -1.511
  175   1HH2  ARG  38           HH21     ARG  38   0.771 -15.553  -4.740
  176   2HH2  ARG  38           HH22     ARG  38   1.111 -15.717  -3.022
  177    H    LEU  39           H        LEU  39  -0.754  -6.271  -3.253
  178    HA   LEU  39           HA       LEU  39  -1.952  -5.434  -5.838
  179   1HB   LEU  39           HB2      LEU  39  -2.542  -3.227  -5.093
  180   2HB   LEU  39           HB1      LEU  39  -3.245  -4.416  -4.002
  181    HG   LEU  39           HG       LEU  39  -1.077  -3.815  -2.504
  182   1HD1  LEU  39           HD12     LEU  39  -0.182  -2.210  -4.347
  183   2HD1  LEU  39           HD11     LEU  39  -1.510  -1.118  -3.936
  184   3HD1  LEU  39           HD13     LEU  39  -0.298  -1.523  -2.698
  185   1HD2  LEU  39           HD21     LEU  39  -3.488  -3.351  -1.796
  186   2HD2  LEU  39           HD23     LEU  39  -2.418  -2.014  -1.345
  187   3HD2  LEU  39           HD22     LEU  39  -3.490  -1.875  -2.762
  188    H    ARG  40           H        ARG  40  -0.640  -3.271  -6.604
  189    HA   ARG  40           HA       ARG  40   2.203  -3.599  -5.968
  190   1HB   ARG  40           HB2      ARG  40   1.366  -3.852  -8.904
  191   2HB   ARG  40           HB1      ARG  40   3.004  -3.834  -8.281
  192   1HG   ARG  40           HG2      ARG  40   2.535  -6.047  -7.132
  193   2HG   ARG  40           HG1      ARG  40   0.973  -6.116  -7.867
  194   1HD   ARG  40           HD2      ARG  40   3.324  -7.230  -8.846
  195   2HD   ARG  40           HD1      ARG  40   1.933  -6.953  -9.858
  196    HE   ARG  40           HE       ARG  40   2.725  -4.731 -10.530
  197   1HH1  ARG  40           HH11     ARG  40   5.245  -7.263  -9.768
  198   2HH1  ARG  40           HH12     ARG  40   6.451  -6.352 -10.646
  199   1HH2  ARG  40           HH21     ARG  40   4.358  -3.724 -11.595
  200   2HH2  ARG  40           HH22     ARG  40   5.966  -4.435 -11.684
  201    H    VAL  41           H        VAL  41   3.484  -1.647  -7.003
  202    HA   VAL  41           HA       VAL  41   1.584   0.385  -8.046
  203    HB   VAL  41           HB       VAL  41   3.366   1.116  -5.694
  204   1HG1  VAL  41           HG11     VAL  41   0.637   2.162  -6.767
  205   2HG1  VAL  41           HG13     VAL  41   1.473   2.865  -5.382
  206   3HG1  VAL  41           HG12     VAL  41   2.235   2.914  -7.009
  207   1HG2  VAL  41           HG21     VAL  41   2.095  -0.774  -4.738
  208   2HG2  VAL  41           HG23     VAL  41   1.630   0.782  -4.024
  209   3HG2  VAL  41           HG22     VAL  41   0.565   0.025  -5.237
  210    H    SER  42           H        SER  42   2.832  -0.281  -9.975
  211    HA   SER  42           HA       SER  42   5.663   0.237  -9.976
  212   1HB   SER  42           HB2      SER  42   5.002  -1.353 -11.609
  213   2HB   SER  42           HB1      SER  42   3.640  -0.352 -12.171
  214    HG   SER  42           HG       SER  42   5.458  -0.191 -13.658
  215    H    VAL  43           H        VAL  43   6.609   2.281  -9.741
  216    HA   VAL  43           HA       VAL  43   5.617   4.344 -11.597
  217    HB   VAL  43           HB       VAL  43   5.251   6.002  -9.852
  218   1HG1  VAL  43           HG11     VAL  43   3.926   3.351  -8.946
  219   2HG1  VAL  43           HG13     VAL  43   3.500   4.956  -8.405
  220   3HG1  VAL  43           HG12     VAL  43   3.295   4.534 -10.129
  221   1HG2  VAL  43           HG22     VAL  43   6.346   3.964  -7.821
  222   2HG2  VAL  43           HG21     VAL  43   7.165   5.452  -8.331
  223   3HG2  VAL  43           HG23     VAL  43   5.654   5.578  -7.444
  224    H    ALA  44           H        ALA  44   6.991   6.322 -11.634
  225    HA   ALA  44           HA       ALA  44   9.832   5.624 -11.352
  226   1HB   ALA  44           HB3      ALA  44   9.027   7.132 -13.194
  227   2HB   ALA  44           HB2      ALA  44   8.484   8.330 -11.980
  228   3HB   ALA  44           HB1      ALA  44  10.224   7.949 -12.142
  229    H    ASP  45           H        ASP  45   7.339   7.635  -9.617
  230    HA   ASP  45           HA       ASP  45   8.757   9.247  -8.075
  231   1HB   ASP  45           HB2      ASP  45   6.288   8.954  -8.026
  232   2HB   ASP  45           HB1      ASP  45   6.452   7.667  -6.838
  233    H    VAL  46           H        VAL  46   8.024   6.392  -5.876
  234    HA   VAL  46           HA       VAL  46   9.373   5.769  -4.156
  235    HB   VAL  46           HB       VAL  46  10.736   4.054  -4.792
  236   1HG1  VAL  46           HG12     VAL  46   8.546   3.960  -6.113
  237   2HG1  VAL  46           HG11     VAL  46   9.421   4.668  -7.509
  238   3HG1  VAL  46           HG13     VAL  46   9.875   3.057  -6.886
  239   1HG2  VAL  46           HG22     VAL  46  11.839   5.700  -7.135
  240   2HG2  VAL  46           HG21     VAL  46  12.712   5.155  -5.668
  241   3HG2  VAL  46           HG23     VAL  46  12.187   3.966  -6.868
  242    H    SER  47           H        SER  47   9.994   8.764  -4.886
  243    HA   SER  47           HA       SER  47  12.800   8.783  -3.780
  244   1HB   SER  47           HB2      SER  47  12.536   9.668  -6.100
  245   2HB   SER  47           HB1      SER  47  11.273  10.791  -5.537
  246    HG   SER  47           HG       SER  47  14.013  10.855  -4.653
  247    H    LYS  48           H        LYS  48   9.782   8.860  -2.481
  248    HA   LYS  48           HA       LYS  48  10.561  10.403  -0.289
  249   1HB   LYS  48           HB2      LYS  48   8.949  12.296  -0.311
  250   2HB   LYS  48           HB1      LYS  48  10.340  12.510  -1.391
  251   1HG   LYS  48           HG2      LYS  48   7.455  11.839  -2.307
  252   2HG   LYS  48           HG1      LYS  48   8.275  13.401  -2.323
  253   1HD   LYS  48           HD2      LYS  48  10.130  12.210  -3.810
  254   2HD   LYS  48           HD1      LYS  48   8.882  10.948  -4.046
  255   1HE   LYS  48           HE2      LYS  48   8.817  12.488  -5.915
  256   2HE   LYS  48           HE1      LYS  48   7.346  12.833  -4.944
  257   1HZ   LYS  48           HZ1      LYS  48   9.951  14.414  -4.863
  258   2HZ   LYS  48           HZ3      LYS  48   8.565  14.846  -5.800
  259   3HZ   LYS  48           HZ2      LYS  48   8.458  14.873  -4.085
  260    H    VAL  49           H        VAL  49   7.574   9.526  -2.227
  261    HA   VAL  49           HA       VAL  49   5.718   8.986  -0.426
  262    HB   VAL  49           HB       VAL  49   5.431   8.124  -2.643
  263   1HG1  VAL  49           HG11     VAL  49   7.993   6.523  -2.172
  264   2HG1  VAL  49           HG13     VAL  49   6.813   6.020  -3.425
  265   3HG1  VAL  49           HG12     VAL  49   7.612   7.596  -3.506
  266   1HG2  VAL  49           HG21     VAL  49   4.233   6.802  -0.877
  267   2HG2  VAL  49           HG23     VAL  49   4.673   5.813  -2.303
  268   3HG2  VAL  49           HG22     VAL  49   5.588   5.659  -0.779
  269    H    ASP  50           H        ASP  50   5.315   7.631   1.452
  270    HA   ASP  50           HA       ASP  50   7.823   6.719   2.725
  271   1HB   ASP  50           HB2      ASP  50   6.109   8.152   3.876
  272   2HB   ASP  50           HB1      ASP  50   4.953   6.798   3.815
  273    H    GLN  51           H        GLN  51   7.908   4.997   0.838
  274    HA   GLN  51           HA       GLN  51   5.860   2.949   0.811
  275   1HB   GLN  51           HB2      GLN  51   8.751   2.529  -0.078
  276   2HB   GLN  51           HB1      GLN  51   7.331   1.549  -0.547
  277   1HG   GLN  51           HG2      GLN  51   6.336   3.591  -1.658
  278   2HG   GLN  51           HG1      GLN  51   7.835   4.479  -1.309
  279   1HE2  GLN  51           HE22     GLN  51   9.579   2.217  -3.799
  280   2HE2  GLN  51           HE21     GLN  51   9.736   2.216  -2.092
  281    H    ALA  52           H        ALA  52   9.124   3.315   2.359
  282    HA   ALA  52           HA       ALA  52   9.406   0.887   3.601
  283   1HB   ALA  52           HB3      ALA  52  11.051   2.770   3.857
  284   2HB   ALA  52           HB2      ALA  52   9.882   3.665   4.872
  285   3HB   ALA  52           HB1      ALA  52  10.585   2.126   5.457
  286    H    GLY  53           H        GLY  53   7.045   3.498   4.537
  287   1HA   GLY  53           HA1      GLY  53   6.108   1.839   6.827
  288   2HA   GLY  53           HA2      GLY  53   5.424   3.388   6.277
  289    H    LEU  54           H        LEU  54   5.055   2.724   3.428
  290    HA   LEU  54           HA       LEU  54   2.451   1.682   3.892
  291   1HB   LEU  54           HB2      LEU  54   3.479   3.081   1.818
  292   2HB   LEU  54           HB1      LEU  54   3.503   1.515   1.020
  293    HG   LEU  54           HG       LEU  54   0.863   2.370   2.402
  294   1HD1  LEU  54           HD11     LEU  54   2.004   3.388  -0.062
  295   2HD1  LEU  54           HD13     LEU  54   0.317   3.760   0.353
  296   3HD1  LEU  54           HD12     LEU  54   1.684   4.500   1.237
  297   1HD2  LEU  54           HD22     LEU  54   1.409   1.041  -0.343
  298   2HD2  LEU  54           HD21     LEU  54   0.944   0.135   1.116
  299   3HD2  LEU  54           HD23     LEU  54  -0.177   1.316   0.410
  300    H    LYS  55           H        LYS  55   5.540   0.135   3.289
  301    HA   LYS  55           HA       LYS  55   4.378  -2.118   2.055
  302   1HB   LYS  55           HB2      LYS  55   6.642  -3.218   2.329
  303   2HB   LYS  55           HB1      LYS  55   6.630  -1.558   1.618
  304   1HG   LYS  55           HG2      LYS  55   8.571  -1.753   2.816
  305   2HG   LYS  55           HG1      LYS  55   7.568  -0.654   3.713
  306   1HD   LYS  55           HD2      LYS  55   7.612  -1.966   5.605
  307   2HD   LYS  55           HD1      LYS  55   7.316  -3.479   4.698
  308   1HE   LYS  55           HE2      LYS  55  10.042  -2.029   4.745
  309   2HE   LYS  55           HE1      LYS  55   9.581  -3.261   5.942
  310   1HZ   LYS  55           HZ1      LYS  55   9.613  -3.834   2.951
  311   2HZ   LYS  55           HZ3      LYS  55  10.895  -4.206   4.052
  312   3HZ   LYS  55           HZ2      LYS  55   9.341  -4.948   4.238
  313    H    LYS  56           H        LYS  56   5.345  -1.473   5.362
  314    HA   LYS  56           HA       LYS  56   4.356  -4.161   6.216
  315   1HB   LYS  56           HB2      LYS  56   5.245  -3.645   8.428
  316   2HB   LYS  56           HB1      LYS  56   6.470  -3.445   7.161
  317   1HG   LYS  56           HG2      LYS  56   5.983  -0.845   7.318
  318   2HG   LYS  56           HG1      LYS  56   5.017  -1.236   8.752
  319   1HD   LYS  56           HD2      LYS  56   8.015  -1.911   8.326
  320   2HD   LYS  56           HD1      LYS  56   7.413  -0.420   9.094
  321   1HE   LYS  56           HE2      LYS  56   6.254  -1.790  10.866
  322   2HE   LYS  56           HE1      LYS  56   6.968  -3.271  10.162
  323   1HZ   LYS  56           HZ1      LYS  56   8.534  -0.892  11.237
  324   2HZ   LYS  56           HZ3      LYS  56   8.309  -2.410  12.047
  325   3HZ   LYS  56           HZ2      LYS  56   9.223  -2.345  10.564
  326    H    LEU  57           H        LEU  57   3.600  -0.655   6.689
  327    HA   LEU  57           HA       LEU  57   1.324  -1.375   8.434
  328   1HB   LEU  57           HB2      LEU  57   2.970   0.290   9.071
  329   2HB   LEU  57           HB1      LEU  57   2.654   1.281   7.631
  330    HG   LEU  57           HG       LEU  57   1.702   2.036   9.910
  331   1HD1  LEU  57           HD11     LEU  57  -0.028   1.970   7.388
  332   2HD1  LEU  57           HD13     LEU  57  -0.298   3.022   8.831
  333   3HD1  LEU  57           HD12     LEU  57   1.176   3.208   7.861
  334   1HD2  LEU  57           HD21     LEU  57   0.629  -0.163  10.562
  335   2HD2  LEU  57           HD23     LEU  57  -0.485   1.237  10.606
  336   3HD2  LEU  57           HD22     LEU  57  -0.584   0.077   9.263
  337    H    GLY  58           H        GLY  58   1.905  -0.247   5.050
  338   1HA   GLY  58           HA1      GLY  58  -1.021   0.208   4.682
  339   2HA   GLY  58           HA2      GLY  58   0.251   0.482   3.496
  340    H    ALA  59           H        ALA  59   1.633  -2.077   3.600
  341    HA   ALA  59           HA       ALA  59  -0.500  -3.878   2.507
  342   1HB   ALA  59           HB3      ALA  59   0.849  -2.692   0.729
  343   2HB   ALA  59           HB2      ALA  59   2.340  -3.349   1.471
  344   3HB   ALA  59           HB1      ALA  59   1.161  -4.449   0.706
  345    H    ALA  60           H        ALA  60   1.789  -6.061   2.267
  346    HA   ALA  60           HA       ALA  60   3.114  -5.976   4.833
  347   1HB   ALA  60           HB3      ALA  60   0.939  -6.609   5.740
  348   2HB   ALA  60           HB2      ALA  60   0.822  -8.059   4.716
  349   3HB   ALA  60           HB1      ALA  60   2.177  -7.904   5.850
  350    H    GLY  61           H        GLY  61   4.379  -5.967   2.569
  351   1HA   GLY  61           HA1      GLY  61   6.301  -7.702   2.516
  352   2HA   GLY  61           HA2      GLY  61   5.062  -8.813   1.889
  353    H    VAL  62           H        VAL  62   6.709  -5.607   1.174
  354    HA   VAL  62           HA       VAL  62   5.805  -5.979  -1.682
  355    HB   VAL  62           HB       VAL  62   5.549  -3.597  -1.889
  356   1HG1  VAL  62           HG12     VAL  62   3.875  -4.550  -0.187
  357   2HG1  VAL  62           HG11     VAL  62   4.955  -3.993   1.042
  358   3HG1  VAL  62           HG13     VAL  62   4.219  -2.807  -0.102
  359   1HG2  VAL  62           HG22     VAL  62   7.632  -3.170   0.216
  360   2HG2  VAL  62           HG21     VAL  62   7.732  -2.904  -1.529
  361   3HG2  VAL  62           HG23     VAL  62   6.624  -1.902  -0.599
  362    H    VAL  63           H        VAL  63   7.392  -4.839  -3.243
  363    HA   VAL  63           HA       VAL  63  10.157  -5.043  -2.246
  364    HB   VAL  63           HB       VAL  63  10.706  -6.997  -3.290
  365   1HG1  VAL  63           HG11     VAL  63   7.724  -7.195  -4.054
  366   2HG1  VAL  63           HG13     VAL  63   8.890  -8.530  -4.191
  367   3HG1  VAL  63           HG12     VAL  63   8.497  -7.852  -2.595
  368   1HG2  VAL  63           HG21     VAL  63  11.082  -5.721  -5.392
  369   2HG2  VAL  63           HG23     VAL  63  10.510  -7.373  -5.710
  370   3HG2  VAL  63           HG22     VAL  63   9.381  -6.005  -5.871
  371    H    VAL  64           H        VAL  64  11.543  -3.525  -3.343
  372    HA   VAL  64           HA       VAL  64  10.005  -1.771  -5.236
  373    HB   VAL  64           HB       VAL  64  12.344  -1.160  -3.383
  374   1HG1  VAL  64           HG11     VAL  64  10.688   0.683  -5.227
  375   2HG1  VAL  64           HG13     VAL  64  11.891   1.238  -4.027
  376   3HG1  VAL  64           HG12     VAL  64  12.404   0.257  -5.428
  377   1HG2  VAL  64           HG21     VAL  64  10.137  -1.594  -2.185
  378   2HG2  VAL  64           HG23     VAL  64  10.716   0.075  -1.991
  379   3HG2  VAL  64           HG22     VAL  64   9.389  -0.283  -3.143
  380    H    ALA  65           H        ALA  65  10.869  -1.676  -7.378
  381    HA   ALA  65           HA       ALA  65  13.728  -2.517  -7.770
  382   1HB   ALA  65           HB2      ALA  65  11.245  -3.708  -9.158
  383   2HB   ALA  65           HB1      ALA  65  12.946  -4.052  -9.594
  384   3HB   ALA  65           HB3      ALA  65  12.306  -4.559  -8.002
  385    H    GLY  66           H        GLY  66  14.031  -0.127  -8.149
  386   1HA   GLY  66           HA1      GLY  66  12.777   1.705  -9.485
  387   2HA   GLY  66           HA2      GLY  66  14.457   1.375  -9.954
  388    H    SER  67           H        SER  67  11.249   1.566 -11.231
  389    HA   SER  67           HA       SER  67  10.996   1.149 -13.664
  390   1HB   SER  67           HB2      SER  67  12.127  -1.643 -12.993
  391   2HB   SER  67           HB1      SER  67  11.246  -1.216 -14.478
  392    HG   SER  67           HG       SER  67  12.983   0.317 -14.946
  393    H    GLY  68           H        GLY  68  10.393  -0.705 -10.629
  394   1HA   GLY  68           HA1      GLY  68   7.579  -0.465 -11.067
  395   2HA   GLY  68           HA2      GLY  68   8.123  -2.137 -11.396
  396    H    VAL  69           H        VAL  69   6.353  -1.739  -9.203
  397    HA   VAL  69           HA       VAL  69   8.165  -2.416  -6.959
  398    HB   VAL  69           HB       VAL  69   5.943  -0.329  -6.665
  399   1HG1  VAL  69           HG11     VAL  69   7.807  -1.570  -4.561
  400   2HG1  VAL  69           HG13     VAL  69   6.778  -0.177  -4.288
  401   3HG1  VAL  69           HG12     VAL  69   6.042  -1.746  -4.686
  402   1HG2  VAL  69           HG22     VAL  69   8.996  -0.045  -6.755
  403   2HG2  VAL  69           HG21     VAL  69   7.760   0.840  -7.681
  404   3HG2  VAL  69           HG23     VAL  69   7.993   1.165  -5.943
  405    H    GLN  70           H        GLN  70   7.225  -4.265  -5.918
  406    HA   GLN  70           HA       GLN  70   4.435  -4.917  -6.800
  407   1HB   GLN  70           HB2      GLN  70   5.848  -6.643  -7.540
  408   2HB   GLN  70           HB1      GLN  70   6.891  -6.564  -6.114
  409   1HG   GLN  70           HG2      GLN  70   5.102  -7.500  -4.670
  410   2HG   GLN  70           HG1      GLN  70   4.004  -7.574  -6.078
  411   1HE2  GLN  70           HE22     GLN  70   6.642 -10.630  -5.554
  412   2HE2  GLN  70           HE21     GLN  70   6.416  -9.443  -4.323
  413    H    ALA  71           H        ALA  71   2.870  -5.663  -4.967
  414    HA   ALA  71           HA       ALA  71   3.857  -4.899  -2.357
  415   1HB   ALA  71           HB3      ALA  71   2.879  -2.784  -3.247
  416   2HB   ALA  71           HB2      ALA  71   1.362  -3.667  -3.573
  417   3HB   ALA  71           HB1      ALA  71   1.894  -3.433  -1.893
  418    H    ILE  72           H        ILE  72   3.623  -6.924  -1.311
  419    HA   ILE  72           HA       ILE  72   0.990  -8.213  -1.834
  420    HB   ILE  72           HB       ILE  72   3.831  -9.208  -1.934
  421   1HG1  ILE  72           HG12     ILE  72   2.555 -11.191  -3.108
  422   2HG1  ILE  72           HG11     ILE  72   1.157 -10.128  -2.912
  423   1HG2  ILE  72           HG22     ILE  72   3.282 -10.102   0.353
  424   2HG2  ILE  72           HG21     ILE  72   1.891 -10.980  -0.363
  425   3HG2  ILE  72           HG23     ILE  72   3.555 -11.354  -0.876
  426   1HD1  ILE  72           HD12     ILE  72   2.390  -8.309  -4.240
  427   2HD1  ILE  72           HD11     ILE  72   3.713  -9.515  -4.413
  428   3HD1  ILE  72           HD13     ILE  72   2.131  -9.817  -5.174
  429    H    PHE  73           H        PHE  73  -0.027  -9.464  -0.118
  430    HA   PHE  73           HA       PHE  73   0.920  -8.507   2.543
  431   1HB   PHE  73           HB2      PHE  73  -1.900  -9.390   2.408
  432   2HB   PHE  73           HB1      PHE  73  -1.218  -8.008   3.270
  433    HD1  PHE  73           HD1      PHE  73  -0.417  -6.030   1.720
  434    HD2  PHE  73           HD2      PHE  73  -3.312  -8.918   0.592
  435    HE1  PHE  73           HE1      PHE  73  -1.128  -4.554  -0.175
  436    HE2  PHE  73           HE2      PHE  73  -4.126  -7.412  -1.230
  437    HZ   PHE  73           HZ       PHE  73  -2.795  -5.467  -1.827
  438    H    GLY  74           H        GLY  74  -1.088 -11.232   1.036
  439   1HA   GLY  74           HA1      GLY  74  -0.506 -13.523   1.206
  440   2HA   GLY  74           HA2      GLY  74   0.709 -13.141   2.433
  441    H    THR  75           H        THR  75  -2.910 -13.083   1.883
  442    HA   THR  75           HA       THR  75  -4.663 -13.489   3.285
  443    HB   THR  75           HB       THR  75  -2.624 -15.432   4.409
  444    HG1  THR  75           HG1      THR  75  -4.225 -16.804   3.299
  445   1HG2  THR  75           HG22     THR  75  -5.514 -14.940   5.395
  446   2HG2  THR  75           HG21     THR  75  -4.569 -16.423   5.721
  447   3HG2  THR  75           HG23     THR  75  -4.016 -14.864   6.377
  448    H    LYS  76           H        LYS  76  -1.887 -13.094   5.710
  449    HA   LYS  76           HA       LYS  76  -3.417 -11.906   7.641
  450   1HB   LYS  76           HB2      LYS  76  -1.531 -10.627   8.426
  451   2HB   LYS  76           HB1      LYS  76  -0.951 -12.219   7.885
  452   1HG   LYS  76           HG2      LYS  76  -0.284 -11.108   5.658
  453   2HG   LYS  76           HG1      LYS  76  -0.681  -9.527   6.344
  454   1HD   LYS  76           HD2      LYS  76   1.404 -11.511   7.424
  455   2HD   LYS  76           HD1      LYS  76   1.776 -10.094   6.432
  456   1HE   LYS  76           HE2      LYS  76   0.586 -10.117   9.293
  457   2HE   LYS  76           HE1      LYS  76   2.277  -9.794   8.886
  458   1HZ   LYS  76           HZ1      LYS  76   0.072  -7.960   7.915
  459   2HZ   LYS  76           HZ3      LYS  76   0.818  -7.798   9.464
  460   3HZ   LYS  76           HZ2      LYS  76   1.781  -7.658   8.061
  461    H    SER  77           H        SER  77  -2.804 -10.488   4.390
  462    HA   SER  77           HA       SER  77  -3.412  -7.957   4.485
  463   1HB   SER  77           HB2      SER  77  -4.156  -9.707   2.539
  464   2HB   SER  77           HB1      SER  77  -5.762  -9.461   3.195
  465    HG   SER  77           HG       SER  77  -5.295  -7.738   1.672
  466    H    ASP  78           H        ASP  78  -5.986 -10.479   5.358
  467    HA   ASP  78           HA       ASP  78  -7.976  -8.632   5.900
  468   1HB   ASP  78           HB2      ASP  78  -7.464 -11.269   7.388
  469   2HB   ASP  78           HB1      ASP  78  -8.977 -10.318   7.457
  470    H    ASN  79           H        ASN  79  -5.540  -9.875   8.378
  471    HA   ASN  79           HA       ASN  79  -6.501  -8.357  10.529
  472   1HB   ASN  79           HB2      ASN  79  -4.635  -9.977  10.763
  473   2HB   ASN  79           HB1      ASN  79  -3.553  -8.936   9.815
  474   1HD2  ASN  79           HD22     ASN  79  -3.032  -6.547  12.481
  475   2HD2  ASN  79           HD21     ASN  79  -2.943  -6.736  10.768
  476    H    LEU  80           H        LEU  80  -4.175  -7.390   7.958
  477    HA   LEU  80           HA       LEU  80  -3.873  -4.661   8.867
  478   1HB   LEU  80           HB2      LEU  80  -2.162  -5.291   7.371
  479   2HB   LEU  80           HB1      LEU  80  -3.246  -6.212   6.339
  480    HG   LEU  80           HG       LEU  80  -4.261  -3.975   5.519
  481   1HD1  LEU  80           HD12     LEU  80  -3.104  -2.530   7.299
  482   2HD1  LEU  80           HD11     LEU  80  -1.531  -2.965   6.564
  483   3HD1  LEU  80           HD13     LEU  80  -2.720  -2.014   5.628
  484   1HD2  LEU  80           HD21     LEU  80  -2.914  -5.527   4.126
  485   2HD2  LEU  80           HD23     LEU  80  -2.603  -3.829   3.759
  486   3HD2  LEU  80           HD22     LEU  80  -1.420  -4.764   4.738
  487    H    LYS  81           H        LYS  81  -6.000  -6.064   6.257
  488    HA   LYS  81           HA       LYS  81  -7.003  -3.640   5.466
  489   1HB   LYS  81           HB2      LYS  81  -7.131  -5.857   4.257
  490   2HB   LYS  81           HB1      LYS  81  -8.543  -6.281   5.240
  491   1HG   LYS  81           HG2      LYS  81  -8.748  -3.584   3.855
  492   2HG   LYS  81           HG1      LYS  81  -8.508  -4.936   2.738
  493   1HD   LYS  81           HD2      LYS  81 -10.866  -4.563   2.906
  494   2HD   LYS  81           HD1      LYS  81 -10.501  -6.133   3.668
  495   1HE   LYS  81           HE2      LYS  81 -10.691  -5.081   5.925
  496   2HE   LYS  81           HE1      LYS  81 -10.926  -3.472   5.160
  497   1HZ   LYS  81           HZ1      LYS  81 -12.791  -5.840   4.858
  498   2HZ   LYS  81           HZ3      LYS  81 -13.052  -4.471   5.900
  499   3HZ   LYS  81           HZ2      LYS  81 -13.028  -4.248   4.181
  500    H    THR  82           H        THR  82  -8.068  -5.809   8.165
  501    HA   THR  82           HA       THR  82 -10.602  -4.472   8.602
  502    HB   THR  82           HB       THR  82 -10.367  -5.516  10.939
  503    HG1  THR  82           HG1      THR  82  -8.419  -6.813  11.203
  504   1HG2  THR  82           HG22     THR  82 -10.030  -7.266   8.408
  505   2HG2  THR  82           HG21     THR  82 -10.271  -7.970  10.030
  506   3HG2  THR  82           HG23     THR  82 -11.516  -6.901   9.318
  507    H    GLU  83           H        GLU  83  -7.257  -4.216  10.124
  508    HA   GLU  83           HA       GLU  83  -8.026  -2.065  11.797
  509   1HB   GLU  83           HB2      GLU  83  -5.833  -1.863  12.480
  510   2HB   GLU  83           HB1      GLU  83  -5.726  -3.470  11.737
  511   1HG   GLU  83           HG2      GLU  83  -4.823  -2.212   9.602
  512   2HG   GLU  83           HG1      GLU  83  -4.852  -0.747  10.586
  513    H    MET  84           H        MET  84  -7.065  -2.219   8.308
  514    HA   MET  84           HA       MET  84  -6.804   0.558   7.968
  515   1HB   MET  84           HB2      MET  84  -7.718  -1.511   5.892
  516   2HB   MET  84           HB1      MET  84  -7.465   0.183   5.610
  517   1HG   MET  84           HG2      MET  84  -4.996  -0.255   6.659
  518   2HG   MET  84           HG1      MET  84  -5.368  -1.956   6.309
  519   1HE   MET  84           HE2      MET  84  -6.079   1.671   4.819
  520   2HE   MET  84           HE1      MET  84  -4.314   1.526   4.801
  521   3HE   MET  84           HE3      MET  84  -5.262   1.485   3.268
  522    H    ASP  85           H        ASP  85  -9.717  -1.622   7.386
  523    HA   ASP  85           HA       ASP  85 -11.463   0.203   6.371
  524   1HB   ASP  85           HB2      ASP  85 -12.237  -2.058   6.731
  525   2HB   ASP  85           HB1      ASP  85 -12.052  -1.937   8.495
  526    H    GLU  86           H        GLU  86 -10.957  -0.349   9.947
  527    HA   GLU  86           HA       GLU  86 -12.465   1.881  10.793
  528   1HB   GLU  86           HB2      GLU  86 -10.072   0.377  11.982
  529   2HB   GLU  86           HB1      GLU  86 -10.560   1.900  12.736
  530   1HG   GLU  86           HG2      GLU  86 -12.845  -0.046  12.202
  531   2HG   GLU  86           HG1      GLU  86 -11.673  -0.526  13.446
  532    H    TYR  87           H        TYR  87  -8.842   1.787  10.100
  533    HA   TYR  87           HA       TYR  87  -8.420   4.446  10.693
  534   1HB   TYR  87           HB1      TYR  87  -7.108   2.631   8.672
  535   2HB   TYR  87           HB2      TYR  87  -6.724   4.304   8.601
  536    HD1  TYR  87           HD2      TYR  87  -6.277   5.450  11.118
  537    HD2  TYR  87           HD1      TYR  87  -5.638   1.338  10.063
  538    HE1  TYR  87           HE2      TYR  87  -4.548   5.272  12.861
  539    HE2  TYR  87           HE1      TYR  87  -3.780   1.205  11.704
  540    HH   TYR  87           HH       TYR  87  -2.595   4.002  13.528
  541    H    ILE  88           H        ILE  88  -9.520   3.245   7.352
  542    HA   ILE  88           HA       ILE  88  -9.342   5.947   6.337
  543    HB   ILE  88           HB       ILE  88 -11.246   3.901   5.157
  544   1HG1  ILE  88           HG12     ILE  88  -8.763   3.887   3.620
  545   2HG1  ILE  88           HG11     ILE  88  -8.292   3.616   5.302
  546   1HG2  ILE  88           HG22     ILE  88 -11.407   6.260   4.325
  547   2HG2  ILE  88           HG21     ILE  88  -9.675   6.231   3.887
  548   3HG2  ILE  88           HG23     ILE  88 -10.831   5.160   3.046
  549   1HD1  ILE  88           HD11     ILE  88 -10.447   2.039   3.725
  550   2HD1  ILE  88           HD13     ILE  88  -8.792   1.468   4.069
  551   3HD1  ILE  88           HD12     ILE  88  -9.949   1.712   5.407
  552    H    ARG  89           H        ARG  89 -12.074   3.943   7.670
  553    HA   ARG  89           HA       ARG  89 -14.020   6.008   7.364
  554   1HB   ARG  89           HB2      ARG  89 -13.834   3.842   9.548
  555   2HB   ARG  89           HB1      ARG  89 -15.259   4.829   9.174
  556   1HG   ARG  89           HG2      ARG  89 -14.443   3.634   6.632
  557   2HG   ARG  89           HG1      ARG  89 -14.335   2.335   7.839
  558   1HD   ARG  89           HD2      ARG  89 -16.717   4.112   7.273
  559   2HD   ARG  89           HD1      ARG  89 -16.600   2.371   6.841
  560    HE   ARG  89           HE       ARG  89 -16.132   2.345   9.573
  561   1HH1  ARG  89           HH11     ARG  89 -18.852   3.557   7.532
  562   2HH1  ARG  89           HH12     ARG  89 -19.978   3.474   8.878
  563   1HH2  ARG  89           HH21     ARG  89 -17.655   2.241  11.206
  564   2HH2  ARG  89           HH22     ARG  89 -19.330   2.711  10.908
  565    H    ASN  90           H        ASN  90 -11.460   5.506   9.834
  566    HA   ASN  90           HA       ASN  90 -12.497   7.538  11.652
  567   1HB   ASN  90           HB2      ASN  90 -11.026   5.692  12.465
  568   2HB   ASN  90           HB1      ASN  90  -9.742   6.233  11.358
  569   1HD2  ASN  90           HD22     ASN  90  -8.313   7.993  14.072
  570   2HD2  ASN  90           HD21     ASN  90  -8.088   6.753  12.902
  571    H    PHE  91           H        PHE  91 -10.497   7.587   8.657
  572    HA   PHE  91           HA       PHE  91  -9.893  10.488   9.216
  573   1HB   PHE  91           HB2      PHE  91  -8.124   8.355   9.369
  574   2HB   PHE  91           HB1      PHE  91  -7.971   8.763   7.653
  575    HD1  PHE  91           HD1      PHE  91  -7.812  10.017  11.173
  576    HD2  PHE  91           HD2      PHE  91  -6.629  10.817   7.108
  577    HE1  PHE  91           HE1      PHE  91  -6.142  11.655  11.983
  578    HE2  PHE  91           HE2      PHE  91  -4.977  12.477   7.923
  579    HZ   PHE  91           HZ       PHE  91  -4.714  12.884  10.361
  580    H    GLY  92           H        GLY  92 -12.244   9.444   7.792
  581   1HA   GLY  92           HA1      GLY  92 -11.589  10.480   5.039
  582   2HA   GLY  92           HA2      GLY  92 -12.431   8.921   5.269
   
  No H/Q in entry =         582
  Start of MODEL   10
    1    H    MET  15           H        MET  15  -2.725   7.818  11.630
    2    HA   MET  15           HA       MET  15  -1.198   8.782   9.296
    3   1HB   MET  15           HB2      MET  15  -0.067   7.341  11.783
    4   2HB   MET  15           HB1      MET  15   0.850   8.103  10.455
    5   1HG   MET  15           HG2      MET  15  -0.573  10.283  11.093
    6   2HG   MET  15           HG1      MET  15  -0.829   9.455  12.651
    7   1HE   MET  15           HE2      MET  15   1.394  11.713  10.554
    8   2HE   MET  15           HE1      MET  15   0.720  12.331  12.101
    9   3HE   MET  15           HE3      MET  15   2.496  12.205  11.878
   10    H    ALA  16           H        ALA  16  -2.134   5.629  10.945
   11    HA   ALA  16           HA       ALA  16  -0.761   4.006   9.164
   12   1HB   ALA  16           HB3      ALA  16  -2.024   3.031  11.069
   13   2HB   ALA  16           HB2      ALA  16  -3.578   3.403  10.293
   14   3HB   ALA  16           HB1      ALA  16  -2.470   2.258   9.532
   15    HA   PRO  17           HA       PRO  17  -4.075   4.427   5.928
   16   1HB   PRO  17           HB2      PRO  17  -5.602   6.920   5.910
   17   2HB   PRO  17           HB1      PRO  17  -6.117   5.264   6.191
   18   1HG   PRO  17           HG2      PRO  17  -5.763   7.475   8.159
   19   2HG   PRO  17           HG1      PRO  17  -6.377   5.854   8.519
   20   1HD   PRO  17           HD2      PRO  17  -3.732   6.879   9.077
   21   2HD   PRO  17           HD1      PRO  17  -4.485   5.371   9.619
   22    H    ALA  18           H        ALA  18  -2.880   7.748   7.053
   23    HA   ALA  18           HA       ALA  18  -2.369   8.870   4.555
   24   1HB   ALA  18           HB3      ALA  18  -1.834  10.036   6.770
   25   2HB   ALA  18           HB2      ALA  18  -0.431   8.939   6.961
   26   3HB   ALA  18           HB1      ALA  18  -0.481  10.095   5.602
   27    H    LEU  19           H        LEU  19  -0.701   6.167   6.325
   28    HA   LEU  19           HA       LEU  19   1.544   6.187   4.624
   29   1HB   LEU  19           HB2      LEU  19   1.200   4.957   6.927
   30   2HB   LEU  19           HB1      LEU  19   0.624   3.613   5.932
   31    HG   LEU  19           HG       LEU  19   2.925   3.157   6.232
   32   1HD1  LEU  19           HD12     LEU  19   2.325   3.080   3.849
   33   2HD1  LEU  19           HD11     LEU  19   3.009   4.718   3.578
   34   3HD1  LEU  19           HD13     LEU  19   4.060   3.396   4.115
   35   1HD2  LEU  19           HD21     LEU  19   3.568   5.257   7.388
   36   2HD2  LEU  19           HD23     LEU  19   4.781   4.693   6.231
   37   3HD2  LEU  19           HD22     LEU  19   3.730   6.082   5.809
   38    H    VAL  20           H        VAL  20  -1.199   3.591   4.492
   39    HA   VAL  20           HA       VAL  20  -0.664   2.640   2.043
   40    HB   VAL  20           HB       VAL  20  -2.482   1.746   3.299
   41   1HG1  VAL  20           HG12     VAL  20  -3.559   3.877   3.891
   42   2HG1  VAL  20           HG11     VAL  20  -4.182   4.119   2.242
   43   3HG1  VAL  20           HG13     VAL  20  -4.762   2.741   3.242
   44   1HG2  VAL  20           HG21     VAL  20  -2.250   1.161   0.852
   45   2HG2  VAL  20           HG23     VAL  20  -3.947   1.104   1.411
   46   3HG2  VAL  20           HG22     VAL  20  -3.380   2.493   0.446
   47    H    ALA  21           H        ALA  21  -2.115   5.950   2.598
   48    HA   ALA  21           HA       ALA  21  -2.724   6.328  -0.181
   49   1HB   ALA  21           HB3      ALA  21  -3.725   7.742   1.613
   50   2HB   ALA  21           HB2      ALA  21  -2.116   8.468   1.940
   51   3HB   ALA  21           HB1      ALA  21  -2.918   8.743   0.360
   52    H    ALA  22           H        ALA  22   0.260   7.152   1.814
   53    HA   ALA  22           HA       ALA  22   1.650   8.648  -0.054
   54   1HB   ALA  22           HB3      ALA  22   2.588   8.033   2.205
   55   2HB   ALA  22           HB2      ALA  22   2.876   6.363   1.616
   56   3HB   ALA  22           HB1      ALA  22   3.754   7.740   0.874
   57    H    PHE  23           H        PHE  23   1.360   5.051  -0.006
   58    HA   PHE  23           HA       PHE  23   2.516   5.061  -2.720
   59   1HB   PHE  23           HB2      PHE  23   3.986   3.821  -1.062
   60   2HB   PHE  23           HB1      PHE  23   2.818   2.482  -1.328
   61    HD1  PHE  23           HD2      PHE  23   4.557   5.029  -3.624
   62    HD2  PHE  23           HD1      PHE  23   3.559   0.891  -2.825
   63    HE1  PHE  23           HE2      PHE  23   6.054   4.318  -5.409
   64    HE2  PHE  23           HE1      PHE  23   4.778   0.243  -4.847
   65    HZ   PHE  23           HZ       PHE  23   6.098   1.967  -6.134
   66    H    GLY  24           H        GLY  24  -0.504   4.925  -1.419
   67   1HA   GLY  24           HA1      GLY  24  -1.403   3.467  -3.841
   68   2HA   GLY  24           HA2      GLY  24  -2.016   2.928  -2.247
   69    H    GLY  25           H        GLY  25  -1.386   6.436  -2.817
   70   1HA   GLY  25           HA1      GLY  25  -4.137   6.913  -3.782
   71   2HA   GLY  25           HA2      GLY  25  -3.708   7.588  -2.179
   72    H    LYS  26           H        LYS  26  -2.002   7.089  -5.344
   73    HA   LYS  26           HA       LYS  26  -1.073   9.963  -5.224
   74   1HB   LYS  26           HB2      LYS  26   0.602   7.850  -6.718
   75   2HB   LYS  26           HB1      LYS  26   1.000   9.475  -6.162
   76   1HG   LYS  26           HG2      LYS  26   2.174   8.110  -4.650
   77   2HG   LYS  26           HG1      LYS  26   0.661   8.434  -3.780
   78   1HD   LYS  26           HD2      LYS  26   0.786   6.151  -3.544
   79   2HD   LYS  26           HD1      LYS  26  -0.074   6.050  -5.066
   80   1HE   LYS  26           HE2      LYS  26   2.978   5.928  -5.024
   81   2HE   LYS  26           HE1      LYS  26   1.932   4.491  -4.834
   82   1HZ   LYS  26           HZ2      LYS  26   0.916   4.936  -6.979
   83   2HZ   LYS  26           HZ1      LYS  26   2.096   6.216  -7.252
   84   3HZ   LYS  26           HZ3      LYS  26   2.567   4.537  -7.001
   85    H    GLU  27           H        GLU  27  -3.347  10.048  -6.295
   86    HA   GLU  27           HA       GLU  27  -4.177   8.649  -8.393
   87   1HB   GLU  27           HB2      GLU  27  -5.779  10.263  -8.630
   88   2HB   GLU  27           HB1      GLU  27  -4.893  11.227  -7.433
   89   1HG   GLU  27           HG2      GLU  27  -3.580  12.291  -9.323
   90   2HG   GLU  27           HG1      GLU  27  -4.599  11.377 -10.484
   91    H    ASN  28           H        ASN  28  -1.418  10.917  -8.756
   92    HA   ASN  28           HA       ASN  28  -1.136  10.903 -11.513
   93   1HB   ASN  28           HB2      ASN  28   0.372  12.105  -9.898
   94   2HB   ASN  28           HB1      ASN  28   1.100  10.547  -9.422
   95   1HD2  ASN  28           HD22     ASN  28   3.535  11.112 -12.014
   96   2HD2  ASN  28           HD21     ASN  28   3.263  10.637 -10.379
   97    H    ILE  29           H        ILE  29  -0.840   8.017  -9.507
   98    HA   ILE  29           HA       ILE  29   0.531   6.159 -10.336
   99    HB   ILE  29           HB       ILE  29  -2.369   6.375  -9.953
  100   1HG1  ILE  29           HG12     ILE  29  -1.929   3.775  -9.303
  101   2HG1  ILE  29           HG11     ILE  29  -0.267   4.391  -9.148
  102   1HG2  ILE  29           HG21     ILE  29  -1.789   4.294 -12.101
  103   2HG2  ILE  29           HG23     ILE  29  -3.285   4.395 -11.140
  104   3HG2  ILE  29           HG22     ILE  29  -2.803   5.748 -12.179
  105   1HD1  ILE  29           HD11     ILE  29  -2.762   5.520  -7.708
  106   2HD1  ILE  29           HD13     ILE  29  -1.517   4.476  -6.981
  107   3HD1  ILE  29           HD12     ILE  29  -1.087   6.111  -7.538
  108    H    THR  30           H        THR  30   1.183   4.648 -12.010
  109    HA   THR  30           HA       THR  30   0.370   5.454 -14.763
  110    HB   THR  30           HB       THR  30   2.363   6.554 -14.948
  111    HG1  THR  30           HG1      THR  30   3.871   4.993 -15.882
  112   1HG2  THR  30           HG23     THR  30   3.104   6.288 -12.563
  113   2HG2  THR  30           HG22     THR  30   3.679   4.644 -13.004
  114   3HG2  THR  30           HG21     THR  30   4.449   6.077 -13.719
  115    H    ASN  31           H        ASN  31   2.258   2.696 -13.063
  116    HA   ASN  31           HA       ASN  31   0.580   0.905 -14.810
  117   1HB   ASN  31           HB2      ASN  31   3.538   1.302 -14.915
  118   2HB   ASN  31           HB1      ASN  31   3.069  -0.388 -14.639
  119   1HD2  ASN  31           HD22     ASN  31   2.038   1.395 -18.236
  120   2HD2  ASN  31           HD21     ASN  31   2.472   2.414 -16.908
  121    H    LEU  32           H        LEU  32  -0.498  -0.609 -13.481
  122    HA   LEU  32           HA       LEU  32   0.918  -1.388 -10.971
  123   1HB   LEU  32           HB2      LEU  32  -2.008  -0.994 -10.587
  124   2HB   LEU  32           HB1      LEU  32  -0.645  -0.532  -9.553
  125    HG   LEU  32           HG       LEU  32  -2.107   1.309 -10.075
  126   1HD1  LEU  32           HD11     LEU  32   0.786   1.586 -11.001
  127   2HD1  LEU  32           HD13     LEU  32  -0.323   2.940 -10.996
  128   3HD1  LEU  32           HD12     LEU  32   0.014   2.028  -9.490
  129   1HD2  LEU  32           HD21     LEU  32  -2.577   0.388 -12.531
  130   2HD2  LEU  32           HD23     LEU  32  -2.724   2.111 -12.142
  131   3HD2  LEU  32           HD22     LEU  32  -1.277   1.545 -12.996
  132    H    ASP  33           H        ASP  33  -0.735  -3.188  -9.875
  133    HA   ASP  33           HA       ASP  33  -2.218  -4.663 -11.923
  134   1HB   ASP  33           HB2      ASP  33   0.616  -5.268 -11.478
  135   2HB   ASP  33           HB1      ASP  33  -0.387  -6.667 -10.996
  136    H    ALA  34           H        ALA  34  -3.897  -4.021 -10.372
  137    HA   ALA  34           HA       ALA  34  -3.738  -4.925  -7.650
  138   1HB   ALA  34           HB3      ALA  34  -5.225  -3.054  -8.293
  139   2HB   ALA  34           HB2      ALA  34  -6.233  -4.170  -9.259
  140   3HB   ALA  34           HB1      ALA  34  -6.149  -4.352  -7.485
  141    H    CYS  35           H        CYS  35  -4.988  -6.767  -6.614
  142    HA   CYS  35           HA       CYS  35  -6.529  -8.540  -8.202
  143   1HB   CYS  35           HB2      CYS  35  -3.625  -8.865  -8.513
  144   2HB   CYS  35           HB1      CYS  35  -4.262 -10.310  -7.690
  145    HG   CYS  35           HG       CYS  35  -4.293 -10.587 -10.219
  146    H    ILE  36           H        ILE  36  -6.599 -10.913  -7.115
  147    HA   ILE  36           HA       ILE  36  -8.085 -10.561  -5.005
  148    HB   ILE  36           HB       ILE  36  -7.812 -12.799  -4.131
  149   1HG1  ILE  36           HG12     ILE  36  -5.506 -13.465  -4.156
  150   2HG1  ILE  36           HG11     ILE  36  -6.381 -14.528  -5.244
  151   1HG2  ILE  36           HG22     ILE  36  -9.209 -12.347  -6.162
  152   2HG2  ILE  36           HG21     ILE  36  -7.866 -12.875  -7.213
  153   3HG2  ILE  36           HG23     ILE  36  -8.608 -14.020  -6.074
  154   1HD1  ILE  36           HD11     ILE  36  -4.630 -12.199  -6.255
  155   2HD1  ILE  36           HD13     ILE  36  -4.180 -13.913  -6.159
  156   3HD1  ILE  36           HD12     ILE  36  -5.496 -13.395  -7.254
  157    H    THR  37           H        THR  37  -4.585 -11.433  -4.146
  158    HA   THR  37           HA       THR  37  -4.974  -9.631  -1.834
  159    HB   THR  37           HB       THR  37  -4.020 -12.546  -1.744
  160    HG1  THR  37           HG1      THR  37  -6.346 -12.263  -1.682
  161   1HG2  THR  37           HG22     THR  37  -4.122 -10.314   0.384
  162   2HG2  THR  37           HG21     THR  37  -4.032 -12.055   0.791
  163   3HG2  THR  37           HG23     THR  37  -2.695 -11.291  -0.107
  164    H    ARG  38           H        ARG  38  -3.857  -9.163  -4.497
  165    HA   ARG  38           HA       ARG  38  -0.938  -8.983  -3.895
  166   1HB   ARG  38           HB2      ARG  38  -1.249 -11.055  -5.135
  167   2HB   ARG  38           HB1      ARG  38  -2.342 -10.272  -6.288
  168   1HG   ARG  38           HG2      ARG  38   0.272  -8.866  -6.259
  169   2HG   ARG  38           HG1      ARG  38   0.552 -10.603  -6.530
  170   1HD   ARG  38           HD2      ARG  38  -1.341  -8.844  -8.146
  171   2HD   ARG  38           HD1      ARG  38   0.265  -9.280  -8.687
  172    HE   ARG  38           HE       ARG  38  -2.142 -10.979  -8.679
  173   1HH1  ARG  38           HH11     ARG  38   1.477 -11.118  -8.654
  174   2HH1  ARG  38           HH12     ARG  38   1.475 -12.747  -9.288
  175   1HH2  ARG  38           HH21     ARG  38  -2.014 -13.066  -9.443
  176   2HH2  ARG  38           HH22     ARG  38  -0.452 -13.832  -9.727
  177    H    LEU  39           H        LEU  39  -0.590  -6.689  -4.150
  178    HA   LEU  39           HA       LEU  39  -1.957  -5.477  -6.452
  179   1HB   LEU  39           HB2      LEU  39  -2.825  -3.538  -5.201
  180   2HB   LEU  39           HB1      LEU  39  -3.436  -5.082  -4.591
  181    HG   LEU  39           HG       LEU  39  -1.398  -4.824  -2.823
  182   1HD1  LEU  39           HD12     LEU  39  -0.615  -2.619  -3.912
  183   2HD1  LEU  39           HD11     LEU  39  -2.135  -1.886  -3.371
  184   3HD1  LEU  39           HD13     LEU  39  -0.975  -2.504  -2.158
  185   1HD2  LEU  39           HD21     LEU  39  -3.883  -4.957  -2.232
  186   2HD2  LEU  39           HD23     LEU  39  -2.995  -3.827  -1.192
  187   3HD2  LEU  39           HD22     LEU  39  -4.032  -3.217  -2.513
  188    H    ARG  40           H        ARG  40  -0.733  -3.991  -7.720
  189    HA   ARG  40           HA       ARG  40   1.999  -3.528  -6.547
  190   1HB   ARG  40           HB2      ARG  40   1.766  -3.666  -9.448
  191   2HB   ARG  40           HB1      ARG  40   3.169  -4.109  -8.498
  192   1HG   ARG  40           HG2      ARG  40   0.690  -5.642  -9.204
  193   2HG   ARG  40           HG1      ARG  40   2.353  -5.920  -9.803
  194   1HD   ARG  40           HD2      ARG  40   0.787  -7.078  -7.557
  195   2HD   ARG  40           HD1      ARG  40   1.972  -7.779  -8.684
  196    HE   ARG  40           HE       ARG  40   2.652  -6.263  -6.165
  197   1HH1  ARG  40           HH11     ARG  40   2.940  -9.471  -7.896
  198   2HH1  ARG  40           HH12     ARG  40   3.780 -10.158  -6.537
  199   1HH2  ARG  40           HH21     ARG  40   3.731  -7.345  -4.531
  200   2HH2  ARG  40           HH22     ARG  40   4.286  -8.986  -4.739
  201    H    VAL  41           H        VAL  41   3.285  -1.779  -7.652
  202    HA   VAL  41           HA       VAL  41   1.568   0.348  -8.634
  203    HB   VAL  41           HB       VAL  41   2.910   1.480  -6.272
  204   1HG1  VAL  41           HG12     VAL  41   1.134   2.620  -7.550
  205   2HG1  VAL  41           HG11     VAL  41  -0.041   1.377  -7.028
  206   3HG1  VAL  41           HG13     VAL  41   0.716   2.458  -5.826
  207   1HG2  VAL  41           HG21     VAL  41   2.510  -0.812  -5.208
  208   2HG2  VAL  41           HG23     VAL  41   1.671   0.541  -4.422
  209   3HG2  VAL  41           HG22     VAL  41   0.761  -0.556  -5.452
  210    H    SER  42           H        SER  42   3.041   0.293 -10.501
  211    HA   SER  42           HA       SER  42   5.914   0.759  -9.848
  212   1HB   SER  42           HB2      SER  42   5.488  -0.983 -11.546
  213   2HB   SER  42           HB1      SER  42   4.539   0.159 -12.536
  214    HG   SER  42           HG       SER  42   6.747   0.103 -13.279
  215    H    VAL  43           H        VAL  43   6.282   2.970  -9.297
  216    HA   VAL  43           HA       VAL  43   5.437   4.862 -11.440
  217    HB   VAL  43           HB       VAL  43   4.454   6.327  -9.774
  218   1HG1  VAL  43           HG12     VAL  43   3.089   4.354 -10.714
  219   2HG1  VAL  43           HG11     VAL  43   3.302   3.528  -9.158
  220   3HG1  VAL  43           HG13     VAL  43   2.391   5.060  -9.273
  221   1HG2  VAL  43           HG21     VAL  43   6.084   5.591  -7.826
  222   2HG2  VAL  43           HG23     VAL  43   4.417   5.898  -7.368
  223   3HG2  VAL  43           HG22     VAL  43   4.993   4.217  -7.565
  224    H    ALA  44           H        ALA  44   6.326   7.100 -11.171
  225    HA   ALA  44           HA       ALA  44   9.156   6.897 -10.300
  226   1HB   ALA  44           HB3      ALA  44   8.622   7.906 -12.529
  227   2HB   ALA  44           HB2      ALA  44   7.668   9.183 -11.713
  228   3HB   ALA  44           HB1      ALA  44   9.431   9.058 -11.423
  229    H    ASP  45           H        ASP  45   6.123   7.774  -8.747
  230    HA   ASP  45           HA       ASP  45   7.296   9.855  -7.095
  231   1HB   ASP  45           HB2      ASP  45   4.970   8.016  -6.350
  232   2HB   ASP  45           HB1      ASP  45   5.424   9.563  -5.600
  233    H    VAL  46           H        VAL  46   9.460   8.286  -7.093
  234    HA   VAL  46           HA       VAL  46   9.235   6.542  -4.694
  235    HB   VAL  46           HB       VAL  46  10.273   5.624  -6.799
  236   1HG1  VAL  46           HG12     VAL  46  11.625   7.577  -7.554
  237   2HG1  VAL  46           HG11     VAL  46  12.635   7.493  -6.083
  238   3HG1  VAL  46           HG13     VAL  46  12.669   6.167  -7.271
  239   1HG2  VAL  46           HG21     VAL  46  10.642   4.549  -4.575
  240   2HG2  VAL  46           HG23     VAL  46  12.077   4.407  -5.613
  241   3HG2  VAL  46           HG22     VAL  46  12.067   5.587  -4.282
  242    H    SER  47           H        SER  47   9.158   9.724  -4.955
  243    HA   SER  47           HA       SER  47  11.680  10.712  -4.252
  244   1HB   SER  47           HB2      SER  47  10.052  12.252  -5.043
  245   2HB   SER  47           HB1      SER  47   8.868  11.814  -3.800
  246    HG   SER  47           HG       SER  47  11.359  13.146  -3.239
  247    H    LYS  48           H        LYS  48   9.043  10.877  -1.728
  248    HA   LYS  48           HA       LYS  48  11.070   9.746   0.202
  249   1HB   LYS  48           HB2      LYS  48   9.749  10.894   1.982
  250   2HB   LYS  48           HB1      LYS  48  10.474  12.012   0.809
  251   1HG   LYS  48           HG2      LYS  48   8.148  12.629   1.553
  252   2HG   LYS  48           HG1      LYS  48   8.340  12.536  -0.212
  253   1HD   LYS  48           HD2      LYS  48   7.188  10.355  -0.269
  254   2HD   LYS  48           HD1      LYS  48   7.081  10.309   1.523
  255   1HE   LYS  48           HE2      LYS  48   5.751  12.422  -0.325
  256   2HE   LYS  48           HE1      LYS  48   4.950  10.949   0.282
  257   1HZ   LYS  48           HZ2      LYS  48   5.302  11.740   2.601
  258   2HZ   LYS  48           HZ1      LYS  48   5.952  13.241   1.990
  259   3HZ   LYS  48           HZ3      LYS  48   4.307  12.797   1.662
  260    H    VAL  49           H        VAL  49   8.665   8.527  -1.699
  261    HA   VAL  49           HA       VAL  49   6.588   7.671  -0.364
  262    HB   VAL  49           HB       VAL  49   7.209   6.835  -2.608
  263   1HG1  VAL  49           HG11     VAL  49   9.386   5.158  -1.219
  264   2HG1  VAL  49           HG13     VAL  49   8.835   4.935  -2.900
  265   3HG1  VAL  49           HG12     VAL  49   9.603   6.459  -2.373
  266   1HG2  VAL  49           HG22     VAL  49   6.496   4.631  -0.557
  267   2HG2  VAL  49           HG21     VAL  49   5.443   5.644  -1.548
  268   3HG2  VAL  49           HG23     VAL  49   6.517   4.392  -2.300
  269    H    ASP  50           H        ASP  50   5.959   6.238   1.425
  270    HA   ASP  50           HA       ASP  50   8.322   5.363   3.059
  271   1HB   ASP  50           HB2      ASP  50   6.574   6.991   3.911
  272   2HB   ASP  50           HB1      ASP  50   5.420   5.635   3.940
  273    H    GLN  51           H        GLN  51   8.058   3.869   0.875
  274    HA   GLN  51           HA       GLN  51   6.225   1.676   0.959
  275   1HB   GLN  51           HB2      GLN  51   8.457   0.339  -0.102
  276   2HB   GLN  51           HB1      GLN  51   7.220   1.184  -1.052
  277   1HG   GLN  51           HG2      GLN  51   8.465   3.134  -1.210
  278   2HG   GLN  51           HG1      GLN  51   9.663   2.642   0.045
  279   1HE2  GLN  51           HE22     GLN  51  11.955   1.832  -2.427
  280   2HE2  GLN  51           HE21     GLN  51  11.702   2.294  -0.809
  281    H    ALA  52           H        ALA  52   9.490   2.144   2.466
  282    HA   ALA  52           HA       ALA  52   9.746  -0.418   3.556
  283   1HB   ALA  52           HB3      ALA  52  11.538   1.326   3.734
  284   2HB   ALA  52           HB2      ALA  52  10.516   2.264   4.872
  285   3HB   ALA  52           HB1      ALA  52  11.147   0.651   5.346
  286    H    GLY  53           H        GLY  53   7.650   2.325   4.680
  287   1HA   GLY  53           HA1      GLY  53   6.657   0.698   6.942
  288   2HA   GLY  53           HA2      GLY  53   5.984   2.247   6.367
  289    H    LEU  54           H        LEU  54   5.620   1.592   3.538
  290    HA   LEU  54           HA       LEU  54   2.996   0.821   4.026
  291   1HB   LEU  54           HB2      LEU  54   4.037   2.137   2.005
  292   2HB   LEU  54           HB1      LEU  54   4.126   0.578   1.170
  293    HG   LEU  54           HG       LEU  54   1.442   1.189   2.409
  294   1HD1  LEU  54           HD11     LEU  54   2.674   3.285   0.722
  295   2HD1  LEU  54           HD13     LEU  54   1.007   2.765   0.234
  296   3HD1  LEU  54           HD12     LEU  54   1.407   3.386   1.842
  297   1HD2  LEU  54           HD21     LEU  54   1.724  -0.775   0.872
  298   2HD2  LEU  54           HD23     LEU  54   0.523   0.387   0.274
  299   3HD2  LEU  54           HD22     LEU  54   2.149   0.334  -0.451
  300    H    LYS  55           H        LYS  55   5.767  -1.259   3.197
  301    HA   LYS  55           HA       LYS  55   4.036  -3.371   2.342
  302   1HB   LYS  55           HB2      LYS  55   5.837  -4.845   2.321
  303   2HB   LYS  55           HB1      LYS  55   6.698  -3.309   2.027
  304   1HG   LYS  55           HG2      LYS  55   6.501  -4.863   4.697
  305   2HG   LYS  55           HG1      LYS  55   7.760  -5.104   3.509
  306   1HD   LYS  55           HD2      LYS  55   7.646  -2.228   4.052
  307   2HD   LYS  55           HD1      LYS  55   7.751  -3.126   5.583
  308   1HE   LYS  55           HE2      LYS  55   9.983  -2.571   4.788
  309   2HE   LYS  55           HE1      LYS  55   9.804  -4.339   4.691
  310   1HZ   LYS  55           HZ1      LYS  55   9.390  -2.493   2.312
  311   2HZ   LYS  55           HZ3      LYS  55  10.897  -3.237   2.703
  312   3HZ   LYS  55           HZ2      LYS  55   9.552  -4.238   2.287
  313    H    LYS  56           H        LYS  56   5.307  -2.542   5.513
  314    HA   LYS  56           HA       LYS  56   3.720  -4.841   6.616
  315   1HB   LYS  56           HB2      LYS  56   5.045  -4.656   8.626
  316   2HB   LYS  56           HB1      LYS  56   6.072  -4.715   7.179
  317   1HG   LYS  56           HG2      LYS  56   6.150  -2.025   7.430
  318   2HG   LYS  56           HG1      LYS  56   5.483  -2.322   9.029
  319   1HD   LYS  56           HD2      LYS  56   8.041  -3.706   7.938
  320   2HD   LYS  56           HD1      LYS  56   8.119  -2.089   8.660
  321   1HE   LYS  56           HE2      LYS  56   6.906  -4.448  10.202
  322   2HE   LYS  56           HE1      LYS  56   8.661  -4.144  10.170
  323   1HZ   LYS  56           HZ1      LYS  56   6.635  -2.081  11.092
  324   2HZ   LYS  56           HZ3      LYS  56   7.612  -3.082  12.122
  325   3HZ   LYS  56           HZ2      LYS  56   8.366  -1.918  11.084
  326    H    LEU  57           H        LEU  57   3.261  -1.470   6.034
  327    HA   LEU  57           HA       LEU  57   1.259  -1.393   8.230
  328   1HB   LEU  57           HB2      LEU  57   3.401   0.270   7.878
  329   2HB   LEU  57           HB1      LEU  57   2.217   1.075   6.819
  330    HG   LEU  57           HG       LEU  57   2.124   0.504   9.858
  331   1HD1  LEU  57           HD12     LEU  57   3.497   2.514   9.027
  332   2HD1  LEU  57           HD11     LEU  57   1.975   3.205   8.386
  333   3HD1  LEU  57           HD13     LEU  57   2.156   2.951  10.131
  334   1HD2  LEU  57           HD22     LEU  57  -0.115   1.713   8.126
  335   2HD2  LEU  57           HD21     LEU  57  -0.169   0.216   9.121
  336   3HD2  LEU  57           HD23     LEU  57  -0.037   1.778   9.924
  337    H    GLY  58           H        GLY  58   1.614  -1.119   4.586
  338   1HA   GLY  58           HA1      GLY  58  -1.307  -0.389   4.486
  339   2HA   GLY  58           HA2      GLY  58  -0.152  -0.139   3.187
  340    H    ALA  59           H        ALA  59   1.221  -2.506   2.812
  341    HA   ALA  59           HA       ALA  59  -0.961  -4.502   2.358
  342   1HB   ALA  59           HB3      ALA  59   0.244  -3.425   0.367
  343   2HB   ALA  59           HB2      ALA  59   1.759  -4.195   0.933
  344   3HB   ALA  59           HB1      ALA  59   0.380  -5.192   0.386
  345    H    ALA  60           H        ALA  60   1.226  -6.629   2.092
  346    HA   ALA  60           HA       ALA  60   2.342  -6.658   4.864
  347   1HB   ALA  60           HB3      ALA  60   0.044  -7.762   4.817
  348   2HB   ALA  60           HB2      ALA  60   0.777  -9.071   3.828
  349   3HB   ALA  60           HB1      ALA  60   1.418  -8.730   5.454
  350    H    GLY  61           H        GLY  61   3.795  -6.079   2.582
  351   1HA   GLY  61           HA1      GLY  61   6.061  -7.379   2.555
  352   2HA   GLY  61           HA2      GLY  61   5.113  -8.661   1.773
  353    H    VAL  62           H        VAL  62   7.154  -6.133   0.871
  354    HA   VAL  62           HA       VAL  62   5.812  -6.131  -1.716
  355    HB   VAL  62           HB       VAL  62   5.739  -3.759  -2.121
  356   1HG1  VAL  62           HG11     VAL  62   4.595  -4.490   0.496
  357   2HG1  VAL  62           HG13     VAL  62   5.009  -2.736   0.382
  358   3HG1  VAL  62           HG12     VAL  62   3.909  -3.488  -0.712
  359   1HG2  VAL  62           HG22     VAL  62   7.822  -3.471   0.062
  360   2HG2  VAL  62           HG21     VAL  62   7.939  -3.097  -1.677
  361   3HG2  VAL  62           HG23     VAL  62   6.970  -2.046  -0.622
  362    H    VAL  63           H        VAL  63   7.376  -5.139  -3.456
  363    HA   VAL  63           HA       VAL  63  10.178  -5.717  -2.617
  364    HB   VAL  63           HB       VAL  63  10.374  -7.579  -3.900
  365   1HG1  VAL  63           HG12     VAL  63   8.072  -8.094  -3.152
  366   2HG1  VAL  63           HG11     VAL  63   7.380  -7.314  -4.605
  367   3HG1  VAL  63           HG13     VAL  63   8.399  -8.761  -4.778
  368   1HG2  VAL  63           HG22     VAL  63   9.174  -6.013  -6.240
  369   2HG2  VAL  63           HG21     VAL  63  10.902  -6.190  -5.828
  370   3HG2  VAL  63           HG23     VAL  63   9.953  -7.612  -6.351
  371    H    VAL  64           H        VAL  64  11.692  -4.276  -3.705
  372    HA   VAL  64           HA       VAL  64  10.284  -2.165  -5.314
  373    HB   VAL  64           HB       VAL  64  12.756  -1.949  -3.535
  374   1HG1  VAL  64           HG12     VAL  64  12.569  -0.382  -5.593
  375   2HG1  VAL  64           HG11     VAL  64  11.112   0.311  -4.827
  376   3HG1  VAL  64           HG13     VAL  64  12.709   0.422  -4.027
  377   1HG2  VAL  64           HG21     VAL  64  10.676  -2.324  -2.166
  378   2HG2  VAL  64           HG23     VAL  64  11.318  -0.675  -1.949
  379   3HG2  VAL  64           HG22     VAL  64   9.887  -0.951  -2.980
  380    H    ALA  65           H        ALA  65  10.932  -2.359  -7.523
  381    HA   ALA  65           HA       ALA  65  13.767  -3.292  -8.023
  382   1HB   ALA  65           HB2      ALA  65  11.197  -3.956  -9.598
  383   2HB   ALA  65           HB1      ALA  65  12.854  -4.454 -10.031
  384   3HB   ALA  65           HB3      ALA  65  12.085  -5.085  -8.544
  385    H    GLY  66           H        GLY  66  14.818  -1.277  -8.839
  386   1HA   GLY  66           HA1      GLY  66  13.433   0.970  -9.583
  387   2HA   GLY  66           HA2      GLY  66  14.994   0.555 -10.322
  388    H    SER  67           H        SER  67  11.794   1.287 -11.207
  389    HA   SER  67           HA       SER  67  11.265   1.118 -13.600
  390   1HB   SER  67           HB2      SER  67  11.070  -1.072 -14.715
  391   2HB   SER  67           HB1      SER  67  12.763  -0.675 -14.368
  392    HG   SER  67           HG       SER  67  11.121  -2.490 -12.818
  393    H    GLY  68           H        GLY  68  10.552  -0.866 -10.689
  394   1HA   GLY  68           HA1      GLY  68   7.957   0.016 -10.644
  395   2HA   GLY  68           HA2      GLY  68   7.906  -1.616 -11.410
  396    H    VAL  69           H        VAL  69   6.555  -1.152  -8.947
  397    HA   VAL  69           HA       VAL  69   8.315  -2.512  -6.935
  398    HB   VAL  69           HB       VAL  69   6.313  -0.285  -6.532
  399   1HG1  VAL  69           HG11     VAL  69   8.141  -1.627  -4.423
  400   2HG1  VAL  69           HG13     VAL  69   7.159  -0.196  -4.114
  401   3HG1  VAL  69           HG12     VAL  69   6.369  -1.736  -4.524
  402   1HG2  VAL  69           HG22     VAL  69   9.371  -0.197  -6.540
  403   2HG2  VAL  69           HG21     VAL  69   8.234   0.756  -7.535
  404   3HG2  VAL  69           HG23     VAL  69   8.395   1.096  -5.791
  405    H    GLN  70           H        GLN  70   6.984  -3.895  -5.486
  406    HA   GLN  70           HA       GLN  70   4.303  -4.583  -6.645
  407   1HB   GLN  70           HB2      GLN  70   6.930  -6.030  -6.692
  408   2HB   GLN  70           HB1      GLN  70   5.555  -7.038  -6.298
  409   1HG   GLN  70           HG2      GLN  70   4.578  -6.771  -8.477
  410   2HG   GLN  70           HG1      GLN  70   5.386  -5.215  -8.763
  411   1HE2  GLN  70           HE22     GLN  70   7.474  -8.639  -9.653
  412   2HE2  GLN  70           HE21     GLN  70   6.025  -8.788  -8.723
  413    H    ALA  71           H        ALA  71   2.864  -4.456  -4.896
  414    HA   ALA  71           HA       ALA  71   3.831  -5.164  -2.253
  415   1HB   ALA  71           HB2      ALA  71   1.456  -3.411  -3.310
  416   2HB   ALA  71           HB1      ALA  71   1.713  -3.747  -1.607
  417   3HB   ALA  71           HB3      ALA  71   2.932  -2.850  -2.596
  418    H    ILE  72           H        ILE  72   2.417  -6.451  -0.824
  419    HA   ILE  72           HA       ILE  72   0.497  -8.150  -2.283
  420    HB   ILE  72           HB       ILE  72   3.062  -9.049  -2.273
  421   1HG1  ILE  72           HG12     ILE  72   1.910 -11.541  -1.996
  422   2HG1  ILE  72           HG11     ILE  72   0.437 -10.578  -2.104
  423   1HG2  ILE  72           HG22     ILE  72   3.211  -9.057   0.300
  424   2HG2  ILE  72           HG21     ILE  72   2.035 -10.368   0.303
  425   3HG2  ILE  72           HG23     ILE  72   3.604 -10.586  -0.494
  426   1HD1  ILE  72           HD12     ILE  72   1.472  -9.565  -4.300
  427   2HD1  ILE  72           HD11     ILE  72   2.779 -10.762  -4.114
  428   3HD1  ILE  72           HD13     ILE  72   1.112 -11.326  -4.343
  429    H    PHE  73           H        PHE  73  -1.221  -8.972  -0.677
  430    HA   PHE  73           HA       PHE  73  -0.461  -8.242   2.126
  431   1HB   PHE  73           HB2      PHE  73  -2.378  -6.983   2.570
  432   2HB   PHE  73           HB1      PHE  73  -1.676  -6.334   1.072
  433    HD1  PHE  73           HD2      PHE  73  -2.665  -7.122  -1.220
  434    HD2  PHE  73           HD1      PHE  73  -4.736  -7.340   2.551
  435    HE1  PHE  73           HE2      PHE  73  -4.840  -7.192  -2.401
  436    HE2  PHE  73           HE1      PHE  73  -6.896  -7.493   1.365
  437    HZ   PHE  73           HZ       PHE  73  -6.960  -7.421  -1.124
  438    H    GLY  74           H        GLY  74  -0.109 -10.775   1.091
  439   1HA   GLY  74           HA1      GLY  74  -2.364 -12.267   2.399
  440   2HA   GLY  74           HA2      GLY  74  -1.269 -12.898   1.140
  441    H    THR  75           H        THR  75  -0.938 -11.094   4.196
  442    HA   THR  75           HA       THR  75   0.174 -13.470   5.547
  443    HB   THR  75           HB       THR  75   1.967 -11.101   4.965
  444    HG1  THR  75           HG1      THR  75   3.173 -12.928   4.028
  445   1HG2  THR  75           HG22     THR  75   2.116 -13.203   7.214
  446   2HG2  THR  75           HG21     THR  75   3.636 -12.805   6.373
  447   3HG2  THR  75           HG23     THR  75   2.743 -11.526   7.177
  448    H    LYS  76           H        LYS  76  -0.608  -9.855   5.970
  449    HA   LYS  76           HA       LYS  76  -2.379 -10.882   8.137
  450   1HB   LYS  76           HB2      LYS  76  -0.458  -8.480   8.243
  451   2HB   LYS  76           HB1      LYS  76  -1.873  -8.708   9.320
  452   1HG   LYS  76           HG2      LYS  76  -0.190  -9.487  10.706
  453   2HG   LYS  76           HG1      LYS  76  -0.751 -10.985   9.943
  454   1HD   LYS  76           HD2      LYS  76   1.497 -11.289   9.533
  455   2HD   LYS  76           HD1      LYS  76   1.242 -10.184   8.150
  456   1HE   LYS  76           HE2      LYS  76   2.238  -9.331  10.950
  457   2HE   LYS  76           HE1      LYS  76   3.278  -9.641   9.540
  458   1HZ   LYS  76           HZ2      LYS  76   2.171  -7.810   8.328
  459   2HZ   LYS  76           HZ1      LYS  76   1.188  -7.456   9.734
  460   3HZ   LYS  76           HZ3      LYS  76   2.916  -7.269   9.806
  461    H    SER  77           H        SER  77  -3.463 -10.668   5.567
  462    HA   SER  77           HA       SER  77  -4.161  -8.112   4.767
  463   1HB   SER  77           HB2      SER  77  -6.216  -8.907   3.725
  464   2HB   SER  77           HB1      SER  77  -4.899 -10.077   3.468
  465    HG   SER  77           HG       SER  77  -7.065 -10.422   5.307
  466    H    ASP  78           H        ASP  78  -5.750 -10.161   7.350
  467    HA   ASP  78           HA       ASP  78  -7.892  -8.343   7.784
  468   1HB   ASP  78           HB2      ASP  78  -6.579 -10.381   9.676
  469   2HB   ASP  78           HB1      ASP  78  -8.034  -9.443  10.104
  470    H    ASN  79           H        ASN  79  -4.571  -8.460   9.313
  471    HA   ASN  79           HA       ASN  79  -5.303  -6.451  11.270
  472   1HB   ASN  79           HB2      ASN  79  -3.201  -8.096  11.211
  473   2HB   ASN  79           HB1      ASN  79  -2.417  -6.732  10.358
  474   1HD2  ASN  79           HD22     ASN  79  -3.511  -6.451  14.366
  475   2HD2  ASN  79           HD21     ASN  79  -4.311  -7.603  13.358
  476    H    LEU  80           H        LEU  80  -3.812  -6.430   7.970
  477    HA   LEU  80           HA       LEU  80  -3.291  -3.553   8.022
  478   1HB   LEU  80           HB2      LEU  80  -3.277  -5.684   5.821
  479   2HB   LEU  80           HB1      LEU  80  -3.028  -3.970   5.464
  480    HG   LEU  80           HG       LEU  80  -0.956  -5.453   5.762
  481   1HD1  LEU  80           HD12     LEU  80  -0.916  -2.913   5.699
  482   2HD1  LEU  80           HD11     LEU  80  -1.038  -2.869   7.467
  483   3HD1  LEU  80           HD13     LEU  80   0.396  -3.583   6.690
  484   1HD2  LEU  80           HD21     LEU  80  -1.514  -6.536   7.961
  485   2HD2  LEU  80           HD23     LEU  80   0.047  -5.705   7.977
  486   3HD2  LEU  80           HD22     LEU  80  -1.375  -4.960   8.772
  487    H    LYS  81           H        LYS  81  -6.090  -5.648   7.214
  488    HA   LYS  81           HA       LYS  81  -7.478  -3.468   5.868
  489   1HB   LYS  81           HB2      LYS  81  -8.007  -5.952   5.490
  490   2HB   LYS  81           HB1      LYS  81  -8.628  -5.989   7.148
  491   1HG   LYS  81           HG2      LYS  81 -10.668  -5.393   6.231
  492   2HG   LYS  81           HG1      LYS  81 -10.005  -3.763   6.022
  493   1HD   LYS  81           HD2      LYS  81 -10.119  -6.052   3.944
  494   2HD   LYS  81           HD1      LYS  81 -11.048  -4.532   3.947
  495   1HE   LYS  81           HE2      LYS  81  -8.684  -3.361   3.817
  496   2HE   LYS  81           HE1      LYS  81  -8.085  -4.964   3.306
  497   1HZ   LYS  81           HZ2      LYS  81  -9.892  -4.907   1.507
  498   2HZ   LYS  81           HZ1      LYS  81 -10.215  -3.261   1.957
  499   3HZ   LYS  81           HZ3      LYS  81  -8.669  -3.664   1.326
  500    H    THR  82           H        THR  82  -7.229  -4.856   9.258
  501    HA   THR  82           HA       THR  82  -9.410  -3.462  10.369
  502    HB   THR  82           HB       THR  82  -6.791  -4.470  11.573
  503    HG1  THR  82           HG1      THR  82  -8.602  -5.938  11.132
  504   1HG2  THR  82           HG22     THR  82  -8.957  -2.876  13.055
  505   2HG2  THR  82           HG21     THR  82  -7.735  -3.925  13.842
  506   3HG2  THR  82           HG23     THR  82  -7.207  -2.484  12.930
  507    H    GLU  83           H        GLU  83  -5.892  -2.378  10.447
  508    HA   GLU  83           HA       GLU  83  -6.459   0.186  11.390
  509   1HB   GLU  83           HB2      GLU  83  -4.364   0.949  10.333
  510   2HB   GLU  83           HB1      GLU  83  -4.133  -0.673  11.049
  511   1HG   GLU  83           HG2      GLU  83  -4.482  -1.705   8.765
  512   2HG   GLU  83           HG1      GLU  83  -4.687  -0.087   8.042
  513    H    MET  84           H        MET  84  -6.935  -1.022   7.944
  514    HA   MET  84           HA       MET  84  -7.238   1.686   6.954
  515   1HB   MET  84           HB2      MET  84  -8.144  -1.022   5.775
  516   2HB   MET  84           HB1      MET  84  -8.455   0.552   4.988
  517   1HG   MET  84           HG2      MET  84  -6.110   0.992   4.639
  518   2HG   MET  84           HG1      MET  84  -5.605  -0.312   5.753
  519   1HE   MET  84           HE1      MET  84  -7.670   0.367   2.418
  520   2HE   MET  84           HE3      MET  84  -7.636  -1.257   1.658
  521   3HE   MET  84           HE2      MET  84  -8.648  -0.975   3.104
  522    H    ASP  85           H        ASP  85  -9.531  -0.992   7.998
  523    HA   ASP  85           HA       ASP  85 -11.950   0.246   7.684
  524   1HB   ASP  85           HB2      ASP  85 -11.834  -1.973   8.646
  525   2HB   ASP  85           HB1      ASP  85 -11.063  -1.362  10.128
  526    H    GLU  86           H        GLU  86  -9.633   0.723  10.469
  527    HA   GLU  86           HA       GLU  86 -11.082   2.687  11.808
  528   1HB   GLU  86           HB2      GLU  86  -8.137   2.071  11.622
  529   2HB   GLU  86           HB1      GLU  86  -8.503   3.701  12.165
  530   1HG   GLU  86           HG2      GLU  86 -10.049   1.466  13.555
  531   2HG   GLU  86           HG1      GLU  86  -8.308   1.582  13.875
  532    H    TYR  87           H        TYR  87  -8.915   3.239   8.900
  533    HA   TYR  87           HA       TYR  87  -9.027   6.002   9.101
  534   1HB   TYR  87           HB1      TYR  87  -8.091   6.228   7.064
  535   2HB   TYR  87           HB2      TYR  87  -7.884   4.436   7.231
  536    HD1  TYR  87           HD2      TYR  87 -10.187   7.120   5.854
  537    HD2  TYR  87           HD1      TYR  87  -8.527   3.187   5.271
  538    HE1  TYR  87           HE2      TYR  87 -11.158   7.035   3.586
  539    HE2  TYR  87           HE1      TYR  87  -9.437   3.141   2.986
  540    HH   TYR  87           HH       TYR  87 -11.223   4.149   1.609
  541    H    ILE  88           H        ILE  88 -11.336   3.829   7.342
  542    HA   ILE  88           HA       ILE  88 -12.848   6.045   6.319
  543    HB   ILE  88           HB       ILE  88 -13.984   3.226   6.805
  544   1HG1  ILE  88           HG12     ILE  88 -13.271   3.496   4.024
  545   2HG1  ILE  88           HG11     ILE  88 -11.878   4.089   4.932
  546   1HG2  ILE  88           HG22     ILE  88 -15.652   5.055   6.259
  547   2HG2  ILE  88           HG21     ILE  88 -14.717   5.446   4.786
  548   3HG2  ILE  88           HG23     ILE  88 -15.528   3.859   4.942
  549   1HD1  ILE  88           HD12     ILE  88 -11.779   1.933   6.200
  550   2HD1  ILE  88           HD11     ILE  88 -13.169   1.323   5.273
  551   3HD1  ILE  88           HD13     ILE  88 -11.615   1.688   4.456
  552    H    ARG  89           H        ARG  89 -13.121   3.930   9.269
  553    HA   ARG  89           HA       ARG  89 -15.520   5.184  10.208
  554   1HB   ARG  89           HB2      ARG  89 -13.247   3.903  11.844
  555   2HB   ARG  89           HB1      ARG  89 -14.888   4.243  12.418
  556   1HG   ARG  89           HG2      ARG  89 -15.139   2.642   9.945
  557   2HG   ARG  89           HG1      ARG  89 -13.921   1.858  10.974
  558   1HD   ARG  89           HD2      ARG  89 -16.740   2.686  11.723
  559   2HD   ARG  89           HD1      ARG  89 -16.219   0.985  11.470
  560    HE   ARG  89           HE       ARG  89 -14.432   1.761  13.385
  561   1HH1  ARG  89           HH11     ARG  89 -18.042   1.921  13.317
  562   2HH1  ARG  89           HH12     ARG  89 -18.126   1.999  15.070
  563   1HH2  ARG  89           HH21     ARG  89 -14.660   1.808  15.600
  564   2HH2  ARG  89           HH22     ARG  89 -16.258   1.894  16.342
  565    H    ASN  90           H        ASN  90 -12.059   6.098  10.408
  566    HA   ASN  90           HA       ASN  90 -12.566   8.278  12.310
  567   1HB   ASN  90           HB2      ASN  90 -10.416   7.101  12.392
  568   2HB   ASN  90           HB1      ASN  90 -10.095   7.452  10.686
  569   1HD2  ASN  90           HD22     ASN  90  -8.749  10.686  11.298
  570   2HD2  ASN  90           HD21     ASN  90  -9.116   9.487  10.116
  571    H    PHE  91           H        PHE  91 -12.743   7.878   8.770
  572    HA   PHE  91           HA       PHE  91 -13.039  10.863   8.564
  573   1HB   PHE  91           HB2      PHE  91 -10.869   9.322   7.577
  574   2HB   PHE  91           HB1      PHE  91 -11.921   9.438   6.165
  575    HD1  PHE  91           HD1      PHE  91 -10.242  11.375   8.900
  576    HD2  PHE  91           HD2      PHE  91 -12.011  11.643   4.984
  577    HE1  PHE  91           HE1      PHE  91  -9.124  13.555   8.551
  578    HE2  PHE  91           HE2      PHE  91 -10.936  13.854   4.658
  579    HZ   PHE  91           HZ       PHE  91  -9.455  14.794   6.419
  580    H    GLY  92           H        GLY  92 -15.187   9.018   9.135
  581   1HA   GLY  92           HA1      GLY  92 -16.329   7.985   6.729
  582   2HA   GLY  92           HA2      GLY  92 -17.230   8.323   8.228
   
  No H/Q in entry =         582
  Start of MODEL   11
    1    H    MET  15           H        MET  15  -3.517   9.370  11.147
    2    HA   MET  15           HA       MET  15  -1.906   8.878   9.358
    3   1HB   MET  15           HB2      MET  15   0.200   8.505  10.738
    4   2HB   MET  15           HB1      MET  15  -0.835   9.853  11.296
    5   1HG   MET  15           HG2      MET  15  -1.736   8.490  13.154
    6   2HG   MET  15           HG1      MET  15  -0.903   7.027  12.546
    7   1HE   MET  15           HE1      MET  15  -0.342  10.656  13.989
    8   2HE   MET  15           HE3      MET  15   1.397  10.607  14.429
    9   3HE   MET  15           HE2      MET  15   0.922  10.721  12.709
   10    H    ALA  16           H        ALA  16  -2.844   6.035  11.414
   11    HA   ALA  16           HA       ALA  16  -1.051   4.235  10.259
   12   1HB   ALA  16           HB3      ALA  16  -2.537   3.556  12.118
   13   2HB   ALA  16           HB2      ALA  16  -3.954   3.546  11.058
   14   3HB   ALA  16           HB1      ALA  16  -2.644   2.413  10.762
   15    HA   PRO  17           HA       PRO  17  -3.593   3.813   6.389
   16   1HB   PRO  17           HB2      PRO  17  -5.839   5.195   5.806
   17   2HB   PRO  17           HB1      PRO  17  -5.868   3.918   7.082
   18   1HG   PRO  17           HG2      PRO  17  -5.528   6.930   7.545
   19   2HG   PRO  17           HG1      PRO  17  -6.736   5.861   8.321
   20   1HD   PRO  17           HD2      PRO  17  -4.332   6.502   9.499
   21   2HD   PRO  17           HD1      PRO  17  -5.107   4.889   9.729
   22    H    ALA  18           H        ALA  18  -3.167   7.343   7.399
   23    HA   ALA  18           HA       ALA  18  -3.045   8.492   4.834
   24   1HB   ALA  18           HB2      ALA  18  -0.965   8.870   7.097
   25   2HB   ALA  18           HB1      ALA  18  -1.201   9.955   5.696
   26   3HB   ALA  18           HB3      ALA  18  -2.485   9.814   6.936
   27    H    LEU  19           H        LEU  19  -0.889   6.152   6.530
   28    HA   LEU  19           HA       LEU  19   1.187   6.251   4.682
   29   1HB   LEU  19           HB2      LEU  19   0.930   4.913   6.953
   30   2HB   LEU  19           HB1      LEU  19   0.385   3.582   5.899
   31    HG   LEU  19           HG       LEU  19   2.707   3.215   6.252
   32   1HD1  LEU  19           HD12     LEU  19   2.100   3.206   3.839
   33   2HD1  LEU  19           HD11     LEU  19   2.729   4.869   3.642
   34   3HD1  LEU  19           HD13     LEU  19   3.839   3.567   4.083
   35   1HD2  LEU  19           HD22     LEU  19   3.241   6.217   5.958
   36   2HD2  LEU  19           HD21     LEU  19   3.330   5.231   7.445
   37   3HD2  LEU  19           HD23     LEU  19   4.499   4.961   6.133
   38    H    VAL  20           H        VAL  20  -1.655   3.738   4.539
   39    HA   VAL  20           HA       VAL  20  -1.008   2.894   2.051
   40    HB   VAL  20           HB       VAL  20  -2.868   1.783   3.059
   41   1HG1  VAL  20           HG11     VAL  20  -4.482   4.396   2.676
   42   2HG1  VAL  20           HG13     VAL  20  -5.231   2.814   2.974
   43   3HG1  VAL  20           HG12     VAL  20  -4.157   3.496   4.190
   44   1HG2  VAL  20           HG21     VAL  20  -2.654   1.765   0.515
   45   2HG2  VAL  20           HG23     VAL  20  -4.308   1.429   1.087
   46   3HG2  VAL  20           HG22     VAL  20  -3.910   3.042   0.453
   47    H    ALA  21           H        ALA  21  -2.607   6.074   2.813
   48    HA   ALA  21           HA       ALA  21  -3.282   6.596   0.114
   49   1HB   ALA  21           HB3      ALA  21  -4.200   7.956   2.005
   50   2HB   ALA  21           HB2      ALA  21  -2.586   8.696   2.250
   51   3HB   ALA  21           HB1      ALA  21  -3.473   8.983   0.728
   52    H    ALA  22           H        ALA  22  -0.238   7.186   2.007
   53    HA   ALA  22           HA       ALA  22   1.019   8.952   0.305
   54   1HB   ALA  22           HB3      ALA  22   1.979   8.222   2.496
   55   2HB   ALA  22           HB2      ALA  22   2.304   6.610   1.792
   56   3HB   ALA  22           HB1      ALA  22   3.196   8.047   1.197
   57    H    PHE  23           H        PHE  23   0.463   5.506  -0.538
   58    HA   PHE  23           HA       PHE  23   2.054   6.055  -3.039
   59   1HB   PHE  23           HB2      PHE  23   3.070   4.496  -1.340
   60   2HB   PHE  23           HB1      PHE  23   1.835   3.275  -1.931
   61    HD1  PHE  23           HD1      PHE  23   3.305   5.240  -4.725
   62    HD2  PHE  23           HD2      PHE  23   3.881   1.948  -1.976
   63    HE1  PHE  23           HE1      PHE  23   5.395   4.599  -5.863
   64    HE2  PHE  23           HE2      PHE  23   5.562   1.019  -3.480
   65    HZ   PHE  23           HZ       PHE  23   6.406   2.375  -5.418
   66    H    GLY  24           H        GLY  24  -0.487   3.714  -1.647
   67   1HA   GLY  24           HA1      GLY  24  -1.633   3.222  -4.206
   68   2HA   GLY  24           HA2      GLY  24  -2.451   3.006  -2.631
   69    H    GLY  25           H        GLY  25  -2.055   5.928  -1.844
   70   1HA   GLY  25           HA1      GLY  25  -4.397   6.946  -3.373
   71   2HA   GLY  25           HA2      GLY  25  -3.711   7.662  -1.911
   72    H    LYS  26           H        LYS  26  -1.064   7.032  -4.054
   73    HA   LYS  26           HA       LYS  26  -0.840   9.895  -4.681
   74   1HB   LYS  26           HB2      LYS  26   0.638   7.433  -5.672
   75   2HB   LYS  26           HB1      LYS  26   1.054   9.103  -6.168
   76   1HG   LYS  26           HG2      LYS  26   1.024   8.079  -3.296
   77   2HG   LYS  26           HG1      LYS  26   2.459   7.954  -4.379
   78   1HD   LYS  26           HD2      LYS  26   1.952  10.629  -4.602
   79   2HD   LYS  26           HD1      LYS  26   1.314  10.398  -2.969
   80   1HE   LYS  26           HE2      LYS  26   3.447  10.273  -2.072
   81   2HE   LYS  26           HE1      LYS  26   4.017   9.087  -3.241
   82   1HZ   LYS  26           HZ2      LYS  26   4.369  10.838  -4.924
   83   2HZ   LYS  26           HZ1      LYS  26   3.879  12.047  -3.768
   84   3HZ   LYS  26           HZ3      LYS  26   5.312  11.098  -3.502
   85    H    GLU  27           H        GLU  27  -3.053  10.043  -5.807
   86    HA   GLU  27           HA       GLU  27  -3.803   8.212  -7.779
   87   1HB   GLU  27           HB2      GLU  27  -5.698   9.463  -7.911
   88   2HB   GLU  27           HB1      GLU  27  -4.968  10.644  -6.814
   89   1HG   GLU  27           HG2      GLU  27  -3.965  11.831  -8.837
   90   2HG   GLU  27           HG1      GLU  27  -4.912  10.719  -9.876
   91    H    ASN  28           H        ASN  28  -1.550  10.997  -8.149
   92    HA   ASN  28           HA       ASN  28  -1.424  11.232 -10.882
   93   1HB   ASN  28           HB2      ASN  28  -0.002  12.551  -9.331
   94   2HB   ASN  28           HB1      ASN  28   0.933  11.096  -8.898
   95   1HD2  ASN  28           HD22     ASN  28   3.193  11.794 -11.598
   96   2HD2  ASN  28           HD21     ASN  28   3.002  11.176  -9.998
   97    H    ILE  29           H        ILE  29  -0.183   8.508  -8.972
   98    HA   ILE  29           HA       ILE  29   1.518   7.110 -10.323
   99    HB   ILE  29           HB       ILE  29  -1.215   6.448  -9.186
  100   1HG1  ILE  29           HG12     ILE  29  -0.136   5.807  -7.281
  101   2HG1  ILE  29           HG11     ILE  29   0.852   4.651  -8.094
  102   1HG2  ILE  29           HG22     ILE  29  -1.359   4.902 -11.018
  103   2HG2  ILE  29           HG21     ILE  29   0.208   4.189 -10.533
  104   3HG2  ILE  29           HG23     ILE  29  -1.226   4.119  -9.438
  105   1HD1  ILE  29           HD11     ILE  29   1.649   7.605  -7.836
  106   2HD1  ILE  29           HD13     ILE  29   2.271   6.238  -6.864
  107   3HD1  ILE  29           HD12     ILE  29   2.647   6.372  -8.572
  108    H    THR  30           H        THR  30   1.808   5.350 -11.790
  109    HA   THR  30           HA       THR  30   0.574   5.988 -14.394
  110    HB   THR  30           HB       THR  30   2.462   4.813 -15.358
  111    HG1  THR  30           HG1      THR  30   3.986   3.787 -13.905
  112   1HG2  THR  30           HG22     THR  30   3.343   6.734 -13.077
  113   2HG2  THR  30           HG21     THR  30   4.371   6.214 -14.431
  114   3HG2  THR  30           HG23     THR  30   2.917   7.196 -14.747
  115    H    ASN  31           H        ASN  31   1.615   2.816 -12.741
  116    HA   ASN  31           HA       ASN  31  -0.924   1.583 -13.750
  117   1HB   ASN  31           HB2      ASN  31   1.909   0.983 -14.686
  118   2HB   ASN  31           HB1      ASN  31   0.792  -0.378 -14.488
  119   1HD2  ASN  31           HD22     ASN  31   0.126   2.151 -17.635
  120   2HD2  ASN  31           HD21     ASN  31   1.300   2.600 -16.449
  121    H    LEU  32           H        LEU  32  -1.788   0.324 -12.033
  122    HA   LEU  32           HA       LEU  32   0.166  -1.051 -10.168
  123   1HB   LEU  32           HB2      LEU  32  -2.575   0.258  -9.746
  124   2HB   LEU  32           HB1      LEU  32  -1.985  -0.981  -8.612
  125    HG   LEU  32           HG       LEU  32  -0.324   0.395  -7.696
  126   1HD1  LEU  32           HD11     LEU  32  -0.488   2.063 -10.225
  127   2HD1  LEU  32           HD13     LEU  32   0.502   2.517  -8.784
  128   3HD1  LEU  32           HD12     LEU  32   0.919   1.108  -9.713
  129   1HD2  LEU  32           HD22     LEU  32  -2.573   2.338  -8.403
  130   2HD2  LEU  32           HD21     LEU  32  -2.500   1.231  -7.004
  131   3HD2  LEU  32           HD23     LEU  32  -1.333   2.572  -7.140
  132    H    ASP  33           H        ASP  33  -0.918  -3.094  -9.221
  133    HA   ASP  33           HA       ASP  33  -2.727  -4.414 -11.229
  134   1HB   ASP  33           HB2      ASP  33   0.127  -5.011 -10.624
  135   2HB   ASP  33           HB1      ASP  33  -0.932  -6.438 -10.515
  136    H    ALA  34           H        ALA  34  -3.987  -3.317  -9.273
  137    HA   ALA  34           HA       ALA  34  -3.803  -4.621  -6.768
  138   1HB   ALA  34           HB3      ALA  34  -4.954  -2.479  -6.969
  139   2HB   ALA  34           HB2      ALA  34  -6.249  -3.244  -7.944
  140   3HB   ALA  34           HB1      ALA  34  -6.020  -3.712  -6.228
  141    H    CYS  35           H        CYS  35  -4.947  -6.439  -5.838
  142    HA   CYS  35           HA       CYS  35  -6.995  -7.802  -7.310
  143   1HB   CYS  35           HB2      CYS  35  -5.802  -9.188  -8.702
  144   2HB   CYS  35           HB1      CYS  35  -4.304  -8.361  -8.202
  145    HG   CYS  35           HG       CYS  35  -4.087 -10.843  -7.808
  146    H    ILE  36           H        ILE  36  -7.570  -9.961  -6.208
  147    HA   ILE  36           HA       ILE  36  -8.393  -9.876  -3.856
  148    HB   ILE  36           HB       ILE  36  -7.637 -12.206  -3.195
  149   1HG1  ILE  36           HG12     ILE  36  -5.568 -11.982  -4.987
  150   2HG1  ILE  36           HG11     ILE  36  -6.263 -13.537  -4.486
  151   1HG2  ILE  36           HG22     ILE  36  -9.815 -11.771  -4.181
  152   2HG2  ILE  36           HG21     ILE  36  -9.158 -11.818  -5.832
  153   3HG2  ILE  36           HG23     ILE  36  -9.153 -13.290  -4.817
  154   1HD1  ILE  36           HD11     ILE  36  -6.984 -12.068  -7.114
  155   2HD1  ILE  36           HD13     ILE  36  -5.816 -13.391  -6.933
  156   3HD1  ILE  36           HD12     ILE  36  -7.530 -13.681  -6.591
  157    H    THR  37           H        THR  37  -5.278 -11.480  -2.879
  158    HA   THR  37           HA       THR  37  -4.970  -9.221  -0.973
  159    HB   THR  37           HB       THR  37  -5.200 -11.428   0.100
  160    HG1  THR  37           HG1      THR  37  -3.212 -11.077   1.303
  161   1HG2  THR  37           HG22     THR  37  -2.721 -12.190  -1.565
  162   2HG2  THR  37           HG21     THR  37  -3.238 -13.056  -0.094
  163   3HG2  THR  37           HG23     THR  37  -4.293 -13.050  -1.518
  164    H    ARG  38           H        ARG  38  -4.023  -9.456  -4.073
  165    HA   ARG  38           HA       ARG  38  -1.113  -9.043  -3.482
  166   1HB   ARG  38           HB2      ARG  38  -2.187 -10.989  -5.049
  167   2HB   ARG  38           HB1      ARG  38  -2.218  -9.668  -6.220
  168   1HG   ARG  38           HG2      ARG  38  -0.073 -10.127  -6.785
  169   2HG   ARG  38           HG1      ARG  38   0.461  -9.606  -5.172
  170   1HD   ARG  38           HD2      ARG  38   0.151 -11.888  -4.337
  171   2HD   ARG  38           HD1      ARG  38  -0.511 -12.448  -5.901
  172    HE   ARG  38           HE       ARG  38   1.713 -11.680  -6.959
  173   1HH1  ARG  38           HH11     ARG  38   1.503 -13.441  -3.759
  174   2HH1  ARG  38           HH12     ARG  38   3.082 -14.143  -4.017
  175   1HH2  ARG  38           HH21     ARG  38   3.660 -12.712  -7.142
  176   2HH2  ARG  38           HH22     ARG  38   4.266 -13.758  -5.869
  177    H    LEU  39           H        LEU  39  -0.421  -6.857  -4.035
  178    HA   LEU  39           HA       LEU  39  -1.843  -5.526  -6.175
  179   1HB   LEU  39           HB2      LEU  39  -2.572  -3.523  -5.124
  180   2HB   LEU  39           HB1      LEU  39  -3.135  -4.858  -4.099
  181    HG   LEU  39           HG       LEU  39  -0.922  -4.250  -2.691
  182   1HD1  LEU  39           HD12     LEU  39  -0.165  -2.465  -4.380
  183   2HD1  LEU  39           HD11     LEU  39  -1.609  -1.515  -3.975
  184   3HD1  LEU  39           HD13     LEU  39  -0.372  -1.822  -2.725
  185   1HD2  LEU  39           HD22     LEU  39  -3.478  -2.469  -2.646
  186   2HD2  LEU  39           HD21     LEU  39  -3.292  -4.010  -1.796
  187   3HD2  LEU  39           HD23     LEU  39  -2.304  -2.623  -1.311
  188    H    ARG  40           H        ARG  40  -0.536  -3.372  -6.801
  189    HA   ARG  40           HA       ARG  40   2.318  -3.899  -6.165
  190   1HB   ARG  40           HB1      ARG  40   1.356  -3.983  -9.017
  191   2HB   ARG  40           HB2      ARG  40   2.918  -4.554  -8.494
  192   1HG   ARG  40           HG2      ARG  40   0.199  -6.039  -8.149
  193   2HG   ARG  40           HG1      ARG  40   1.471  -6.314  -9.366
  194   1HD   ARG  40           HD2      ARG  40   2.897  -6.771  -7.219
  195   2HD   ARG  40           HD1      ARG  40   1.383  -7.466  -6.599
  196    HE   ARG  40           HE       ARG  40   1.495  -8.560  -9.103
  197   1HH1  ARG  40           HH11     ARG  40   3.720  -8.595  -6.292
  198   2HH1  ARG  40           HH12     ARG  40   4.569 -10.016  -6.880
  199   1HH2  ARG  40           HH21     ARG  40   2.613 -10.389  -9.771
  200   2HH2  ARG  40           HH22     ARG  40   3.946 -11.020  -8.807
  201    H    VAL  41           H        VAL  41   3.760  -2.084  -7.309
  202    HA   VAL  41           HA       VAL  41   1.981   0.191  -7.969
  203    HB   VAL  41           HB       VAL  41   4.120   0.690  -5.918
  204   1HG1  VAL  41           HG11     VAL  41   1.337   1.944  -6.532
  205   2HG1  VAL  41           HG13     VAL  41   2.417   2.471  -5.250
  206   3HG1  VAL  41           HG12     VAL  41   2.921   2.661  -6.953
  207   1HG2  VAL  41           HG21     VAL  41   2.867  -1.195  -4.887
  208   2HG2  VAL  41           HG23     VAL  41   2.523   0.331  -4.053
  209   3HG2  VAL  41           HG22     VAL  41   1.322  -0.341  -5.182
  210    H    SER  42           H        SER  42   3.008  -0.698 -10.107
  211    HA   SER  42           HA       SER  42   5.795  -0.084 -10.395
  212   1HB   SER  42           HB2      SER  42   5.596  -0.677 -12.787
  213   2HB   SER  42           HB1      SER  42   4.724  -1.862 -11.771
  214    HG   SER  42           HG       SER  42   2.772  -0.732 -12.505
  215    H    VAL  43           H        VAL  43   6.263   2.119  -9.866
  216    HA   VAL  43           HA       VAL  43   5.429   4.005 -12.018
  217    HB   VAL  43           HB       VAL  43   4.520   5.572 -10.431
  218   1HG1  VAL  43           HG12     VAL  43   3.069   3.535 -11.007
  219   2HG1  VAL  43           HG11     VAL  43   3.480   2.816  -9.434
  220   3HG1  VAL  43           HG13     VAL  43   2.584   4.324  -9.518
  221   1HG2  VAL  43           HG22     VAL  43   5.494   3.708  -8.173
  222   2HG2  VAL  43           HG21     VAL  43   6.175   5.305  -8.559
  223   3HG2  VAL  43           HG23     VAL  43   4.513   5.174  -7.972
  224    H    ALA  44           H        ALA  44   6.656   6.116 -11.959
  225    HA   ALA  44           HA       ALA  44   9.426   5.641 -10.947
  226   1HB   ALA  44           HB3      ALA  44   9.141   6.434 -13.299
  227   2HB   ALA  44           HB2      ALA  44   8.328   7.912 -12.699
  228   3HB   ALA  44           HB1      ALA  44  10.041   7.600 -12.284
  229    H    ASP  45           H        ASP  45   6.461   7.319  -9.872
  230    HA   ASP  45           HA       ASP  45   7.799   9.334  -8.323
  231   1HB   ASP  45           HB2      ASP  45   5.214   7.816  -7.658
  232   2HB   ASP  45           HB1      ASP  45   5.809   9.289  -6.851
  233    H    VAL  46           H        VAL  46   9.814   8.042  -7.707
  234    HA   VAL  46           HA       VAL  46   9.252   6.141  -5.442
  235    HB   VAL  46           HB       VAL  46  10.546   5.183  -7.319
  236   1HG1  VAL  46           HG11     VAL  46  12.776   7.184  -6.574
  237   2HG1  VAL  46           HG13     VAL  46  12.955   5.752  -7.615
  238   3HG1  VAL  46           HG12     VAL  46  11.894   7.079  -8.123
  239   1HG2  VAL  46           HG21     VAL  46  10.737   4.242  -5.036
  240   2HG2  VAL  46           HG23     VAL  46  12.298   4.129  -5.875
  241   3HG2  VAL  46           HG22     VAL  46  12.055   5.373  -4.625
  242    H    SER  47           H        SER  47   8.646   8.885  -5.095
  243    HA   SER  47           HA       SER  47  11.106  10.217  -4.204
  244   1HB   SER  47           HB2      SER  47   9.393  11.496  -5.432
  245   2HB   SER  47           HB1      SER  47   8.206  11.182  -4.126
  246    HG   SER  47           HG       SER  47   9.385  13.227  -3.822
  247    H    LYS  48           H        LYS  48  11.517   8.399  -2.508
  248    HA   LYS  48           HA       LYS  48  11.221   7.484  -0.410
  249   1HB   LYS  48           HB2      LYS  48  10.722  10.264   0.745
  250   2HB   LYS  48           HB1      LYS  48  11.715   8.925   1.335
  251   1HG   LYS  48           HG2      LYS  48  13.186  10.693   0.662
  252   2HG   LYS  48           HG1      LYS  48  13.372   9.448  -0.592
  253   1HD   LYS  48           HD2      LYS  48  12.311  10.807  -2.233
  254   2HD   LYS  48           HD1      LYS  48  11.254  11.624  -1.048
  255   1HE   LYS  48           HE2      LYS  48  13.297  12.917  -0.229
  256   2HE   LYS  48           HE1      LYS  48  14.206  12.216  -1.599
  257   1HZ   LYS  48           HZ2      LYS  48  12.465  13.195  -3.135
  258   2HZ   LYS  48           HZ1      LYS  48  11.685  13.915  -1.766
  259   3HZ   LYS  48           HZ3      LYS  48  13.295  14.413  -2.209
  260    H    VAL  49           H        VAL  49   9.068   6.787  -1.564
  261    HA   VAL  49           HA       VAL  49   6.701   8.190  -0.386
  262    HB   VAL  49           HB       VAL  49   6.220   8.090  -2.578
  263   1HG1  VAL  49           HG11     VAL  49   7.591   5.373  -2.935
  264   2HG1  VAL  49           HG13     VAL  49   6.552   6.172  -4.131
  265   3HG1  VAL  49           HG12     VAL  49   8.056   6.966  -3.609
  266   1HG2  VAL  49           HG21     VAL  49   4.527   6.691  -1.108
  267   2HG2  VAL  49           HG23     VAL  49   4.396   6.601  -2.892
  268   3HG2  VAL  49           HG22     VAL  49   5.201   5.288  -2.002
  269    H    ASP  50           H        ASP  50   7.798   7.470   1.715
  270    HA   ASP  50           HA       ASP  50   8.291   5.639   3.209
  271   1HB   ASP  50           HB2      ASP  50   6.258   5.659   4.640
  272   2HB   ASP  50           HB1      ASP  50   6.700   7.281   4.050
  273    H    GLN  51           H        GLN  51   8.671   4.124   1.232
  274    HA   GLN  51           HA       GLN  51   6.445   2.277   0.708
  275   1HB   GLN  51           HB2      GLN  51   9.405   2.030  -0.094
  276   2HB   GLN  51           HB1      GLN  51   8.067   1.064  -0.774
  277   1HG   GLN  51           HG2      GLN  51   7.000   3.116  -1.698
  278   2HG   GLN  51           HG1      GLN  51   8.260   4.140  -0.979
  279   1HE2  GLN  51           HE22     GLN  51   9.191   2.144  -4.415
  280   2HE2  GLN  51           HE21     GLN  51   7.891   1.554  -3.459
  281    H    ALA  52           H        ALA  52   9.605   2.312   2.539
  282    HA   ALA  52           HA       ALA  52   9.425  -0.275   3.598
  283   1HB   ALA  52           HB3      ALA  52  11.425   1.179   3.889
  284   2HB   ALA  52           HB2      ALA  52  10.496   2.265   4.971
  285   3HB   ALA  52           HB1      ALA  52  10.829   0.571   5.465
  286    H    GLY  53           H        GLY  53   7.376   2.606   4.349
  287   1HA   GLY  53           HA1      GLY  53   6.289   1.257   6.763
  288   2HA   GLY  53           HA2      GLY  53   5.723   2.788   6.059
  289    H    LEU  54           H        LEU  54   5.420   1.777   3.236
  290    HA   LEU  54           HA       LEU  54   2.719   0.962   3.804
  291   1HB   LEU  54           HB2      LEU  54   3.735   2.409   1.831
  292   2HB   LEU  54           HB1      LEU  54   3.767   0.886   0.942
  293    HG   LEU  54           HG       LEU  54   1.096   1.571   2.313
  294   1HD1  LEU  54           HD11     LEU  54   2.343   3.205   0.195
  295   2HD1  LEU  54           HD13     LEU  54   0.579   3.262   0.420
  296   3HD1  LEU  54           HD12     LEU  54   1.710   3.843   1.668
  297   1HD2  LEU  54           HD21     LEU  54   1.320  -0.403   0.627
  298   2HD2  LEU  54           HD23     LEU  54   0.127   0.836   0.165
  299   3HD2  LEU  54           HD22     LEU  54   1.727   0.804  -0.622
  300    H    LYS  55           H        LYS  55   5.609  -0.909   3.424
  301    HA   LYS  55           HA       LYS  55   4.114  -3.171   2.332
  302   1HB   LYS  55           HB2      LYS  55   6.115  -4.219   2.032
  303   2HB   LYS  55           HB1      LYS  55   6.729  -2.544   2.034
  304   1HG   LYS  55           HG2      LYS  55   6.825  -4.635   4.331
  305   2HG   LYS  55           HG1      LYS  55   8.097  -4.298   3.132
  306   1HD   LYS  55           HD2      LYS  55   7.703  -1.766   4.088
  307   2HD   LYS  55           HD1      LYS  55   7.396  -2.698   5.575
  308   1HE   LYS  55           HE2      LYS  55   9.922  -2.829   3.802
  309   2HE   LYS  55           HE1      LYS  55   9.790  -2.033   5.391
  310   1HZ   LYS  55           HZ2      LYS  55   9.346  -4.200   6.449
  311   2HZ   LYS  55           HZ1      LYS  55   9.500  -5.020   4.925
  312   3HZ   LYS  55           HZ3      LYS  55  10.867  -4.196   5.615
  313    H    LYS  56           H        LYS  56   5.121  -2.072   5.478
  314    HA   LYS  56           HA       LYS  56   3.952  -4.578   6.636
  315   1HB   LYS  56           HB2      LYS  56   5.047  -4.018   8.700
  316   2HB   LYS  56           HB1      LYS  56   6.204  -3.983   7.349
  317   1HG   LYS  56           HG2      LYS  56   5.870  -1.346   7.369
  318   2HG   LYS  56           HG1      LYS  56   5.000  -1.589   8.891
  319   1HD   LYS  56           HD2      LYS  56   7.899  -2.521   8.283
  320   2HD   LYS  56           HD1      LYS  56   7.496  -0.946   9.013
  321   1HE   LYS  56           HE2      LYS  56   6.467  -2.040  10.977
  322   2HE   LYS  56           HE1      LYS  56   6.772  -3.658  10.283
  323   1HZ   LYS  56           HZ1      LYS  56   8.942  -1.641  10.954
  324   2HZ   LYS  56           HZ3      LYS  56   8.491  -2.997  11.938
  325   3HZ   LYS  56           HZ2      LYS  56   9.180  -3.262  10.359
  326    H    LEU  57           H        LEU  57   3.125  -1.179   6.090
  327    HA   LEU  57           HA       LEU  57   0.881  -1.477   8.031
  328   1HB   LEU  57           HB2      LEU  57   2.797   0.430   7.965
  329   2HB   LEU  57           HB1      LEU  57   1.701   1.147   6.751
  330    HG   LEU  57           HG       LEU  57   1.136   0.402   9.710
  331   1HD1  LEU  57           HD12     LEU  57   2.529   2.514   9.219
  332   2HD1  LEU  57           HD11     LEU  57   1.090   3.151   8.372
  333   3HD1  LEU  57           HD13     LEU  57   1.009   2.810  10.118
  334   1HD2  LEU  57           HD22     LEU  57  -0.775   1.471   7.542
  335   2HD2  LEU  57           HD21     LEU  57  -0.972   0.027   8.595
  336   3HD2  LEU  57           HD23     LEU  57  -1.083   1.642   9.293
  337    H    GLY  58           H        GLY  58   1.589  -0.949   4.498
  338   1HA   GLY  58           HA1      GLY  58  -1.336  -0.603   3.998
  339   2HA   GLY  58           HA2      GLY  58  -0.026  -0.390   2.834
  340    H    ALA  59           H        ALA  59   1.521  -2.777   3.148
  341    HA   ALA  59           HA       ALA  59  -0.449  -4.905   2.373
  342   1HB   ALA  59           HB3      ALA  59   0.724  -3.720   0.458
  343   2HB   ALA  59           HB2      ALA  59   2.284  -4.225   1.158
  344   3HB   ALA  59           HB1      ALA  59   1.153  -5.446   0.527
  345    H    ALA  60           H        ALA  60   2.025  -6.774   2.212
  346    HA   ALA  60           HA       ALA  60   2.949  -6.764   5.047
  347   1HB   ALA  60           HB3      ALA  60   0.674  -7.986   4.952
  348   2HB   ALA  60           HB2      ALA  60   1.483  -9.197   3.902
  349   3HB   ALA  60           HB1      ALA  60   2.067  -8.935   5.562
  350    H    GLY  61           H        GLY  61   4.441  -6.151   2.773
  351   1HA   GLY  61           HA1      GLY  61   6.693  -7.414   2.537
  352   2HA   GLY  61           HA2      GLY  61   5.694  -8.743   1.908
  353    H    VAL  62           H        VAL  62   7.274  -5.808   0.908
  354    HA   VAL  62           HA       VAL  62   5.903  -6.088  -1.725
  355    HB   VAL  62           HB       VAL  62   5.714  -3.685  -2.086
  356   1HG1  VAL  62           HG11     VAL  62   4.559  -4.557   0.497
  357   2HG1  VAL  62           HG13     VAL  62   4.713  -2.769   0.220
  358   3HG1  VAL  62           HG12     VAL  62   3.791  -3.764  -0.845
  359   1HG2  VAL  62           HG22     VAL  62   7.712  -3.342   0.150
  360   2HG2  VAL  62           HG21     VAL  62   7.836  -2.913  -1.566
  361   3HG2  VAL  62           HG23     VAL  62   6.759  -1.973  -0.521
  362    H    VAL  63           H        VAL  63   7.467  -4.955  -3.428
  363    HA   VAL  63           HA       VAL  63  10.257  -5.102  -2.471
  364    HB   VAL  63           HB       VAL  63  10.581  -7.253  -3.083
  365   1HG1  VAL  63           HG11     VAL  63   7.832  -7.232  -4.470
  366   2HG1  VAL  63           HG13     VAL  63   8.906  -8.653  -4.345
  367   3HG1  VAL  63           HG12     VAL  63   8.274  -7.875  -2.876
  368   1HG2  VAL  63           HG21     VAL  63  11.622  -6.171  -5.017
  369   2HG2  VAL  63           HG23     VAL  63  10.953  -7.771  -5.461
  370   3HG2  VAL  63           HG22     VAL  63  10.103  -6.284  -5.950
  371    H    VAL  64           H        VAL  64  11.477  -3.484  -3.484
  372    HA   VAL  64           HA       VAL  64   9.912  -1.962  -5.507
  373    HB   VAL  64           HB       VAL  64  12.218  -1.097  -3.694
  374   1HG1  VAL  64           HG11     VAL  64  10.401   0.526  -5.577
  375   2HG1  VAL  64           HG13     VAL  64  11.595   1.223  -4.443
  376   3HG1  VAL  64           HG12     VAL  64  12.138   0.198  -5.804
  377   1HG2  VAL  64           HG22     VAL  64   9.182  -0.601  -3.467
  378   2HG2  VAL  64           HG21     VAL  64  10.183  -1.585  -2.362
  379   3HG2  VAL  64           HG23     VAL  64  10.428   0.181  -2.452
  380    H    ALA  65           H        ALA  65  10.715  -2.095  -7.677
  381    HA   ALA  65           HA       ALA  65  13.644  -2.754  -8.031
  382   1HB   ALA  65           HB2      ALA  65  11.225  -4.090  -9.387
  383   2HB   ALA  65           HB1      ALA  65  12.944  -4.388  -9.783
  384   3HB   ALA  65           HB3      ALA  65  12.296  -4.855  -8.182
  385    H    GLY  66           H        GLY  66  13.790  -0.339  -8.441
  386   1HA   GLY  66           HA1      GLY  66  12.521   1.398  -9.837
  387   2HA   GLY  66           HA2      GLY  66  14.206   1.099 -10.310
  388    H    SER  67           H        SER  67  11.011   1.238 -11.586
  389    HA   SER  67           HA       SER  67  10.753   0.859 -13.998
  390   1HB   SER  67           HB2      SER  67  12.694  -0.622 -14.513
  391   2HB   SER  67           HB1      SER  67  11.971  -1.916 -13.480
  392    HG   SER  67           HG       SER  67  11.384  -2.130 -15.764
  393    H    GLY  68           H        GLY  68  10.340  -1.217 -11.059
  394   1HA   GLY  68           HA1      GLY  68   7.502  -1.098 -11.474
  395   2HA   GLY  68           HA2      GLY  68   8.149  -2.730 -11.775
  396    H    VAL  69           H        VAL  69   6.326  -2.102  -9.550
  397    HA   VAL  69           HA       VAL  69   8.122  -2.843  -7.291
  398    HB   VAL  69           HB       VAL  69   5.880  -0.781  -7.102
  399   1HG1  VAL  69           HG11     VAL  69   7.686  -1.962  -4.923
  400   2HG1  VAL  69           HG13     VAL  69   6.817  -0.438  -4.744
  401   3HG1  VAL  69           HG12     VAL  69   5.912  -1.941  -5.044
  402   1HG2  VAL  69           HG22     VAL  69   8.922  -0.425  -7.179
  403   2HG2  VAL  69           HG21     VAL  69   7.687   0.328  -8.218
  404   3HG2  VAL  69           HG23     VAL  69   7.856   0.836  -6.522
  405    H    GLN  70           H        GLN  70   6.908  -4.202  -5.701
  406    HA   GLN  70           HA       GLN  70   4.285  -5.092  -6.744
  407   1HB   GLN  70           HB2      GLN  70   5.684  -7.379  -5.806
  408   2HB   GLN  70           HB1      GLN  70   5.131  -7.092  -7.486
  409   1HG   GLN  70           HG2      GLN  70   7.179  -5.970  -8.129
  410   2HG   GLN  70           HG1      GLN  70   7.870  -6.217  -6.526
  411   1HE2  GLN  70           HE22     GLN  70   7.896  -9.979  -7.280
  412   2HE2  GLN  70           HE21     GLN  70   7.113  -9.091  -6.051
  413    H    ALA  71           H        ALA  71   2.782  -5.952  -5.025
  414    HA   ALA  71           HA       ALA  71   3.836  -5.414  -2.340
  415   1HB   ALA  71           HB2      ALA  71   1.497  -3.932  -3.704
  416   2HB   ALA  71           HB1      ALA  71   1.754  -3.937  -1.958
  417   3HB   ALA  71           HB3      ALA  71   2.986  -3.228  -3.070
  418    H    ILE  72           H        ILE  72   3.212  -7.057  -0.902
  419    HA   ILE  72           HA       ILE  72   0.879  -8.707  -1.853
  420    HB   ILE  72           HB       ILE  72   3.773  -9.370  -1.342
  421   1HG1  ILE  72           HG12     ILE  72   3.081 -11.443  -2.707
  422   2HG1  ILE  72           HG11     ILE  72   1.459 -10.734  -2.810
  423   1HG2  ILE  72           HG22     ILE  72   2.913 -10.346   0.783
  424   2HG2  ILE  72           HG21     ILE  72   1.713 -11.285  -0.158
  425   3HG2  ILE  72           HG23     ILE  72   3.456 -11.567  -0.367
  426   1HD1  ILE  72           HD12     ILE  72   2.479  -8.714  -4.002
  427   2HD1  ILE  72           HD11     ILE  72   4.092  -9.466  -3.841
  428   3HD1  ILE  72           HD13     ILE  72   2.833 -10.251  -4.830
  429    H    PHE  73           H        PHE  73  -0.818  -8.784  -0.261
  430    HA   PHE  73           HA       PHE  73   0.055  -7.945   2.477
  431   1HB   PHE  73           HB2      PHE  73  -2.668  -8.331   2.508
  432   2HB   PHE  73           HB1      PHE  73  -1.835  -6.792   2.783
  433    HD1  PHE  73           HD1      PHE  73  -0.954  -6.319  -0.201
  434    HD2  PHE  73           HD2      PHE  73  -4.673  -7.084   1.752
  435    HE1  PHE  73           HE1      PHE  73  -2.096  -6.312  -2.380
  436    HE2  PHE  73           HE2      PHE  73  -5.875  -6.683  -0.384
  437    HZ   PHE  73           HZ       PHE  73  -4.575  -6.535  -2.514
  438    H    GLY  74           H        GLY  74  -0.495 -10.906   0.651
  439   1HA   GLY  74           HA1      GLY  74  -0.462 -13.061   1.494
  440   2HA   GLY  74           HA2      GLY  74   0.356 -12.336   2.909
  441    H    THR  75           H        THR  75  -0.939 -14.142   4.053
  442    HA   THR  75           HA       THR  75  -3.789 -13.785   4.293
  443    HB   THR  75           HB       THR  75  -2.939 -15.895   5.139
  444    HG1  THR  75           HG1      THR  75  -4.750 -14.896   6.300
  445   1HG2  THR  75           HG22     THR  75  -1.290 -14.219   7.141
  446   2HG2  THR  75           HG21     THR  75  -1.651 -15.958   7.334
  447   3HG2  THR  75           HG23     THR  75  -0.668 -15.415   5.954
  448    H    LYS  76           H        LYS  76  -0.984 -12.073   5.749
  449    HA   LYS  76           HA       LYS  76  -2.367 -11.023   7.938
  450   1HB   LYS  76           HB2      LYS  76   0.223 -10.472   6.773
  451   2HB   LYS  76           HB1      LYS  76  -0.625  -8.948   6.829
  452   1HG   LYS  76           HG2      LYS  76   0.536  -9.021   8.872
  453   2HG   LYS  76           HG1      LYS  76  -1.134  -9.418   9.342
  454   1HD   LYS  76           HD2      LYS  76  -0.533 -11.831   9.506
  455   2HD   LYS  76           HD1      LYS  76   1.051 -11.509   8.747
  456   1HE   LYS  76           HE2      LYS  76   1.424 -11.830  11.116
  457   2HE   LYS  76           HE1      LYS  76   1.760 -10.127  10.721
  458   1HZ   LYS  76           HZ1      LYS  76  -0.772 -11.197  12.009
  459   2HZ   LYS  76           HZ3      LYS  76   0.527 -10.384  12.823
  460   3HZ   LYS  76           HZ2      LYS  76  -0.440  -9.511  11.675
  461    H    SER  77           H        SER  77  -2.954 -10.243   4.488
  462    HA   SER  77           HA       SER  77  -3.954  -7.829   4.328
  463   1HB   SER  77           HB2      SER  77  -6.029  -8.715   3.116
  464   2HB   SER  77           HB1      SER  77  -4.555  -9.540   2.596
  465    HG   SER  77           HG       SER  77  -6.455 -10.701   4.340
  466    H    ASP  78           H        ASP  78  -5.644 -10.221   6.523
  467    HA   ASP  78           HA       ASP  78  -7.920  -8.502   6.818
  468   1HB   ASP  78           HB2      ASP  78  -6.751 -10.522   8.821
  469   2HB   ASP  78           HB1      ASP  78  -8.386  -9.806   8.895
  470    H    ASN  79           H        ASN  79  -4.793  -8.758   8.675
  471    HA   ASN  79           HA       ASN  79  -5.505  -6.743  10.572
  472   1HB   ASN  79           HB2      ASN  79  -3.573  -8.381  10.802
  473   2HB   ASN  79           HB1      ASN  79  -2.681  -7.444   9.585
  474   1HD2  ASN  79           HD22     ASN  79  -1.906  -4.786  11.940
  475   2HD2  ASN  79           HD21     ASN  79  -1.857  -5.231  10.276
  476    H    LEU  80           H        LEU  80  -4.105  -6.532   7.224
  477    HA   LEU  80           HA       LEU  80  -3.324  -3.739   7.655
  478   1HB   LEU  80           HB2      LEU  80  -3.493  -5.465   5.110
  479   2HB   LEU  80           HB1      LEU  80  -3.041  -3.747   5.084
  480    HG   LEU  80           HG       LEU  80  -1.137  -5.362   4.974
  481   1HD1  LEU  80           HD11     LEU  80  -1.121  -3.309   7.292
  482   2HD1  LEU  80           HD13     LEU  80   0.333  -4.073   6.640
  483   3HD1  LEU  80           HD12     LEU  80  -0.695  -3.104   5.565
  484   1HD2  LEU  80           HD21     LEU  80  -1.905  -7.040   6.618
  485   2HD2  LEU  80           HD23     LEU  80  -0.258  -6.452   6.989
  486   3HD2  LEU  80           HD22     LEU  80  -1.635  -5.886   7.968
  487    H    LYS  81           H        LYS  81  -5.927  -5.445   5.714
  488    HA   LYS  81           HA       LYS  81  -7.363  -3.176   5.032
  489   1HB   LYS  81           HB2      LYS  81  -8.219  -5.997   5.695
  490   2HB   LYS  81           HB1      LYS  81  -9.511  -4.778   5.791
  491   1HG   LYS  81           HG2      LYS  81  -8.972  -3.962   3.484
  492   2HG   LYS  81           HG1      LYS  81  -7.842  -5.333   3.283
  493   1HD   LYS  81           HD2      LYS  81 -10.888  -5.493   3.856
  494   2HD   LYS  81           HD1      LYS  81 -10.094  -5.798   2.289
  495   1HE   LYS  81           HE2      LYS  81  -8.856  -7.754   3.324
  496   2HE   LYS  81           HE1      LYS  81  -9.756  -7.487   4.845
  497   1HZ   LYS  81           HZ2      LYS  81 -11.881  -7.855   3.651
  498   2HZ   LYS  81           HZ1      LYS  81 -11.020  -8.144   2.166
  499   3HZ   LYS  81           HZ3      LYS  81 -10.827  -9.228   3.502
  500    H    THR  82           H        THR  82  -7.446  -4.950   8.264
  501    HA   THR  82           HA       THR  82  -9.400  -3.351   9.436
  502    HB   THR  82           HB       THR  82  -6.938  -4.693  10.617
  503    HG1  THR  82           HG1      THR  82  -8.736  -5.952  11.495
  504   1HG2  THR  82           HG22     THR  82  -8.940  -2.950  12.180
  505   2HG2  THR  82           HG21     THR  82  -7.816  -4.135  12.914
  506   3HG2  THR  82           HG23     THR  82  -7.161  -2.722  12.047
  507    H    GLU  83           H        GLU  83  -5.904  -2.471   8.923
  508    HA   GLU  83           HA       GLU  83  -6.185   0.021  10.382
  509   1HB   GLU  83           HB2      GLU  83  -4.246  -0.651   8.100
  510   2HB   GLU  83           HB1      GLU  83  -4.115   0.765   9.174
  511   1HG   GLU  83           HG2      GLU  83  -4.031  -2.143  10.238
  512   2HG   GLU  83           HG1      GLU  83  -2.597  -1.249   9.739
  513    H    MET  84           H        MET  84  -6.727  -0.967   6.911
  514    HA   MET  84           HA       MET  84  -7.227   1.726   6.051
  515   1HB   MET  84           HB2      MET  84  -8.389  -0.847   4.806
  516   2HB   MET  84           HB1      MET  84  -8.366   0.784   4.083
  517   1HG   MET  84           HG2      MET  84  -5.823   0.744   4.116
  518   2HG   MET  84           HG1      MET  84  -5.869  -0.912   4.772
  519   1HE   MET  84           HE1      MET  84  -6.900   1.419   1.815
  520   2HE   MET  84           HE3      MET  84  -7.071   0.274   0.451
  521   3HE   MET  84           HE2      MET  84  -8.381   0.417   1.661
  522    H    ASP  85           H        ASP  85  -9.534  -0.958   7.065
  523    HA   ASP  85           HA       ASP  85 -11.941   0.274   6.988
  524   1HB   ASP  85           HB2      ASP  85 -11.644  -1.975   7.954
  525   2HB   ASP  85           HB1      ASP  85 -10.867  -1.275   9.396
  526    H    GLU  86           H        GLU  86  -9.317   0.836   9.445
  527    HA   GLU  86           HA       GLU  86 -10.866   2.540  11.028
  528   1HB   GLU  86           HB2      GLU  86  -9.090   2.657  12.427
  529   2HB   GLU  86           HB1      GLU  86  -8.264   1.572  11.308
  530   1HG   GLU  86           HG2      GLU  86  -6.781   3.396  11.791
  531   2HG   GLU  86           HG1      GLU  86  -7.342   3.642  10.118
  532    H    TYR  87           H        TYR  87  -8.867   3.437   8.088
  533    HA   TYR  87           HA       TYR  87  -9.108   6.223   8.291
  534   1HB   TYR  87           HB1      TYR  87  -8.010   5.049   6.341
  535   2HB   TYR  87           HB2      TYR  87  -9.569   4.561   5.714
  536    HD1  TYR  87           HD1      TYR  87 -11.155   6.322   4.785
  537    HD2  TYR  87           HD2      TYR  87  -7.255   7.463   6.149
  538    HE1  TYR  87           HE1      TYR  87 -11.238   8.313   3.344
  539    HE2  TYR  87           HE2      TYR  87  -7.307   9.432   4.689
  540    HH   TYR  87           HH       TYR  87  -8.469  10.511   2.888
  541    H    ILE  88           H        ILE  88 -11.544   3.857   6.921
  542    HA   ILE  88           HA       ILE  88 -13.180   6.078   6.021
  543    HB   ILE  88           HB       ILE  88 -14.113   3.178   6.306
  544   1HG1  ILE  88           HG12     ILE  88 -13.456   3.609   3.545
  545   2HG1  ILE  88           HG11     ILE  88 -12.060   4.248   4.414
  546   1HG2  ILE  88           HG22     ILE  88 -15.867   4.933   5.896
  547   2HG2  ILE  88           HG21     ILE  88 -14.984   5.482   4.440
  548   3HG2  ILE  88           HG23     ILE  88 -15.702   3.845   4.494
  549   1HD1  ILE  88           HD11     ILE  88 -13.234   1.413   4.736
  550   2HD1  ILE  88           HD13     ILE  88 -11.748   1.853   3.839
  551   3HD1  ILE  88           HD12     ILE  88 -11.809   2.050   5.595
  552    H    ARG  89           H        ARG  89 -13.276   3.721   8.794
  553    HA   ARG  89           HA       ARG  89 -15.656   4.860   9.913
  554   1HB   ARG  89           HB2      ARG  89 -13.310   3.476  11.348
  555   2HB   ARG  89           HB1      ARG  89 -14.927   3.757  12.024
  556   1HG   ARG  89           HG2      ARG  89 -15.324   2.387   9.455
  557   2HG   ARG  89           HG1      ARG  89 -14.021   1.535  10.307
  558   1HD   ARG  89           HD2      ARG  89 -16.794   2.204  11.374
  559   2HD   ARG  89           HD1      ARG  89 -16.259   0.565  10.862
  560    HE   ARG  89           HE       ARG  89 -14.383   1.314  12.795
  561   1HH1  ARG  89           HH11     ARG  89 -17.962   0.881  12.746
  562   2HH1  ARG  89           HH12     ARG  89 -18.018   0.603  14.481
  563   1HH2  ARG  89           HH21     ARG  89 -14.553   0.914  14.993
  564   2HH2  ARG  89           HH22     ARG  89 -16.124   0.591  15.730
  565    H    ASN  90           H        ASN  90 -12.208   5.838  10.065
  566    HA   ASN  90           HA       ASN  90 -12.659   7.803  12.186
  567   1HB   ASN  90           HB2      ASN  90 -10.438   6.753  11.840
  568   2HB   ASN  90           HB1      ASN  90 -10.345   7.431  10.191
  569   1HD2  ASN  90           HD22     ASN  90  -8.340   9.954  11.718
  570   2HD2  ASN  90           HD21     ASN  90  -8.331   8.568  10.694
  571    H    PHE  91           H        PHE  91 -12.942   7.752   8.597
  572    HA   PHE  91           HA       PHE  91 -13.371  10.734   8.674
  573   1HB   PHE  91           HB2      PHE  91 -11.195   9.354   7.532
  574   2HB   PHE  91           HB1      PHE  91 -12.298   9.486   6.153
  575    HD1  PHE  91           HD1      PHE  91 -11.066  11.502   9.124
  576    HD2  PHE  91           HD2      PHE  91 -11.785  11.504   4.872
  577    HE1  PHE  91           HE1      PHE  91 -10.106  13.775   8.963
  578    HE2  PHE  91           HE2      PHE  91 -10.735  13.741   4.705
  579    HZ   PHE  91           HZ       PHE  91  -9.897  14.884   6.746
  580    H    GLY  92           H        GLY  92 -15.445   8.780   9.170
  581   1HA   GLY  92           HA1      GLY  92 -17.625   8.484   8.409
  582   2HA   GLY  92           HA2      GLY  92 -17.287   9.668   7.123
   
  No H/Q in entry =         582