*HEADER    TOXIN                                   08-SEP-16   5LUE              
*TITLE     MINOR FORM OF THE RECOMBINANT CYTOTOXIN-1 FROM N. OXIANA              
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: VC-1=CYTOTOXIN;                                            
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: CYTOTOXIN-1;                                                
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: NAJA OXIANA;                                    
*SOURCE   3 ORGANISM_COMMON: CENTRAL ASIAN COBRA;                                
*SOURCE   4 ORGANISM_TAXID: 8657;                                                
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3);                       
*SOURCE   6 EXPRESSION_SYSTEM_TAXID: 469008;                                     
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PET-22B(+)                            
*KEYWDS    TOXIN, CYTOLYTIC PEPTIDE, ALL-BETA SHEET PROTEIN, COBRA VENOM,        
*KEYWDS   2 STRUCTURE FROM MOLMOL                                                
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    P.V.DUBOVSKII,M.A.DUBINNYI,M.A.SHULEPKO,E.N.LYUKMANOVA,D.A.DOLGIKH,   
*AUTHOR   2 M.P.KIRPICHNIKOV,R.G.EFREMOV                                         
*REVDAT   1   20-SEP-17 5LUE    0                                                
# Restraints file 1: CT1m_AllConstr_070916.mr
  4 CYS  HA     5 ASN  H       2.71
  4 CYS  HB3    5 ASN  H       3.14
  5 ASN  H     59 ARG  HA      3.08
  5 ASN  H      5 ASN  HA      2.71
 23 TYR  H     23 TYR  HB2     2.96
 23 TYR  H     23 TYR  HB3     3.70
 23 TYR  H     39 CYS  HA      3.48
 23 TYR  H     38 GLY  H       2.99
  5 ASN  HB3    6 LYS  H       3.08
  6 LYS  H      7 LEU  H       2.77
  6 LYS  H      6 LYS  HB2     2.65
  6 LYS  H      6 LYS  HA      3.45
  6 LYS  H      6 LYS  HB3     5.50
  5 ASN  HB2    6 LYS  H       3.52
  5 ASN  HA     6 LYS  H       2.52
 13 LYS  H     13 LYS  HB2     3.86
 13 LYS  H     13 LYS  HA      3.27
 12 TYR  HB2   13 LYS  H       3.45
 12 TYR  HA    13 LYS  H       3.08
 13 LYS  H     13 LYS  HB3     4.91
 10 ILE  H     11 ALA  HA      4.14
  9 PRO  HA    10 ILE  H       3.58
 10 ILE  H     10 ILE  HA      3.21
  9 PRO  HB3   10 ILE  H       4.48
 10 ILE  H     10 ILE  HB      3.02
 25 MET  H     36 LYS  H       3.27
 25 MET  H     25 MET  HB3     2.96
 25 MET  H     25 MET  HA      3.76
 15 CYS  H     15 CYS  HB2     2.71
 15 CYS  H     15 CYS  HA      3.08
 14 THR  HA    15 CYS  H       2.40
  3 LYS  HA    15 CYS  H       2.90
  4 CYS  H     15 CYS  H       3.42
 59 ARG  H     59 ARG  HB3     4.54
 58 ASP  HB3   59 ARG  H       3.70
 59 ARG  H     60 CYS  H       3.14
 59 ARG  H     59 ARG  HB2     4.04
 58 ASP  HA    59 ARG  H       2.90
 59 ARG  H     59 ARG  HA      2.77
  7 LEU  H      7 LEU  HA      2.96
  7 LEU  H      7 LEU  HB3     3.33
  6 LYS  HB2    7 LEU  H       3.45
  6 LYS  HB3    7 LEU  H       2.65
  8 VAL  H      8 VAL  HB      2.93
  7 LEU  HA     8 VAL  H       2.52
  8 VAL  H      8 VAL  HA      3.05
 55 CYS  H     55 CYS  HA      3.24
 54 CYS  HB3   55 CYS  H       2.96
 54 CYS  HA    55 CYS  H       2.71
 55 CYS  H     55 CYS  HB3     4.32
 54 CYS  HB2   55 CYS  H       3.30
 22 CYS  H     55 CYS  H       3.05
 55 CYS  H     55 CYS  HB2     3.92
 23 TYR  HA    55 CYS  H       3.33
 11 ALA  HA    12 TYR  H       2.86
 12 TYR  H     12 TYR  HB3     3.55
 12 TYR  H     12 TYR  HB2     3.64
 12 TYR  H     12 TYR  HA      3.21
 36 LYS  HB3   37 ARG  H       3.27
 37 ARG  H     37 ARG  HA      3.39
 37 ARG  H     37 ARG  HB3     3.36
 36 LYS  HA    37 ARG  H       2.52
  4 CYS  H      4 CYS  HA      3.11
  4 CYS  H     13 LYS  H       3.24
  4 CYS  H      4 CYS  HB2     2.96
  3 LYS  HB3    4 CYS  H       2.93
  4 CYS  H      4 CYS  HB3     3.52
  3 LYS  HA     4 CYS  H       2.40
 10 ILE  H     11 ALA  H       3.42
 11 ALA  H     11 ALA  HA      3.11
 10 ILE  HB    11 ALA  H       3.39
 35 VAL  H     35 VAL  HA      3.17
 34 PRO  HA    35 VAL  H       2.52
 35 VAL  H     36 LYS  H       2.49
 26 PHE  HA    35 VAL  H       3.21
  5 ASN  H     61 ASN  H       3.45
 61 ASN  H     61 ASN  HA      2.93
 60 CYS  HB3   61 ASN  H       3.83
 61 ASN  H     61 ASN  HB2     3.21
 61 ASN  H     61 ASN  HB3     3.52
 37 ARG  HB2   38 GLY  H       3.14
 38 GLY  H     38 GLY  HA1     2.90
 37 ARG  HA    38 GLY  H       2.43
 38 GLY  H     38 GLY  HA2     2.90
 37 ARG  HB3   38 GLY  H       3.24
  5 ASN  H     61 ASN  HD22    3.14
  5 ASN  H      5 ASN  HD22    4.54
 23 TYR  H     61 ASN  HD22    4.38
 23 TYR  H     61 ASN  HD21    3.33
 61 ASN  HA    61 ASN  HD22    5.50
 61 ASN  HB2   61 ASN  HD22    4.97
 61 ASN  HB3   61 ASN  HD22    4.26
  6 LYS  H      6 LYS  HG3     4.88
  6 LYS  H      6 LYS  HE3     5.50
  6 LYS  H      6 LYS  HG2     3.95
  6 LYS  H      6 LYS  HE2     5.50
  6 LYS  H      6 LYS  QD      6.38
 13 LYS  H     13 LYS  HG3     5.19
 13 LYS  H     13 LYS  QE      6.38
 13 LYS  H     13 LYS  QD      6.38
 13 LYS  H     13 LYS  HG2     5.10
 10 ILE  H     10 ILE  HG13    3.83
  9 PRO  HG3   10 ILE  H       5.50
 10 ILE  H     10 ILE  HG12    4.51
 25 MET  H     25 MET  HG3     3.58
 25 MET  H     25 MET  HG2     5.19
 59 ARG  H     59 ARG  HE      3.95
 59 ARG  H     59 ARG  HG3     4.57
 59 ARG  H     59 ARG  HG2     4.17
 59 ARG  H     59 ARG  HD3     5.50
 59 ARG  H     59 ARG  HD2     4.91
 61 ASN  HD22  61 ASN  HD21    2.40
 61 ASN  HA    61 ASN  HD21    5.19
 61 ASN  HB2   61 ASN  HD21    4.45
 61 ASN  HB3   61 ASN  HD21    3.52
  5 ASN  HB3    5 ASN  HD22    4.51
  5 ASN  HB2    5 ASN  HD22    3.52
  5 ASN  HA     5 ASN  HD22    5.50
 12 TYR  H     12 TYR  QD      7.64
 12 TYR  H     12 TYR  QE      6.98
  5 ASN  H      5 ASN  HD21    4.35
  5 ASN  HB3    5 ASN  HD21    3.92
  5 ASN  HD22   5 ASN  HD21    2.40
  5 ASN  HB2    5 ASN  HD21    3.08
  5 ASN  HA     5 ASN  HD21    5.50
 37 ARG  H     37 ARG  QD      6.38
 37 ARG  H     37 ARG  QG      6.38
  4 CYS  H     13 LYS  HB2     4.23
 10 ILE  HG12  11 ALA  H       4.60
 34 PRO  HG2   35 VAL  H       5.31
 34 PRO  HG3   35 VAL  H       5.34
 61 ASN  H     61 ASN  HD22    5.28
 22 CYS  HB3   61 ASN  H       4.04
 61 ASN  H     61 ASN  HD21    3.11
  5 ASN  HD22  61 ASN  H       4.32
 38 GLY  H     61 ASN  HD22    3.42
 38 GLY  H     61 ASN  HD21    2.86
 10 ILE  H     10 ILE  QD1     5.04
 10 ILE  H     10 ILE  QG2     6.53
 14 THR  QG2   15 CYS  H       3.86
  7 LEU  H      7 LEU  QD1     5.41
  7 LEU  H      7 LEU  QD2     6.53
  8 VAL  H      8 VAL  QG2     4.30
  8 VAL  H      8 VAL  QG1     4.36
 10 ILE  QG2   12 TYR  H       4.64
 11 ALA  QB    12 TYR  H       5.32
 10 ILE  QD1   11 ALA  H       4.48
 11 ALA  H     11 ALA  QB      4.39
 35 VAL  H     35 VAL  QG2     4.88
 35 VAL  H     35 VAL  QG1     3.86
#disulfide bonds
  3 CYSS SG    21 CYSS SG      2.10
  3 CYSS SG    21 CYSS CB      3.10
  3 CYSS CB    21 CYSS SG      3.10
 14 CYSS SG    38 CYSS SG      2.10
 14 CYSS SG    38 CYSS CB      3.10
 14 CYSS CB    38 CYSS SG      3.10
 42 CYSS SG    53 CYSS SG      2.10
 42 CYSS SG    53 CYSS CB      3.10
 42 CYSS CB    53 CYSS SG      3.10
 54 CYSS SG    59 CYSS SG      2.10
 54 CYSS SG    59 CYSS CB      3.10
 54 CYSS CB    59 CYSS SG      3.10
#hydrogen bonds
  3 CYSS HN    12 LYS  O       2.20
  3 CYSS HN    12 LYS  C       3.50
  3 CYSS N     12 LYS  O       3.30
  5 LYS  HN    10 ALA  O       2.20
  5 LYS  HN    10 ALA  C       3.50
  5 LYS  N     10 ALA  O       3.30
  3 CYSS O     12 LYS  HN      2.20
  3 CYSS C     12 LYS  HN      3.50
  3 CYSS O     12 LYS  N       3.30
  1 LEU  O     14 CYSS HN      2.20
  1 LEU  C     14 CYSS HN      3.50
  1 LEU  O     14 CYSS N       3.30
 15 PRO  O     18 LYS  HN      2.20
 15 PRO  C     18 LYS  HN      3.50
 15 PRO  O     18 LYS  N       3.30
 19 ASN  HN    39 ILE  O       2.20
 19 ASN  HN    39 ILE  C       3.50
 19 ASN  N     39 ILE  O       3.30
 20 LEU  HN    39 ILE  O       2.20
 20 LEU  HN    39 ILE  C       3.50
 20 LEU  N     39 ILE  O       3.30
 21 CYSS HN    54 CYSS O       2.20
 21 CYSS HN    54 CYSS C       3.50
 21 CYSS N     54 CYSS O       3.30
 22 TYR  HN    37 GLY  O       2.20
 22 TYR  HN    37 GLY  C       3.50
 22 TYR  N     37 GLY  O       3.30
 23 LYS  HN    52 VAL  O       2.20
 23 LYS  HN    52 VAL  C       3.50
 23 LYS  N     52 VAL  O       3.30
 24 MET  HN    35 LYS  O       2.20
 24 MET  HN    35 LYS  C       3.50
 24 MET  N     35 LYS  O       3.30
 25 PHE  HN    50 LYS  O       2.20
 25 PHE  HN    50 LYS  C       3.50
 25 PHE  N     50 LYS  O       3.30
 27 MET  HN    48 LEU  O       2.20
 27 MET  HN    48 LEU  C       3.50
 27 MET  N     48 LEU  O       3.30
 24 MET  O     34 VAL  HN      2.20
 24 MET  C     34 VAL  HN      3.50
 24 MET  O     34 VAL  N       3.30
 24 MET  O     35 LYS  HN      2.20
 24 MET  C     35 LYS  HN      3.50
 24 MET  O     35 LYS  N       3.30
 22 TYR  O     37 GLY  HN      2.20
 22 TYR  C     37 GLY  HN      3.50
 22 TYR  O     37 GLY  N       3.30
 20 LEU  O     39 ILE  HN      2.20
 20 LEU  C     39 ILE  HN      3.50
 20 LEU  O     39 ILE  N       3.30
 46 SER  HN    49 VAL  O       2.20
 46 SER  HN    49 VAL  C       3.50
 46 SER  N     49 VAL  O       3.30
 25 PHE  O     50 LYS  HN      2.20
 25 PHE  C     50 LYS  HN      3.50
 25 PHE  O     50 LYS  N       3.30
 23 LYS  O     52 VAL  HN      2.20
 23 LYS  C     52 VAL  HN      3.50
 23 LYS  O     52 VAL  N       3.30
 21 CYSS O     54 CYSS HN      2.20
 21 CYSS C     54 CYSS HN      3.50
 21 CYSS O     54 CYSS N       3.30
 54 CYSS O     56 THR  HN      2.20
 54 CYSS C     56 THR  HN      3.50
 54 CYSS O     56 THR  N       3.30
  2 LYS  O     58 ARG  HN      2.20
  2 LYS  C     58 ARG  HN      3.50
  2 LYS  O     58 ARG  N       3.30
 26 MET  N     71 WATQ O       3.40
 26 MET  HN    71 WATQ O       2.30
 26 MET  N     71 WATQ H3      2.40
 26 MET  HN    71 WATQ H3      1.30
 29 ASP  O     71 WATQ H1      2.10
 29 ASP  O     71 WATQ O       3.10
 29 ASP  C     71 WATQ H1      3.30
 29 ASP  C     71 WATQ O       4.30
 32 ILE  O     71 WATQ H2      2.10
 32 ILE  O     71 WATQ O       3.10
 32 ILE  C     71 WATQ H2      3.30
 32 ILE  C     71 WATQ O       4.30
  2 LYS  HN    57 ASP  OD1     2.20
  2 LYS  HN    57 ASP  CG      3.50
  2 LYS  N     57 ASP  OD1     3.30
 22 TYR  O     60 ASN  HD21    2.20
 22 TYR  C     60 ASN  HD21    3.50
 22 TYR  O     60 ASN  ND2     3.30
 46 SER  HG    49 VAL  HN      2.20
 46 SER  OG    49 VAL  N       3.50
 46 SER  HG    49 VAL  N       3.30
 45 ASN  OD1   51 TYR  HN      2.20
 45 ASN  OD1   51 TYR  N       3.50
 45 ASN  CG    51 TYR  HN      3.30
#dihedral angle constraints
   1 MET   PHI    -166.6   -65.9
   1 MET   PSI      62.8   192.9
   1 MET   CHI1   -215.0   105.0
   1 MET   CHI2   -325.0   -35.0
   2 LEU   PHI    -110.0   -50.0
   2 LEU   PSI     180.0   195.0
   3 LYS   PHI    -140.0  -100.0
   3 LYS   PSI     100.0   150.0
   4 CYS   PHI    -146.9   -72.9
   4 CYS   PSI      93.7   157.6
   4 CYS   CHI1    -80.0   -40.0
   5 ASN   PHI    -120.0   -80.0
   5 ASN   PSI     100.0   180.0
   6 LYS   PHI    -152.5   -77.2
   6 LYS   PSI    -100.0   -60.0
   7 LEU   PHI    -180.6   -78.3
   7 LEU   PSI      63.2   135.7
   8 VAL   PHI    -129.1   -57.3
   8 VAL   PSI     124.2   162.7
   9 PRO   PSI     -50.0   -15.0
  10 ILE   PHI    -129.9   -78.5
  10 ILE   PSI     -20.0    20.0
  11 ALA   PHI     -50.0   -20.0
  11 ALA   PSI     111.8   151.8
  12 TYR   PHI    -169.2  -126.1
  12 TYR   PSI     141.2   181.2
  13 LYS   PHI    -151.4   -96.7
  13 LYS   PSI     111.8   161.8
  14 THR   PHI    -122.3   -77.8
  14 THR   PSI      98.4   138.4
  15 CYS   PHI    -146.5   -63.3
  15 CYS   PSI      70.0   166.8
  16 PRO   PSI     131.2   171.2
  15 CYS   PHI     -75.0   -65.0
  15 CYS   PSI     120.0   180.0
  15 CYS   CHI1    -75.0   -45.0
  16 PRO   PSI     100.0   160.0
  17 GLU   PHI     -75.0   -45.0
  17 GLU   CHI1   -200.0  -160.0
  17 GLU   PSI     120.0   160.0
  18 GLY   PHI      30.0    90.0
  18 GLY   PSI    -105.0   105.0
  19 LYS   PHI    -125.0   -80.0
  19 LYS   CHI1    -80.0   -40.0
  19 LYS   PSI     145.0   185.0
  20 ASN   PHI    -150.0  -105.0
  20 ASN   CHI1    160.0   200.0
  20 ASN   PSI     -65.0    -0.0
  21 LEU   PHI    -100.0   -80.0
  21 LEU   CHI1    -90.0   -30.0
  21 LEU   CHI2     75.0   245.0
  21 LEU   PSI     145.0   175.0
  22 CYS   PHI    -135.0  -105.0
  22 CYS   CHI1    -85.0   -35.0
  22 CYS   PSI    -225.0   -65.0
  23 TYR   PHI    -135.0  -105.0
  23 TYR   PSI      55.0   185.0
  23 TYR   CHI1     40.0    80.0
  24 LYS   PHI    -145.0   -95.0
  24 LYS   CHI1     40.0    80.0
  24 LYS   CHI2     15.0   315.0
  24 LYS   PSI     110.0   180.0
  25 MET   PHI    -145.0   -95.0
  25 MET   CHI1    -85.0   -35.0
  25 MET   CHI2   -315.0   -35.0
  25 MET   PSI     125.0   185.0
  26 PHE   PHI    -145.0   -95.0
  26 PHE   CHI1    -75.0   -45.0
  26 PHE   PSI     125.0   195.0
  27 MET   PHI    -141.0  -100.0
  27 MET   CHI1    -85.0   -45.0
  27 MET   PSI     120.0   160.0
  28 MET   PHI     -75.0   -25.0
  28 MET   CHI1    -85.0   -35.0
  28 MET   PSI     -80.0   -20.0
  29 SER   PHI     -95.0   -35.0
  29 SER   CHI1    160.0   200.0
  29 SER   PSI     -95.0   -55.0
  30 ASP   PHI     -95.0   -35.0
  30 ASP   CHI1   -200.0  -160.0
  30 ASP   PSI      55.0   125.0
  31 LEU   PHI     -85.0   -65.0
  31 LEU   CHI1    -85.0   -35.0
  31 LEU   PSI     -85.0     5.0
  32 THR   PHI    -120.0   -55.0
  32 THR   CHI1    -85.0   -35.0
  32 THR   PSI     -85.0    65.0
  33 ILE   PHI    -160.0  -110.0
  33 ILE   CHI1    -85.0   -45.0
  33 ILE   CHI21    25.0   315.0
  33 ILE   PSI      80.0   130.0
  34 PRO   PSI     125.0   180.0
  35 VAL   PHI    -135.0  -105.0
  35 VAL   CHI1    -80.0   -40.0
  35 VAL   PSI     -85.0    45.0
  36 LYS   PHI    -160.0  -120.0
  36 LYS   CHI1    -85.0   -35.0
  36 LYS   CHI2   -295.0   -25.0
  36 LYS   PSI     105.0   185.0
  37 ARG   PHI    -180.0  -120.0
  37 ARG   CHI1    -85.0   -35.0
  37 ARG   PSI      85.0   195.0
  38 GLY   PHI    -195.0  -115.0
  38 GLY   PSI    -275.0   -85.0
  39 CYS   PHI    -145.0   -95.0
  39 CYS   CHI1    -85.0   -45.0
  39 CYS   PSI     120.0   175.0
  40 ILE   PHI    -165.0  -125.0
  40 ILE   CHI1   -195.0  -165.0
  40 ILE   PSI     120.0   180.0
  41 ASP   PHI    -100.0   -80.0
  41 ASP   PSI     -85.0     0.0
  41 ASP   CHI1     40.0    80.0
  42 VAL   PHI    -125.0  -105.0
  42 VAL   CHI1    165.0   215.0
  42 VAL   PSI     101.0   152.0
  43 CYS   PHI     -75.0   -65.0
  43 CYS   CHI1   -205.0  -155.0
  43 CYS   PSI      90.0   140.0
  44 PRO   PSI     100.0   140.0
  45 LYS   PHI     -85.0   -55.0
  45 LYS   CHI1    -85.0   -45.0
  45 LYS   CHI2     15.0   335.0
  45 LYS   PSI     105.0   195.0
  46 ASN   PHI    -105.0   -60.0
  46 ASN   CHI1    -85.0   -35.0
  46 ASN   CHI2   -155.0    75.0
  46 ASN   PSI      75.0   165.0
  47 SER   PHI    -162.0   -95.0
  47 SER   CHI1     40.0    80.0
  47 SER   PSI     130.0   180.0
  48 LEU   PHI     -95.0   -55.0
  48 LEU   CHI1    -80.0   -40.0
  48 LEU   CHI2     85.0   235.0
  48 LEU   PSI     -60.0    -5.0
  49 LEU   PHI     -95.0   -35.0
  49 LEU   CHI1    -80.0   -40.0
  49 LEU   PSI     -60.0   -20.0
  50 VAL   PHI    -130.0  -105.0
  50 VAL   CHI1    -80.0   -40.0
  50 VAL   PSI     120.0   160.0
  51 LYS   PHI    -155.0   -25.0
  51 LYS   CHI1   -195.0  -165.0
  51 LYS   CHI2     15.0   345.0
  51 LYS   PSI     120.0   175.0
  52 TYR   PHI    -140.0  -100.0
  52 TYR   CHI1    -85.0   -35.0
  52 TYR   PSI     100.0   140.0
  53 VAL   PHI    -140.0  -100.0
  53 VAL   CHI1   -200.0  -160.0
  53 VAL   PSI     120.0   160.0
  54 CYS   PHI    -145.0   -95.0
  54 CYS   CHI1    -85.0   -35.0
  54 CYS   PSI     125.0   185.0
  55 CYS   PHI    -185.0  -125.0
  55 CYS   CHI1     40.0    80.0
  55 CYS   PSI     105.0   185.0
  56 ASN   PHI    -160.0   -80.0
  56 ASN   PSI     -70.0    60.0
  56 ASN   CHI1     40.0    80.0
  57 THR   PHI    -165.0  -110.0
  57 THR   CHI1     15.0    95.0
  57 THR   PSI     155.0   185.0
  58 ASP   PHI    -115.0   -70.0
  58 ASP   CHI1    -85.0   -45.0
  58 ASP   PSI     125.0   165.0
  59 ARG   PHI      30.0    70.0
  59 ARG   CHI1    -75.0   -45.0
  59 ARG   CHI2   -335.0   -15.0
  59 ARG   PSI      20.0    80.0
  60 CYS   PHI     -85.0   -30.0
  60 CYS   CHI1     40.0    80.0
  60 CYS   PSI     -60.0   -20.0
  61 ASN   PHI    -160.0   -80.0
  61 ASN   CHI1     40.0    80.0
  61 ASN   CHI2   -105.0   125.0
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   0          1H        MET   0  -8.203  11.982  -2.369
    2    H2   MET   0          2H        MET   0  -6.736  11.917  -2.674
    3    H    MET   0           H        MET   0  -7.699  11.001  -3.414
    4    H3   MET   0          3H        MET   0  -7.695  11.033  -3.413
    5    HA   MET   0           HA       MET   0  -6.300  10.377  -1.089
    6    HB2  MET   0          1HB       MET   0  -9.303  10.534  -0.757
    7    HB3  MET   0          2HB       MET   0  -8.240   9.625   0.345
    8    HG2  MET   0          1HG       MET   0  -7.119  11.640   1.030
    9    HG3  MET   0          2HG       MET   0  -7.975  12.593  -0.205
   10    HE1  MET   0          1HE       MET   0  -9.880  10.855   3.642
   11    HE2  MET   0          2HE       MET   0  -9.246   9.818   2.341
   12    HE3  MET   0          3HE       MET   0  -8.138  10.850   3.279
   13    H    LEU   1           H        LEU   1  -5.478   8.628  -2.291
   14    HA   LEU   1           HA       LEU   1  -7.173   7.292  -4.120
   15    HB2  LEU   1          1HB       LEU   1  -4.445   7.298  -3.188
   16    HB3  LEU   1          2HB       LEU   1  -4.855   5.736  -3.931
   17    HG   LEU   1           HG       LEU   1  -5.736   7.270  -5.896
   18   HD11  LEU   1          1HD1      LEU   1  -4.285   9.297  -6.180
   19   HD12  LEU   1          2HD1      LEU   1  -5.279   9.415  -4.709
   20   HD13  LEU   1          3HD1      LEU   1  -3.557   8.981  -4.588
   21   HD21  LEU   1          1HD2      LEU   1  -3.535   7.063  -7.000
   22   HD22  LEU   1          2HD2      LEU   1  -2.797   6.698  -5.421
   23   HD23  LEU   1          3HD2      LEU   1  -4.003   5.590  -6.118
   24    H    LYS   2           H        LYS   2  -6.829   4.663  -4.112
   25    HA   LYS   2           HA       LYS   2  -7.610   3.804  -1.413
   26    HB2  LYS   2          1HB       LYS   2  -8.624   2.694  -4.042
   27    HB3  LYS   2          2HB       LYS   2  -9.178   2.274  -2.404
   28    HG2  LYS   2          1HG       LYS   2  -9.530   4.970  -3.760
   29    HG3  LYS   2          2HG       LYS   2 -10.791   3.727  -3.588
   30    HD2  LYS   2          1HD       LYS   2 -10.527   3.871  -1.110
   31    HD3  LYS   2          2HD       LYS   2  -9.371   5.202  -1.345
   32    HE2  LYS   2          1HE       LYS   2 -12.261   5.191  -2.268
   33    HE3  LYS   2          2HE       LYS   2 -11.648   6.008  -0.812
   34    HZ1  LYS   2          1HZ       LYS   2 -11.847   7.523  -2.665
   35    HZ2  LYS   2          2HZ       LYS   2 -10.263   7.362  -2.234
   36    HZ3  LYS   2          3HZ       LYS   2 -10.832   6.603  -3.584
   37    H    CYS   3           H        CYS   3  -6.745   1.850  -0.680
   38    HA   CYS   3           HA       CYS   3  -4.741   0.702  -2.483
   39    HB2  CYS   3          1HB       CYS   3  -4.772   0.780   0.537
   40    HB3  CYS   3          2HB       CYS   3  -3.556  -0.035  -0.451
   41    HG   CYS   3           HG       CYS   3  -2.526   2.148   0.597
   42    H    ASN   4           H        ASN   4  -4.575  -1.673  -2.469
   43    HA   ASN   4           HA       ASN   4  -7.244  -2.708  -2.194
   44    HB2  ASN   4          1HB       ASN   4  -6.160  -3.159  -4.457
   45    HB3  ASN   4          2HB       ASN   4  -4.805  -3.571  -3.378
   46   HD21  ASN   4          1HD2      ASN   4  -5.693  -6.840  -4.339
   47   HD22  ASN   4          2HD2      ASN   4  -4.689  -5.481  -4.719
   48    H    LYS   5           H        LYS   5  -7.773  -4.445  -0.768
   49    HA   LYS   5           HA       LYS   5  -5.576  -5.401   0.920
   50    HB2  LYS   5          1HB       LYS   5  -8.247  -4.243   1.765
   51    HB3  LYS   5          2HB       LYS   5  -7.184  -5.176   2.846
   52    HG2  LYS   5          1HG       LYS   5  -6.520  -2.529   1.512
   53    HG3  LYS   5          2HG       LYS   5  -6.925  -2.768   3.228
   54    HD2  LYS   5          1HD       LYS   5  -4.530  -3.934   1.767
   55    HD3  LYS   5          2HD       LYS   5  -4.497  -2.572   2.912
   56    HE2  LYS   5          1HE       LYS   5  -5.427  -4.101   4.660
   57    HE3  LYS   5          2HE       LYS   5  -5.260  -5.446   3.507
   58    HZ1  LYS   5          1HZ       LYS   5  -3.382  -5.314   4.997
   59    HZ2  LYS   5          2HZ       LYS   5  -2.898  -5.018   3.448
   60    HZ3  LYS   5          3HZ       LYS   5  -3.052  -3.771   4.517
   61    H    LEU   6           H        LEU   6  -9.155  -5.806   1.125
   62    HA   LEU   6           HA       LEU   6  -8.739  -8.663   1.113
   63    HB2  LEU   6          1HB       LEU   6 -10.115  -7.703   2.682
   64    HB3  LEU   6          2HB       LEU   6 -11.206  -6.879   1.545
   65    HG   LEU   6           HG       LEU   6 -11.819  -9.186   0.662
   66   HD11  LEU   6          1HD1      LEU   6 -11.422 -11.098   2.237
   67   HD12  LEU   6          2HD1      LEU   6  -9.888 -10.414   1.650
   68   HD13  LEU   6          3HD1      LEU   6 -10.473 -10.018   3.284
   69   HD21  LEU   6          1HD2      LEU   6 -13.424  -9.628   2.486
   70   HD22  LEU   6          2HD2      LEU   6 -12.512  -8.514   3.535
   71   HD23  LEU   6          3HD2      LEU   6 -13.317  -7.902   2.070
   72    H    VAL   7           H        VAL   7  -9.181 -10.051  -0.551
   73    HA   VAL   7           HA       VAL   7  -9.556  -8.951  -3.125
   74    HB   VAL   7           HB       VAL   7  -9.737 -11.339  -3.836
   75   HG11  VAL   7          1HG1      VAL   7  -7.519 -12.080  -3.037
   76   HG12  VAL   7          2HG1      VAL   7  -7.501 -10.354  -3.468
   77   HG13  VAL   7          3HG1      VAL   7  -7.565 -10.844  -1.758
   78   HG21  VAL   7          1HG2      VAL   7  -9.580 -13.132  -2.184
   79   HG22  VAL   7          2HG2      VAL   7  -9.702 -11.934  -0.873
   80   HG23  VAL   7          3HG2      VAL   7 -11.067 -12.175  -1.990
   81    HA   PRO   8           HA       PRO   8 -10.230  -9.830  -4.827
   82    HB2  PRO   8          1HB       PRO   8 -11.544  -9.145  -7.077
   83    HB3  PRO   8          2HB       PRO   8 -11.805 -10.749  -6.379
   84    HG2  PRO   8          1HG       PRO   8 -13.483  -8.241  -6.080
   85    HG3  PRO   8          2HG       PRO   8 -14.011  -9.907  -6.356
   86    HD2  PRO   8          1HD       PRO   8 -13.982  -8.721  -3.838
   87    HD3  PRO   8          2HD       PRO   8 -13.845 -10.467  -4.078
   88    H    ILE   9           H        ILE   9 -12.393  -7.116  -4.383
   89    HA   ILE   9           HA       ILE   9 -10.277  -5.430  -5.527
   90    HB   ILE   9           HB       ILE   9 -13.307  -5.034  -5.572
   91   HG12  ILE   9          1HG1      ILE   9 -12.646  -6.776  -7.059
   92   HG13  ILE   9          2HG1      ILE   9 -13.139  -5.323  -7.960
   93   HG21  ILE   9          1HG2      ILE   9 -12.801  -3.090  -7.013
   94   HG22  ILE   9          2HG2      ILE   9 -12.062  -2.904  -5.405
   95   HG23  ILE   9          3HG2      ILE   9 -11.059  -3.382  -6.795
   96   HD11  ILE   9          1HD1      ILE   9 -11.161  -6.375  -8.984
   97   HD12  ILE   9          2HD1      ILE   9 -10.773  -4.758  -8.348
   98   HD13  ILE   9          3HD1      ILE   9 -10.279  -6.211  -7.448
   99    H    ALA  10           H        ALA  10 -12.259  -6.215  -2.781
  100    HA   ALA  10           HA       ALA  10 -12.992  -3.865  -1.714
  101    HB1  ALA  10          1HB       ALA  10 -11.955  -5.376   0.450
  102    HB2  ALA  10          2HB       ALA  10 -13.624  -5.375  -0.175
  103    HB3  ALA  10          3HB       ALA  10 -12.443  -6.555  -0.792
  104    H    TYR  11           H        TYR  11 -12.068  -2.141  -0.558
  105    HA   TYR  11           HA       TYR  11  -9.140  -2.096  -0.559
  106    HB2  TYR  11          1HB       TYR  11  -9.214   0.100  -1.673
  107    HB3  TYR  11          2HB       TYR  11  -9.714  -1.263  -2.703
  108    HD1  TYR  11          1HD       TYR  11 -10.861   1.761  -0.928
  109    HD2  TYR  11          2HD       TYR  11 -12.002  -1.449  -3.493
  110    HE1  TYR  11          1HE       TYR  11 -12.981   2.936  -1.443
  111    HE2  TYR  11          2HE       TYR  11 -14.121  -0.291  -4.018
  112    HH   TYR  11           HH       TYR  11 -15.409   1.554  -3.660
  113    H    LYS  12           H        LYS  12  -8.259  -0.174   0.622
  114    HA   LYS  12           HA       LYS  12 -10.225   0.870   2.538
  115    HB2  LYS  12          1HB       LYS  12  -7.267   0.273   2.785
  116    HB3  LYS  12          2HB       LYS  12  -8.150   1.287   3.950
  117    HG2  LYS  12          1HG       LYS  12  -9.677  -0.659   4.378
  118    HG3  LYS  12          2HG       LYS  12  -8.619  -1.651   3.348
  119    HD2  LYS  12          1HD       LYS  12  -6.728  -1.227   4.841
  120    HD3  LYS  12          2HD       LYS  12  -7.744  -0.171   5.852
  121    HE2  LYS  12          1HE       LYS  12  -9.239  -2.112   6.295
  122    HE3  LYS  12          2HE       LYS  12  -8.116  -3.145   5.382
  123    HZ1  LYS  12          1HZ       LYS  12  -7.714  -3.267   7.747
  124    HZ2  LYS  12          2HZ       LYS  12  -6.412  -2.599   6.985
  125    HZ3  LYS  12          3HZ       LYS  12  -7.455  -1.641   7.833
  126    H    THR  13           H        THR  13 -10.013   3.127   3.143
  127    HA   THR  13           HA       THR  13  -9.203   4.652   0.805
  128    HB   THR  13           HB       THR  13 -10.672   5.453   3.365
  129    HG1  THR  13          1HG       THR  13 -12.497   5.449   1.920
  130   HG21  THR  13          1HG2      THR  13 -11.267   7.497   2.111
  131   HG22  THR  13          2HG2      THR  13  -9.504   7.349   2.294
  132   HG23  THR  13          3HG2      THR  13 -10.275   6.947   0.743
  133    H    CYS  14           H        CYS  14  -7.395   5.816   0.623
  134    HA   CYS  14           HA       CYS  14  -5.498   5.707   2.701
  135    HB2  CYS  14          1HB       CYS  14  -5.594   7.235   0.103
  136    HB3  CYS  14          2HB       CYS  14  -4.212   7.281   1.203
  137    HG   CYS  14           HG       CYS  14  -3.648   5.757  -0.868
  138    HA   PRO  15           HA       PRO  15  -6.617   9.363   4.815
  139    HB2  PRO  15          1HB       PRO  15  -4.348  10.020   6.146
  140    HB3  PRO  15          2HB       PRO  15  -5.266   8.585   6.619
  141    HG2  PRO  15          1HG       PRO  15  -2.851   8.782   4.784
  142    HG3  PRO  15          2HG       PRO  15  -3.153   7.641   6.101
  143    HD2  PRO  15          1HD       PRO  15  -3.613   6.954   3.486
  144    HD3  PRO  15          2HD       PRO  15  -4.616   6.309   4.792
  145    H    GLU  16           H        GLU  16  -6.570  11.659   4.844
  146    HA   GLU  16           HA       GLU  16  -5.812  12.752   2.443
  147    HB2  GLU  16          1HB       GLU  16  -7.422  13.742   3.998
  148    HB3  GLU  16          2HB       GLU  16  -6.118  14.046   5.172
  149    HG2  GLU  16          1HG       GLU  16  -5.086  15.694   3.534
  150    HG3  GLU  16          2HG       GLU  16  -6.415  15.236   2.445
  151    HE2  GLU  16           HE       GLU  16  -7.396  18.200   4.257
  152    H    GLY  17           H        GLY  17  -3.932  13.679   1.638
  153    HA2  GLY  17          1HA       GLY  17  -1.857  14.740   1.870
  154    HA3  GLY  17          2HA       GLY  17  -1.695  14.097   3.493
  155    H    LYS  18           H        LYS  18  -2.702  11.352   2.526
  156    HA   LYS  18           HA       LYS  18  -0.170  10.473   1.391
  157    HB2  LYS  18          1HB       LYS  18  -2.572   9.086   2.597
  158    HB3  LYS  18          2HB       LYS  18  -1.275   8.198   1.763
  159    HG2  LYS  18          1HG       LYS  18  -1.028   8.200   4.243
  160    HG3  LYS  18          2HG       LYS  18   0.354   8.932   3.393
  161    HD2  LYS  18          1HD       LYS  18  -1.642  10.944   3.954
  162    HD3  LYS  18          2HD       LYS  18  -1.229  10.070   5.448
  163    HE2  LYS  18          1HE       LYS  18   1.233  10.409   4.664
  164    HE3  LYS  18          2HE       LYS  18   0.547  11.676   3.622
  165    HZ1  LYS  18          1HZ       LYS  18   1.284  12.561   5.729
  166    HZ2  LYS  18          2HZ       LYS  18  -0.352  12.719   5.590
  167    HZ3  LYS  18          3HZ       LYS  18   0.284  11.544   6.557
  168    H    ASN  19           H        ASN  19  -0.140   9.022  -0.497
  169    HA   ASN  19           HA       ASN  19  -2.390   9.588  -2.247
  170    HB2  ASN  19          1HB       ASN  19  -0.472  11.358  -2.721
  171    HB3  ASN  19          2HB       ASN  19   0.383   9.804  -2.883
  172   HD21  ASN  19          1HD2      ASN  19  -1.767  11.374  -5.932
  173   HD22  ASN  19          2HD2      ASN  19  -1.675  12.121  -4.371
  174    H    LEU  20           H        LEU  20   0.718   7.825  -1.605
  175    HA   LEU  20           HA       LEU  20   0.233   6.124  -3.897
  176    HB2  LEU  20          1HB       LEU  20   2.386   6.197  -1.874
  177    HB3  LEU  20          2HB       LEU  20   2.580   5.331  -3.416
  178    HG   LEU  20           HG       LEU  20   2.382   8.341  -3.016
  179   HD11  LEU  20          1HD1      LEU  20   4.710   8.334  -3.947
  180   HD12  LEU  20          2HD1      LEU  20   4.607   7.366  -2.457
  181   HD13  LEU  20          3HD1      LEU  20   4.650   6.558  -4.042
  182   HD21  LEU  20          1HD2      LEU  20   2.730   8.511  -5.455
  183   HD22  LEU  20          2HD2      LEU  20   2.626   6.737  -5.575
  184   HD23  LEU  20          3HD2      LEU  20   1.215   7.677  -5.035
  185    H    CYS  21           H        CYS  21   0.287   3.764  -3.746
  186    HA   CYS  21           HA       CYS  21  -0.463   2.829  -1.072
  187    HB2  CYS  21          1HB       CYS  21  -1.227   1.822  -3.806
  188    HB3  CYS  21          2HB       CYS  21  -1.461   0.871  -2.338
  189    HG   CYS  21           HG       CYS  21  -3.768   1.859  -3.129
  190    H    TYR  22           H        TYR  22   0.791   1.162  -0.165
  191    HA   TYR  22           HA       TYR  22   3.002   0.198  -1.850
  192    HB2  TYR  22          1HB       TYR  22   4.453   0.309   0.017
  193    HB3  TYR  22          2HB       TYR  22   3.679   1.898  -0.196
  194    HD1  TYR  22          1HD       TYR  22   3.760  -1.156   1.904
  195    HD2  TYR  22          2HD       TYR  22   2.257   2.816   1.508
  196    HE1  TYR  22          1HE       TYR  22   3.005  -1.214   4.263
  197    HE2  TYR  22          2HE       TYR  22   1.498   2.775   3.860
  198    HH   TYR  22           HH       TYR  22   1.363   1.564   5.784
  199    H    LYS  23           H        LYS  23   3.823  -1.959  -1.314
  200    HA   LYS  23           HA       LYS  23   2.182  -3.394   0.646
  201    HB2  LYS  23          1HB       LYS  23   2.410  -5.412  -0.712
  202    HB3  LYS  23          2HB       LYS  23   1.536  -4.130  -1.586
  203    HG2  LYS  23          1HG       LYS  23   3.466  -3.646  -2.945
  204    HG3  LYS  23          2HG       LYS  23   4.482  -4.739  -1.975
  205    HD2  LYS  23          1HD       LYS  23   3.752  -5.713  -4.163
  206    HD3  LYS  23          2HD       LYS  23   3.260  -6.668  -2.744
  207    HE2  LYS  23          1HE       LYS  23   1.020  -5.747  -2.844
  208    HE3  LYS  23          2HE       LYS  23   1.490  -4.663  -4.173
  209    HZ1  LYS  23          1HZ       LYS  23   0.330  -6.606  -4.977
  210    HZ2  LYS  23          2HZ       LYS  23   1.884  -6.606  -5.531
  211    HZ3  LYS  23          3HZ       LYS  23   1.448  -7.611  -4.298
  212    H    MET  24           H        MET  24   3.329  -5.007   1.878
  213    HA   MET  24           HA       MET  24   6.187  -4.418   1.858
  214    HB2  MET  24          1HB       MET  24   4.290  -5.195   4.080
  215    HB3  MET  24          2HB       MET  24   6.058  -5.112   4.275
  216    HG2  MET  24          1HG       MET  24   6.036  -2.734   3.787
  217    HG3  MET  24          2HG       MET  24   4.287  -2.788   3.460
  218    HE1  MET  24          1HE       MET  24   6.147  -3.484   7.651
  219    HE2  MET  24          2HE       MET  24   6.255  -4.667   6.324
  220    HE3  MET  24          3HE       MET  24   7.102  -3.107   6.197
  221    H    PHE  25           H        PHE  25   7.680  -6.112   1.806
  222    HA   PHE  25           HA       PHE  25   6.518  -8.807   1.836
  223    HB2  PHE  25          1HB       PHE  25   8.991  -7.744   0.411
  224    HB3  PHE  25          2HB       PHE  25   8.491  -9.450   0.448
  225    HD1  PHE  25          1HD       PHE  25   7.756  -6.109  -0.862
  226    HD2  PHE  25          2HD       PHE  25   6.642 -10.234  -0.841
  227    HE1  PHE  25          1HE       PHE  25   6.356  -5.739  -2.866
  228    HE2  PHE  25          2HE       PHE  25   5.242  -9.868  -2.846
  229    HZ   PHE  25           HZ       PHE  25   5.099  -7.620  -3.858
  230    H    MET  26           H        MET  26   8.060 -10.544   2.652
  231    HA   MET  26           HA       MET  26   9.924  -9.406   4.591
  232    HB2  MET  26          1HB       MET  26   8.205 -11.889   4.762
  233    HB3  MET  26          2HB       MET  26   9.516 -11.510   5.906
  234    HG2  MET  26          1HG       MET  26   8.338  -9.430   6.533
  235    HG3  MET  26          2HG       MET  26   7.014  -9.861   5.426
  236    HE1  MET  26          1HE       MET  26   8.068 -12.107   9.338
  237    HE2  MET  26          2HE       MET  26   9.158 -12.077   7.930
  238    HE3  MET  26          3HE       MET  26   8.808 -10.574   8.818
  239    H    MET  27           H        MET  27  11.987 -10.421   4.791
  240    HA   MET  27           HA       MET  27  13.062 -11.556   2.569
  241    HB2  MET  27          1HB       MET  27  13.779 -11.718   5.495
  242    HB3  MET  27          2HB       MET  27  14.807 -12.437   4.233
  243    HG2  MET  27          1HG       MET  27  14.039  -9.509   4.444
  244    HG3  MET  27          2HG       MET  27  15.602 -10.205   4.934
  245    HE1  MET  27          1HE       MET  27  17.196 -11.287   1.556
  246    HE2  MET  27          2HE       MET  27  17.447 -11.037   3.302
  247    HE3  MET  27          3HE       MET  27  16.309 -12.283   2.735
  248    H    SER  28           H        SER  28  11.137 -13.065   5.128
  249    HA   SER  28           HA       SER  28  11.718 -15.705   4.367
  250    HB2  SER  28          1HB       SER  28  10.709 -15.149   6.511
  251    HB3  SER  28          2HB       SER  28   9.287 -14.461   5.694
  252    HG   SER  28           HG       SER  28   8.934 -16.595   6.444
  253    H    ASP  29           H        ASP  29   8.694 -13.732   3.837
  254    HA   ASP  29           HA       ASP  29   8.161 -15.484   1.590
  255    HB2  ASP  29          1HB       ASP  29   6.411 -15.287   3.440
  256    HB3  ASP  29          2HB       ASP  29   6.440 -13.559   3.010
  257    HD2  ASP  29           HD       ASP  29   3.706 -15.228   1.248
  258    H    LEU  30           H        LEU  30   9.478 -14.398  -0.031
  259    HA   LEU  30           HA       LEU  30   9.070 -11.595  -0.505
  260    HB2  LEU  30          1HB       LEU  30  10.670 -13.785  -1.766
  261    HB3  LEU  30          2HB       LEU  30  10.454 -12.234  -2.599
  262    HG   LEU  30           HG       LEU  30  12.487 -11.982  -1.523
  263   HD11  LEU  30          1HD1      LEU  30  10.484 -10.917   0.487
  264   HD12  LEU  30          2HD1      LEU  30  12.172 -10.385   0.293
  265   HD13  LEU  30          3HD1      LEU  30  10.998 -10.106  -1.013
  266   HD21  LEU  30          1HD2      LEU  30  11.798 -14.144  -0.032
  267   HD22  LEU  30          2HD2      LEU  30  13.236 -13.134   0.255
  268   HD23  LEU  30          3HD2      LEU  30  11.752 -12.858   1.199
  269    H    THR  31           H        THR  31   7.632 -14.660  -1.471
  270    HA   THR  31           HA       THR  31   6.883 -13.861  -4.083
  271    HB   THR  31           HB       THR  31   5.775 -16.040  -2.245
  272    HG1  THR  31          1HG       THR  31   7.183 -17.368  -3.536
  273   HG21  THR  31          1HG2      THR  31   4.941 -17.069  -4.329
  274   HG22  THR  31          2HG2      THR  31   4.218 -15.463  -4.073
  275   HG23  THR  31          3HG2      THR  31   5.530 -15.670  -5.256
  276    H    ILE  32           H        ILE  32   5.236 -13.790  -0.889
  277    HA   ILE  32           HA       ILE  32   3.078 -12.307  -2.218
  278    HB   ILE  32           HB       ILE  32   2.886 -14.433  -0.032
  279   HG12  ILE  32          1HG1      ILE  32   3.025 -15.289  -2.279
  280   HG13  ILE  32          2HG1      ILE  32   1.438 -15.589  -1.534
  281   HG21  ILE  32          1HG2      ILE  32   0.471 -13.916   0.027
  282   HG22  ILE  32          2HG2      ILE  32   1.438 -12.505   0.514
  283   HG23  ILE  32          3HG2      ILE  32   0.729 -12.576  -1.115
  284   HD11  ILE  32          1HD1      ILE  32   1.201 -14.937  -3.898
  285   HD12  ILE  32          2HD1      ILE  32   0.480 -13.718  -2.821
  286   HD13  ILE  32          3HD1      ILE  32   2.067 -13.420  -3.567
  287    HA   PRO  33           HA       PRO  33   4.230  -9.353   0.762
  288    HB2  PRO  33          1HB       PRO  33   2.362  -7.438   0.228
  289    HB3  PRO  33          2HB       PRO  33   3.748  -7.673  -0.847
  290    HG2  PRO  33          1HG       PRO  33   0.937  -8.795  -1.087
  291    HG3  PRO  33          2HG       PRO  33   1.950  -8.059  -2.336
  292    HD2  PRO  33          1HD       PRO  33   1.738 -10.778  -2.107
  293    HD3  PRO  33          2HD       PRO  33   3.249 -10.025  -2.631
  294    H    VAL  34           H        VAL  34   3.444  -8.261   2.747
  295    HA   VAL  34           HA       VAL  34   1.617 -10.266   3.879
  296    HB   VAL  34           HB       VAL  34   2.939 -10.046   5.971
  297   HG11  VAL  34          1HG1      VAL  34   5.010 -11.149   5.195
  298   HG12  VAL  34          2HG1      VAL  34   3.587 -11.783   4.335
  299   HG13  VAL  34          3HG1      VAL  34   4.669 -10.620   3.530
  300   HG21  VAL  34          1HG2      VAL  34   5.049  -8.815   5.994
  301   HG22  VAL  34          2HG2      VAL  34   4.708  -8.203   4.357
  302   HG23  VAL  34          3HG2      VAL  34   3.655  -7.745   5.718
  303    H    LYS  35           H        LYS  35   2.407  -6.886   3.414
  304    HA   LYS  35           HA       LYS  35  -0.013  -6.200   4.864
  305    HB2  LYS  35          1HB       LYS  35   2.760  -5.142   5.430
  306    HB3  LYS  35          2HB       LYS  35   1.302  -4.184   5.781
  307    HG2  LYS  35          1HG       LYS  35   0.544  -6.294   7.117
  308    HG3  LYS  35          2HG       LYS  35   2.269  -6.730   7.073
  309    HD2  LYS  35          1HD       LYS  35   2.031  -5.552   9.093
  310    HD3  LYS  35          2HD       LYS  35   2.704  -4.354   7.961
  311    HE2  LYS  35          1HE       LYS  35   0.537  -3.370   7.609
  312    HE3  LYS  35          2HE       LYS  35  -0.255  -4.662   8.540
  313    HZ1  LYS  35          1HZ       LYS  35  -0.001  -2.658   9.839
  314    HZ2  LYS  35          2HZ       LYS  35   0.901  -3.875  10.493
  315    HZ3  LYS  35          3HZ       LYS  35   1.635  -2.676   9.630
  316    H    ARG  36           H        ARG  36  -1.086  -4.406   3.976
  317    HA   ARG  36           HA       ARG  36   0.439  -2.895   2.037
  318    HB2  ARG  36          1HB       ARG  36  -2.312  -3.927   1.466
  319    HB3  ARG  36          2HB       ARG  36  -1.339  -2.844   0.443
  320    HG2  ARG  36          1HG       ARG  36  -0.945  -4.860  -0.592
  321    HG3  ARG  36          2HG       ARG  36   0.409  -4.812   0.563
  322    HD2  ARG  36          1HD       ARG  36  -0.425  -6.965   0.665
  323    HD3  ARG  36          2HD       ARG  36  -1.066  -6.143   2.107
  324    HE   ARG  36           HE       ARG  36  -3.320  -6.480   1.155
  325   HH11  ARG  36          1HH1      ARG  36  -0.903  -7.201  -1.252
  326   HH12  ARG  36          2HH1      ARG  36  -2.127  -7.933  -2.270
  327   HH21  ARG  36          1HH2      ARG  36  -4.735  -7.308  -0.003
  328   HH22  ARG  36          2HH2      ARG  36  -4.313  -7.994  -1.560
  329    H    GLY  37           H        GLY  37  -0.451  -0.682   1.690
  330    HA2  GLY  37          1HA       GLY  37  -2.612   0.327   3.206
  331    HA3  GLY  37          2HA       GLY  37  -1.122   0.528   4.105
  332    H    CYS  38           H        CYS  38  -1.723   2.903   3.766
  333    HA   CYS  38           HA       CYS  38  -1.031   3.764   1.054
  334    HB2  CYS  38          1HB       CYS  38  -2.681   4.909   3.429
  335    HB3  CYS  38          2HB       CYS  38  -2.472   5.788   1.895
  336    HG   CYS  38           HG       CYS  38  -4.890   4.923   2.102
  337    H    ILE  39           H        ILE  39   0.455   5.605   0.871
  338    HA   ILE  39           HA       ILE  39   1.250   6.950   3.255
  339    HB   ILE  39           HB       ILE  39   2.788   4.903   3.203
  340   HG12  ILE  39          1HG1      ILE  39   4.334   7.427   2.776
  341   HG13  ILE  39          2HG1      ILE  39   3.249   7.221   4.172
  342   HG21  ILE  39          1HG2      ILE  39   4.598   4.926   1.520
  343   HG22  ILE  39          2HG2      ILE  39   3.008   4.744   0.746
  344   HG23  ILE  39          3HG2      ILE  39   3.836   6.318   0.717
  345   HD11  ILE  39          1HD1      ILE  39   5.574   6.657   4.761
  346   HD12  ILE  39          2HD1      ILE  39   4.519   5.227   4.866
  347   HD13  ILE  39          3HD1      ILE  39   5.603   5.433   3.471
  348    H    ASP  40           H        ASP  40   2.733   8.818   2.706
  349    HA   ASP  40           HA       ASP  40   1.881   9.840   0.169
  350    HB2  ASP  40          1HB       ASP  40   2.889  12.021   1.050
  351    HB3  ASP  40          2HB       ASP  40   1.624  11.164   1.966
  352    HD2  ASP  40           HD       ASP  40   4.464  12.169   4.121
  353    H    VAL  41           H        VAL  41   4.936   9.150   2.012
  354    HA   VAL  41           HA       VAL  41   6.399   9.342  -0.531
  355    HB   VAL  41           HB       VAL  41   7.395   9.729   2.331
  356   HG11  VAL  41          1HG1      VAL  41   9.532  10.365   1.261
  357   HG12  VAL  41          2HG1      VAL  41   9.092   8.686   0.867
  358   HG13  VAL  41          3HG1      VAL  41   8.848   9.977  -0.335
  359   HG21  VAL  41          1HG2      VAL  41   7.778  12.051   1.671
  360   HG22  VAL  41          2HG2      VAL  41   7.032  11.722   0.089
  361   HG23  VAL  41          3HG2      VAL  41   6.059  11.603   1.575
  362    H    CYS  42           H        CYS  42   7.448   7.534  -1.263
  363    HA   CYS  42           HA       CYS  42   6.616   5.119  -0.076
  364    HB2  CYS  42          1HB       CYS  42   6.864   5.435  -2.489
  365    HB3  CYS  42          2HB       CYS  42   8.615   5.599  -2.297
  366    HG   CYS  42           HG       CYS  42   8.054   3.269  -3.389
  367    HA   PRO  43           HA       PRO  43  10.004   4.870   2.696
  368    HB2  PRO  43          1HB       PRO  43   9.450   2.450   3.846
  369    HB3  PRO  43          2HB       PRO  43   8.541   3.901   4.292
  370    HG2  PRO  43          1HG       PRO  43   7.832   1.750   2.274
  371    HG3  PRO  43          2HG       PRO  43   6.799   2.527   3.481
  372    HD2  PRO  43          1HD       PRO  43   6.750   3.312   0.860
  373    HD3  PRO  43          2HD       PRO  43   6.500   4.480   2.164
  374    H    LYS  44           H        LYS  44  12.112   4.241   2.675
  375    HA   LYS  44           HA       LYS  44  12.858   2.817   0.345
  376    HB2  LYS  44          1HB       LYS  44  14.372   3.654   2.831
  377    HB3  LYS  44          2HB       LYS  44  15.131   2.923   1.397
  378    HG2  LYS  44          1HG       LYS  44  14.388   4.829   0.028
  379    HG3  LYS  44          2HG       LYS  44  13.626   5.561   1.461
  380    HD2  LYS  44          1HD       LYS  44  15.808   5.718   2.564
  381    HD3  LYS  44          2HD       LYS  44  16.585   4.941   1.164
  382    HE2  LYS  44          1HE       LYS  44  15.876   6.806  -0.269
  383    HE3  LYS  44          2HE       LYS  44  15.097   7.584   1.127
  384    HZ1  LYS  44          1HZ       LYS  44  17.275   8.501   0.699
  385    HZ2  LYS  44          2HZ       LYS  44  17.258   7.742   2.164
  386    HZ3  LYS  44          3HZ       LYS  44  17.981   7.020   0.868
  387    H    ASN  45           H        ASN  45  14.194   0.802   0.337
  388    HA   ASN  45           HA       ASN  45  12.647  -1.134   1.661
  389    HB2  ASN  45          1HB       ASN  45  15.125  -1.653  -0.134
  390    HB3  ASN  45          2HB       ASN  45  13.966  -2.654   0.773
  391   HD21  ASN  45          1HD2      ASN  45  13.047  -1.927  -2.880
  392   HD22  ASN  45          2HD2      ASN  45  14.593  -2.213  -2.154
  393    H    SER  46           H        SER  46  13.298  -2.552   3.398
  394    HA   SER  46           HA       SER  46  15.779  -1.745   4.693
  395    HB2  SER  46          1HB       SER  46  14.789  -2.581   6.761
  396    HB3  SER  46          2HB       SER  46  13.699  -1.409   5.983
  397    HG   SER  46           HG       SER  46  12.501  -3.174   5.192
  398    H    LEU  47           H        LEU  47  16.594  -3.771   6.185
  399    HA   LEU  47           HA       LEU  47  17.298  -5.759   4.261
  400    HB2  LEU  47          1HB       LEU  47  17.701  -5.394   7.163
  401    HB3  LEU  47          2HB       LEU  47  18.546  -6.721   6.333
  402    HG   LEU  47           HG       LEU  47  18.919  -3.742   5.834
  403   HD11  LEU  47          1HD1      LEU  47  21.225  -4.150   6.734
  404   HD12  LEU  47          2HD1      LEU  47  19.980  -4.550   7.941
  405   HD13  LEU  47          3HD1      LEU  47  20.789  -5.850   7.035
  406   HD21  LEU  47          1HD2      LEU  47  20.733  -4.425   4.303
  407   HD22  LEU  47          2HD2      LEU  47  20.282  -6.129   4.556
  408   HD23  LEU  47          3HD2      LEU  47  19.136  -5.010   3.780
  409    H    LEU  48           H        LEU  48  14.827  -5.348   6.722
  410    HA   LEU  48           HA       LEU  48  14.467  -8.221   6.975
  411    HB2  LEU  48          1HB       LEU  48  13.198  -5.824   8.148
  412    HB3  LEU  48          2HB       LEU  48  12.698  -7.440   8.699
  413    HG   LEU  48           HG       LEU  48  15.438  -6.161   9.040
  414   HD11  LEU  48          1HD1      LEU  48  14.892  -6.300  11.484
  415   HD12  LEU  48          2HD1      LEU  48  13.704  -5.304  10.613
  416   HD13  LEU  48          3HD1      LEU  48  13.299  -6.973  11.075
  417   HD21  LEU  48          1HD2      LEU  48  16.025  -8.192  10.317
  418   HD22  LEU  48          2HD2      LEU  48  14.453  -8.901   9.878
  419   HD23  LEU  48          3HD2      LEU  48  15.650  -8.538   8.612
  420    H    VAL  49           H        VAL  49  12.636  -5.264   5.951
  421    HA   VAL  49           HA       VAL  49  10.842  -7.079   4.497
  422    HB   VAL  49           HB       VAL  49   9.026  -5.386   4.946
  423   HG11  VAL  49          1HG1      VAL  49   8.622  -6.056   7.290
  424   HG12  VAL  49          2HG1      VAL  49   9.201  -7.432   6.322
  425   HG13  VAL  49          3HG1      VAL  49  10.313  -6.591   7.429
  426   HG21  VAL  49          1HG2      VAL  49   9.330  -3.758   6.741
  427   HG22  VAL  49          2HG2      VAL  49  11.047  -4.211   6.860
  428   HG23  VAL  49          3HG2      VAL  49  10.425  -3.456   5.373
  429    H    LYS  50           H        LYS  50  10.117  -6.339   2.447
  430    HA   LYS  50           HA       LYS  50  11.685  -4.073   1.440
  431    HB2  LYS  50          1HB       LYS  50  12.086  -6.206   0.325
  432    HB3  LYS  50          2HB       LYS  50  10.341  -6.405   0.043
  433    HG2  LYS  50          1HG       LYS  50  10.364  -4.410  -1.419
  434    HG3  LYS  50          2HG       LYS  50  12.118  -4.257  -1.161
  435    HD2  LYS  50          1HD       LYS  50  12.476  -6.461  -2.173
  436    HD3  LYS  50          2HD       LYS  50  10.722  -6.653  -2.398
  437    HE2  LYS  50          1HE       LYS  50  10.716  -4.645  -3.850
  438    HE3  LYS  50          2HE       LYS  50  12.481  -4.533  -3.669
  439    HZ1  LYS  50          1HZ       LYS  50  11.866  -5.648  -5.705
  440    HZ2  LYS  50          2HZ       LYS  50  12.659  -6.693  -4.705
  441    HZ3  LYS  50          3HZ       LYS  50  11.021  -6.796  -4.873
  442    H    TYR  51           H        TYR  51  10.659  -2.418   0.224
  443    HA   TYR  51           HA       TYR  51   7.743  -2.366   0.620
  444    HB2  TYR  51          1HB       TYR  51   9.781  -0.138   0.640
  445    HB3  TYR  51          2HB       TYR  51   8.017   0.092   0.676
  446    HD1  TYR  51          1HD       TYR  51  10.977  -0.834   2.616
  447    HD2  TYR  51          2HD       TYR  51   6.720  -0.589   2.671
  448    HE1  TYR  51          1HE       TYR  51  11.004  -1.054   5.082
  449    HE2  TYR  51          2HE       TYR  51   6.728  -0.809   5.133
  450    HH   TYR  51           HH       TYR  51   9.764  -1.150   6.984
  451    H    VAL  52           H        VAL  52   6.529  -2.296  -1.213
  452    HA   VAL  52           HA       VAL  52   7.748  -0.951  -3.522
  453    HB   VAL  52           HB       VAL  52   5.806  -3.310  -3.554
  454   HG11  VAL  52          1HG1      VAL  52   6.134  -3.238  -6.003
  455   HG12  VAL  52          2HG1      VAL  52   5.432  -1.716  -5.406
  456   HG13  VAL  52          3HG1      VAL  52   7.161  -1.795  -5.823
  457   HG21  VAL  52          1HG2      VAL  52   7.641  -4.564  -4.569
  458   HG22  VAL  52          2HG2      VAL  52   8.721  -3.169  -4.338
  459   HG23  VAL  52          3HG2      VAL  52   8.039  -4.011  -2.926
  460    H    CYS  53           H        CYS  53   6.613   0.783  -4.268
  461    HA   CYS  53           HA       CYS  53   3.919   1.091  -3.152
  462    HB2  CYS  53          1HB       CYS  53   5.795   3.350  -3.831
  463    HB3  CYS  53          2HB       CYS  53   4.266   3.432  -2.949
  464    HG   CYS  53           HG       CYS  53   6.264   3.953  -1.315
  465    H    CYS  54           H        CYS  54   2.521   2.591  -4.587
  466    HA   CYS  54           HA       CYS  54   3.453   2.815  -7.311
  467    HB2  CYS  54          1HB       CYS  54   1.381   1.502  -8.056
  468    HB3  CYS  54          2HB       CYS  54   2.304   0.510  -6.900
  469    HG   CYS  54           HG       CYS  54  -0.224   0.124  -6.582
  470    H    ASN  55           H        ASN  55   2.136   4.415  -8.506
  471    HA   ASN  55           HA       ASN  55   0.770   6.167  -6.651
  472    HB2  ASN  55          1HB       ASN  55   1.255   8.012  -8.329
  473    HB3  ASN  55          2HB       ASN  55   2.511   6.854  -7.824
  474   HD21  ASN  55          1HD2      ASN  55   2.625   7.540 -11.512
  475   HD22  ASN  55          2HD2      ASN  55   2.545   8.558 -10.112
  476    H    THR  56           H        THR  56  -0.564   3.717  -7.451
  477    HA   THR  56           HA       THR  56  -2.760   4.827  -9.052
  478    HB   THR  56           HB       THR  56  -2.990   2.653 -10.212
  479    HG1  THR  56          1HG       THR  56  -1.270   1.108  -9.951
  480   HG21  THR  56          1HG2      THR  56  -0.990   2.768 -11.656
  481   HG22  THR  56          2HG2      THR  56  -1.607   4.396 -11.287
  482   HG23  THR  56          3HG2      THR  56  -0.170   3.777 -10.442
  483    H    ASP  57           H        ASP  57  -4.747   3.307  -8.892
  484    HA   ASP  57           HA       ASP  57  -5.117   3.014  -6.068
  485    HB2  ASP  57          1HB       ASP  57  -7.096   2.910  -8.410
  486    HB3  ASP  57          2HB       ASP  57  -7.394   2.523  -6.697
  487    HD2  ASP  57           HD       ASP  57  -7.379   6.255  -7.750
  488    H    ARG  58           H        ARG  58  -5.431   0.983  -5.015
  489    HA   ARG  58           HA       ARG  58  -5.537  -1.162  -4.719
  490    HB2  ARG  58          1HB       ARG  58  -7.238  -1.034  -7.250
  491    HB3  ARG  58          2HB       ARG  58  -7.226  -2.405  -6.130
  492    HG2  ARG  58          1HG       ARG  58  -8.296  -1.189  -4.435
  493    HG3  ARG  58          2HG       ARG  58  -7.796   0.380  -5.090
  494    HD2  ARG  58          1HD       ARG  58  -9.302  -0.562  -7.166
  495    HD3  ARG  58          2HD       ARG  58 -10.129  -1.349  -5.813
  496    HE   ARG  58           HE       ARG  58  -9.649   1.417  -5.190
  497   HH11  ARG  58          1HH1      ARG  58 -12.790   2.558  -6.166
  498   HH12  ARG  58          2HH1      ARG  58 -11.332   2.910  -5.264
  499   HH21  ARG  58          1HH2      ARG  58 -13.000   0.541  -7.296
  500   HH22  ARG  58          2HH2      ARG  58 -11.708  -0.610  -7.242
  501    H    CYS  59           H        CYS  59  -3.108  -0.633  -5.811
  502    HA   CYS  59           HA       CYS  59  -2.735  -2.285  -8.146
  503    HB2  CYS  59          1HB       CYS  59  -0.545  -1.476  -8.226
  504    HB3  CYS  59          2HB       CYS  59  -1.549  -0.097  -7.774
  505    HG   CYS  59           HG       CYS  59   0.785   0.073  -6.571
  506    H    ASN  60           H        ASN  60  -2.451  -2.369  -4.600
  507    HA   ASN  60           HA       ASN  60  -0.622  -4.613  -4.818
  508    HB2  ASN  60          1HB       ASN  60  -0.229  -4.126  -2.342
  509    HB3  ASN  60          2HB       ASN  60   0.250  -2.814  -3.429
  510   HD21  ASN  60          1HD2      ASN  60   0.087  -1.479  -1.543
  511   HD22  ASN  60          2HD2      ASN  60  -1.442  -0.836  -1.039
  Start of MODEL    2
    1    H1   MET   0          1H        MET   0  -8.115  10.100   0.284
    2    H2   MET   0          2H        MET   0  -9.270  10.775  -0.394
    3    H    MET   0           H        MET   0  -9.092   9.269  -0.529
    4    H3   MET   0          3H        MET   0  -9.099   9.288  -0.504
    5    HA   MET   0           HA       MET   0  -8.129  11.198  -2.290
    6    HB2  MET   0          1HB       MET   0  -5.972   9.628  -0.861
    7    HB3  MET   0          2HB       MET   0  -5.711  10.554  -2.359
    8    HG2  MET   0          1HG       MET   0  -6.652  11.728   0.276
    9    HG3  MET   0          2HG       MET   0  -4.968  11.748  -0.300
   10    HE1  MET   0          1HE       MET   0  -5.077  14.128  -3.359
   11    HE2  MET   0          2HE       MET   0  -4.053  13.259  -2.189
   12    HE3  MET   0          3HE       MET   0  -5.080  12.348  -3.323
   13    H    LEU   1           H        LEU   1  -5.862   8.739  -2.674
   14    HA   LEU   1           HA       LEU   1  -7.416   7.466  -4.700
   15    HB2  LEU   1          1HB       LEU   1  -4.760   7.446  -3.567
   16    HB3  LEU   1          2HB       LEU   1  -5.127   5.908  -4.384
   17    HG   LEU   1           HG       LEU   1  -5.871   7.576  -6.338
   18   HD11  LEU   1          1HD1      LEU   1  -4.261   9.495  -6.470
   19   HD12  LEU   1          2HD1      LEU   1  -5.309   9.628  -5.038
   20   HD13  LEU   1          3HD1      LEU   1  -3.633   9.058  -4.864
   21   HD21  LEU   1          1HD2      LEU   1  -3.646   7.245  -7.356
   22   HD22  LEU   1          2HD2      LEU   1  -3.009   6.760  -5.765
   23   HD23  LEU   1          3HD2      LEU   1  -4.262   5.777  -6.561
   24    H    LYS   2           H        LYS   2  -7.072   4.832  -4.672
   25    HA   LYS   2           HA       LYS   2  -7.823   3.942  -1.976
   26    HB2  LYS   2          1HB       LYS   2  -8.645   2.695  -4.609
   27    HB3  LYS   2          2HB       LYS   2  -9.208   2.253  -2.980
   28    HG2  LYS   2          1HG       LYS   2  -9.745   4.922  -4.326
   29    HG3  LYS   2          2HG       LYS   2 -10.881   3.551  -4.318
   30    HD2  LYS   2          1HD       LYS   2 -10.849   3.600  -1.824
   31    HD3  LYS   2          2HD       LYS   2  -9.819   5.050  -1.899
   32    HE2  LYS   2          1HE       LYS   2 -12.595   4.807  -3.099
   33    HE3  LYS   2          2HE       LYS   2 -12.218   5.583  -1.544
   34    HZ1  LYS   2          1HZ       LYS   2 -12.391   7.189  -3.320
   35    HZ2  LYS   2          2HZ       LYS   2 -10.849   7.158  -2.735
   36    HZ3  LYS   2          3HZ       LYS   2 -11.200   6.437  -4.178
   37    H    CYS   3           H        CYS   3  -6.723   2.173  -1.143
   38    HA   CYS   3           HA       CYS   3  -4.832   0.910  -2.989
   39    HB2  CYS   3          1HB       CYS   3  -4.698   1.741   0.005
   40    HB3  CYS   3          2HB       CYS   3  -3.391   0.840  -0.801
   41    HG   CYS   3           HG       CYS   3  -2.646   3.263  -0.338
   42    H    ASN   4           H        ASN   4  -4.341  -1.398  -2.362
   43    HA   ASN   4           HA       ASN   4  -6.799  -2.632  -1.651
   44    HB2  ASN   4          1HB       ASN   4  -4.162  -4.015  -2.530
   45    HB3  ASN   4          2HB       ASN   4  -5.745  -4.577  -1.939
   46   HD21  ASN   4          1HD2      ASN   4  -5.422  -4.221  -5.742
   47   HD22  ASN   4          2HD2      ASN   4  -4.267  -4.751  -4.565
   48    H    LYS   5           H        LYS   5  -6.939  -4.332   0.100
   49    HA   LYS   5           HA       LYS   5  -4.797  -4.217   2.072
   50    HB2  LYS   5          1HB       LYS   5  -6.461  -2.571   2.785
   51    HB3  LYS   5          2HB       LYS   5  -7.747  -3.790   2.627
   52    HG2  LYS   5          1HG       LYS   5  -6.683  -5.120   4.425
   53    HG3  LYS   5          2HG       LYS   5  -5.441  -3.858   4.603
   54    HD2  LYS   5          1HD       LYS   5  -7.071  -3.478   6.312
   55    HD3  LYS   5          2HD       LYS   5  -7.303  -2.221   5.074
   56    HE2  LYS   5          1HE       LYS   5  -9.175  -3.428   4.127
   57    HE3  LYS   5          2HE       LYS   5  -8.896  -4.796   5.227
   58    HZ1  LYS   5          1HZ       LYS   5 -10.680  -3.387   5.997
   59    HZ2  LYS   5          2HZ       LYS   5  -9.425  -3.343   7.065
   60    HZ3  LYS   5          3HZ       LYS   5  -9.683  -2.074   6.044
   61    H    LEU   6           H        LEU   6  -8.128  -5.562   2.289
   62    HA   LEU   6           HA       LEU   6  -6.915  -8.167   2.702
   63    HB2  LEU   6          1HB       LEU   6  -8.476  -7.334   4.210
   64    HB3  LEU   6          2HB       LEU   6  -9.793  -7.122   3.033
   65    HG   LEU   6           HG       LEU   6  -9.643  -9.639   2.627
   66   HD11  LEU   6          1HD1      LEU   6  -8.663 -10.976   4.509
   67   HD12  LEU   6          2HD1      LEU   6  -7.423  -9.983   3.708
   68   HD13  LEU   6          3HD1      LEU   6  -8.103  -9.468   5.270
   69   HD21  LEU   6          1HD2      LEU   6 -11.026 -10.180   4.601
   70   HD22  LEU   6          2HD2      LEU   6 -10.513  -8.652   5.357
   71   HD23  LEU   6          3HD2      LEU   6 -11.469  -8.625   3.857
   72    H    VAL   7           H        VAL   7  -7.112  -9.907   1.321
   73    HA   VAL   7           HA       VAL   7  -7.808  -9.416  -1.355
   74    HB   VAL   7           HB       VAL   7  -7.617 -11.897  -1.600
   75   HG11  VAL   7          1HG1      VAL   7  -5.269 -12.105  -0.853
   76   HG12  VAL   7          2HG1      VAL   7  -5.567 -10.516  -1.595
   77   HG13  VAL   7          3HG1      VAL   7  -5.469 -10.667   0.176
   78   HG21  VAL   7          1HG2      VAL   7  -7.079 -13.285   0.337
   79   HG22  VAL   7          2HG2      VAL   7  -7.345 -11.888   1.409
   80   HG23  VAL   7          3HG2      VAL   7  -8.698 -12.557   0.466
   81    HA   PRO   8           HA       PRO   8  -8.384 -10.704  -2.810
   82    HB2  PRO   8          1HB       PRO   8  -9.873 -10.721  -5.054
   83    HB3  PRO   8          2HB       PRO   8  -9.827 -12.168  -4.037
   84    HG2  PRO   8          1HG       PRO   8 -11.907  -9.964  -4.129
   85    HG3  PRO   8          2HG       PRO   8 -12.143 -11.714  -4.028
   86    HD2  PRO   8          1HD       PRO   8 -12.231 -10.033  -1.806
   87    HD3  PRO   8          2HD       PRO   8 -11.814 -11.748  -1.702
   88    H    ILE   9           H        ILE   9 -10.990  -8.357  -2.793
   89    HA   ILE   9           HA       ILE   9  -9.240  -6.641  -4.413
   90    HB   ILE   9           HB       ILE   9 -12.242  -6.956  -4.506
   91   HG12  ILE   9          1HG1      ILE   9 -11.073  -8.799  -5.557
   92   HG13  ILE   9          2HG1      ILE   9 -11.859  -7.787  -6.779
   93   HG21  ILE   9          1HG2      ILE   9 -10.412  -5.044  -5.979
   94   HG22  ILE   9          2HG2      ILE   9 -12.108  -5.362  -6.418
   95   HG23  ILE   9          3HG2      ILE   9 -11.717  -4.636  -4.840
   96   HD11  ILE   9          1HD1      ILE   9  -9.750  -6.761  -7.384
   97   HD12  ILE   9          2HD1      ILE   9  -8.930  -7.493  -5.983
   98   HD13  ILE   9          3HD1      ILE   9  -9.480  -8.519  -7.330
   99    H    ALA  10           H        ALA  10 -10.855  -7.126  -1.423
  100    HA   ALA  10           HA       ALA  10 -12.036  -4.784  -0.800
  101    HB1  ALA  10          1HB       ALA  10 -11.173  -7.080   0.538
  102    HB2  ALA  10          2HB       ALA  10 -10.344  -5.753   1.388
  103    HB3  ALA  10          3HB       ALA  10 -12.117  -5.744   1.239
  104    H    TYR  11           H        TYR  11 -11.450  -2.683  -0.308
  105    HA   TYR  11           HA       TYR  11  -8.578  -2.103  -0.369
  106    HB2  TYR  11          1HB       TYR  11  -8.972  -0.298  -1.938
  107    HB3  TYR  11          2HB       TYR  11  -9.390  -1.885  -2.631
  108    HD1  TYR  11          1HD       TYR  11 -10.689   1.371  -1.543
  109    HD2  TYR  11          2HD       TYR  11 -11.736  -2.472  -3.065
  110    HE1  TYR  11          1HE       TYR  11 -12.943   2.223  -2.120
  111    HE2  TYR  11          2HE       TYR  11 -13.989  -1.639  -3.647
  112    HH   TYR  11           HH       TYR  11 -15.408   0.143  -3.642
  113    H    LYS  12           H        LYS  12  -8.160   0.268   0.228
  114    HA   LYS  12           HA       LYS  12 -10.198   1.151   2.149
  115    HB2  LYS  12          1HB       LYS  12  -8.055   1.988   3.405
  116    HB3  LYS  12          2HB       LYS  12  -8.643   0.321   3.614
  117    HG2  LYS  12          1HG       LYS  12  -6.983  -0.411   1.883
  118    HG3  LYS  12          2HG       LYS  12  -6.334   1.246   1.874
  119    HD2  LYS  12          1HD       LYS  12  -6.505  -0.523   4.335
  120    HD3  LYS  12          2HD       LYS  12  -5.050  -0.344   3.326
  121    HE2  LYS  12          1HE       LYS  12  -5.013   2.062   3.787
  122    HE3  LYS  12          2HE       LYS  12  -6.484   1.904   4.772
  123    HZ1  LYS  12          1HZ       LYS  12  -4.504   1.947   6.130
  124    HZ2  LYS  12          2HZ       LYS  12  -5.253   0.483   6.267
  125    HZ3  LYS  12          3HZ       LYS  12  -3.888   0.629   5.352
  126    H    THR  13           H        THR  13 -10.308   3.448   2.488
  127    HA   THR  13           HA       THR  13  -9.414   4.917   0.147
  128    HB   THR  13           HB       THR  13 -11.100   5.754   2.559
  129    HG1  THR  13          1HG       THR  13 -12.826   5.539   1.013
  130   HG21  THR  13          1HG2      THR  13 -11.744   7.674   1.145
  131   HG22  THR  13          2HG2      THR  13  -9.989   7.656   1.439
  132   HG23  THR  13          3HG2      THR  13 -10.634   7.112  -0.126
  133    H    CYS  14           H        CYS  14  -7.634   6.129   0.036
  134    HA   CYS  14           HA       CYS  14  -5.889   6.097   2.245
  135    HB2  CYS  14          1HB       CYS  14  -6.096   7.533  -0.501
  136    HB3  CYS  14          2HB       CYS  14  -4.600   7.565   0.463
  137    HG   CYS  14           HG       CYS  14  -4.303   6.033  -1.587
  138    HA   PRO  15           HA       PRO  15  -7.174   9.900   4.029
  139    HB2  PRO  15          1HB       PRO  15  -5.213  10.349   5.835
  140    HB3  PRO  15          2HB       PRO  15  -6.357   9.027   6.100
  141    HG2  PRO  15          1HG       PRO  15  -3.579   8.929   4.875
  142    HG3  PRO  15          2HG       PRO  15  -4.301   7.853   6.079
  143    HD2  PRO  15          1HD       PRO  15  -4.207   7.203   3.398
  144    HD3  PRO  15          2HD       PRO  15  -5.502   6.627   4.455
  145    H    GLU  16           H        GLU  16  -6.846  12.173   4.016
  146    HA   GLU  16           HA       GLU  16  -5.402  13.085   1.876
  147    HB2  GLU  16          1HB       GLU  16  -7.160  14.338   3.020
  148    HB3  GLU  16          2HB       GLU  16  -6.137  14.477   4.470
  149    HG2  GLU  16          1HG       GLU  16  -4.520  15.920   3.139
  150    HG3  GLU  16          2HG       GLU  16  -5.610  15.631   1.763
  151    HE2  GLU  16           HE       GLU  16  -6.544  18.749   3.327
  152    H    GLY  17           H        GLY  17  -3.293  13.892   1.573
  153    HA2  GLY  17          1HA       GLY  17  -1.169  14.531   2.358
  154    HA3  GLY  17          2HA       GLY  17  -1.456  13.677   3.860
  155    H    LYS  18           H        LYS  18  -2.638  11.267   2.478
  156    HA   LYS  18           HA       LYS  18  -0.164  10.188   1.353
  157    HB2  LYS  18          1HB       LYS  18  -2.731   8.884   2.306
  158    HB3  LYS  18          2HB       LYS  18  -1.352   8.010   1.600
  159    HG2  LYS  18          1HG       LYS  18   0.067   8.899   3.482
  160    HG3  LYS  18          2HG       LYS  18  -1.421   9.539   4.220
  161    HD2  LYS  18          1HD       LYS  18  -2.313   7.384   4.573
  162    HD3  LYS  18          2HD       LYS  18  -1.159   6.630   3.447
  163    HE2  LYS  18          1HE       LYS  18   0.683   7.297   5.025
  164    HE3  LYS  18          2HE       LYS  18  -0.572   7.809   6.178
  165    HZ1  LYS  18          1HZ       LYS  18   0.190   5.576   6.625
  166    HZ2  LYS  18          2HZ       LYS  18  -1.399   5.553   6.180
  167    HZ3  LYS  18          3HZ       LYS  18  -0.235   5.079   5.112
  168    H    ASN  19           H        ASN  19  -0.389   8.756  -0.607
  169    HA   ASN  19           HA       ASN  19  -2.524   9.576  -2.335
  170    HB2  ASN  19          1HB       ASN  19  -0.842  11.595  -2.525
  171    HB3  ASN  19          2HB       ASN  19   0.221  10.196  -2.817
  172   HD21  ASN  19          1HD2      ASN  19  -0.165  10.459  -6.212
  173   HD22  ASN  19          2HD2      ASN  19   0.837  10.183  -4.826
  174    H    LEU  20           H        LEU  20   0.464   7.830  -1.530
  175    HA   LEU  20           HA       LEU  20   0.357   6.296  -4.002
  176    HB2  LEU  20          1HB       LEU  20   2.169   6.198  -1.671
  177    HB3  LEU  20          2HB       LEU  20   2.583   5.421  -3.218
  178    HG   LEU  20           HG       LEU  20   2.458   8.392  -2.584
  179   HD11  LEU  20          1HD1      LEU  20   4.846   8.332  -3.354
  180   HD12  LEU  20          2HD1      LEU  20   4.580   7.222  -1.989
  181   HD13  LEU  20          3HD1      LEU  20   4.692   6.583  -3.646
  182   HD21  LEU  20          1HD2      LEU  20   2.995   8.793  -4.963
  183   HD22  LEU  20          2HD2      LEU  20   2.798   7.053  -5.282
  184   HD23  LEU  20          3HD2      LEU  20   1.407   8.020  -4.738
  185    H    CYS  21           H        CYS  21   0.371   3.921  -3.949
  186    HA   CYS  21           HA       CYS  21  -0.784   2.885  -1.462
  187    HB2  CYS  21          1HB       CYS  21  -1.029   1.873  -4.294
  188    HB3  CYS  21          2HB       CYS  21  -1.603   0.995  -2.873
  189    HG   CYS  21           HG       CYS  21  -3.651   2.020  -4.170
  190    H    TYR  22           H        TYR  22   0.264   1.094  -0.476
  191    HA   TYR  22           HA       TYR  22   2.829   0.357  -1.722
  192    HB2  TYR  22          1HB       TYR  22   3.893   0.447   0.350
  193    HB3  TYR  22          2HB       TYR  22   2.951   1.952   0.219
  194    HD1  TYR  22          1HD       TYR  22   3.148  -1.345   1.892
  195    HD2  TYR  22          2HD       TYR  22   1.135   2.411   1.734
  196    HE1  TYR  22          1HE       TYR  22   2.047  -1.854   4.052
  197    HE2  TYR  22          2HE       TYR  22   0.028   1.919   3.888
  198    HH   TYR  22           HH       TYR  22  -0.225   0.427   5.589
  199    H    LYS  23           H        LYS  23   3.585  -1.832  -1.302
  200    HA   LYS  23           HA       LYS  23   1.872  -3.370   0.498
  201    HB2  LYS  23          1HB       LYS  23   2.183  -5.351  -0.901
  202    HB3  LYS  23          2HB       LYS  23   1.297  -4.069  -1.760
  203    HG2  LYS  23          1HG       LYS  23   3.290  -3.482  -3.024
  204    HG3  LYS  23          2HG       LYS  23   4.255  -4.661  -2.104
  205    HD2  LYS  23          1HD       LYS  23   3.542  -5.450  -4.383
  206    HD3  LYS  23          2HD       LYS  23   3.042  -6.506  -3.040
  207    HE2  LYS  23          1HE       LYS  23   0.806  -5.526  -3.071
  208    HE3  LYS  23          2HE       LYS  23   1.296  -4.408  -4.364
  209    HZ1  LYS  23          1HZ       LYS  23   0.103  -6.305  -5.230
  210    HZ2  LYS  23          2HZ       LYS  23   1.658  -6.313  -5.784
  211    HZ3  LYS  23          3HZ       LYS  23   1.204  -7.349  -4.583
  212    H    MET  24           H        MET  24   2.997  -4.777   1.880
  213    HA   MET  24           HA       MET  24   5.884  -4.378   1.756
  214    HB2  MET  24          1HB       MET  24   4.015  -4.925   4.072
  215    HB3  MET  24          2HB       MET  24   5.789  -4.898   4.210
  216    HG2  MET  24          1HG       MET  24   5.699  -2.522   3.331
  217    HG3  MET  24          2HG       MET  24   3.933  -2.600   3.543
  218    HE1  MET  24          1HE       MET  24   3.520  -2.953   7.398
  219    HE2  MET  24          2HE       MET  24   2.705  -2.674   5.840
  220    HE3  MET  24          3HE       MET  24   3.502  -4.234   6.161
  221    H    PHE  25           H        PHE  25   7.279  -6.164   1.836
  222    HA   PHE  25           HA       PHE  25   5.946  -8.772   2.007
  223    HB2  PHE  25          1HB       PHE  25   8.550  -7.807   0.696
  224    HB3  PHE  25          2HB       PHE  25   8.026  -9.495   0.692
  225    HD1  PHE  25          1HD       PHE  25   7.287  -6.124  -0.573
  226    HD2  PHE  25          2HD       PHE  25   6.375 -10.253  -0.850
  227    HE1  PHE  25          1HE       PHE  25   6.001  -5.698  -2.699
  228    HE2  PHE  25          2HE       PHE  25   5.093  -9.834  -2.969
  229    HZ   PHE  25           HZ       PHE  25   4.923  -7.561  -3.869
  230    H    MET  26           H        MET  26   7.341 -10.557   2.980
  231    HA   MET  26           HA       MET  26   9.433  -9.429   4.677
  232    HB2  MET  26          1HB       MET  26   7.766 -11.935   4.992
  233    HB3  MET  26          2HB       MET  26   9.155 -11.519   6.025
  234    HG2  MET  26          1HG       MET  26   7.998  -9.495   6.780
  235    HG3  MET  26          2HG       MET  26   6.615  -9.885   5.729
  236    HE1  MET  26          1HE       MET  26   5.169 -10.523   9.338
  237    HE2  MET  26          2HE       MET  26   6.322  -9.255   8.853
  238    HE3  MET  26          3HE       MET  26   4.948  -9.663   7.795
  239    H    MET  27           H        MET  27  11.501 -10.489   4.708
  240    HA   MET  27           HA       MET  27  12.372 -11.112   2.234
  241    HB2  MET  27          1HB       MET  27  13.409 -11.764   4.986
  242    HB3  MET  27          2HB       MET  27  14.321 -12.219   3.525
  243    HG2  MET  27          1HG       MET  27  13.510  -9.408   4.330
  244    HG3  MET  27          2HG       MET  27  15.139 -10.108   4.483
  245    HE1  MET  27          1HE       MET  27  16.272 -10.519   0.779
  246    HE2  MET  27          2HE       MET  27  16.755 -10.582   2.491
  247    HE3  MET  27          3HE       MET  27  15.560 -11.741   1.859
  248    H    SER  28           H        SER  28  10.956 -13.293   4.673
  249    HA   SER  28           HA       SER  28  11.574 -15.687   3.456
  250    HB2  SER  28          1HB       SER  28  10.562 -15.522   5.657
  251    HB3  SER  28          2HB       SER  28   9.090 -14.811   4.957
  252    HG   SER  28           HG       SER  28   8.876 -17.049   5.387
  253    H    ASP  29           H        ASP  29   8.317 -14.073   3.292
  254    HA   ASP  29           HA       ASP  29   7.902 -15.470   0.815
  255    HB2  ASP  29          1HB       ASP  29   6.140 -15.467   2.685
  256    HB3  ASP  29          2HB       ASP  29   6.120 -13.713   2.373
  257    HD2  ASP  29           HD       ASP  29   3.443 -15.304   0.476
  258    H    LEU  30           H        LEU  30   9.361 -14.130  -0.541
  259    HA   LEU  30           HA       LEU  30   8.777 -11.341  -0.825
  260    HB2  LEU  30          1HB       LEU  30  10.494 -13.392  -1.925
  261    HB3  LEU  30          2HB       LEU  30  10.280 -12.034  -3.052
  262    HG   LEU  30           HG       LEU  30  11.708 -10.726  -1.906
  263   HD11  LEU  30          1HD1      LEU  30  11.604 -10.445   0.584
  264   HD12  LEU  30          2HD1      LEU  30   9.985 -10.342  -0.146
  265   HD13  LEU  30          3HD1      LEU  30  10.496 -11.834   0.680
  266   HD21  LEU  30          1HD2      LEU  30  13.355 -11.878  -0.470
  267   HD22  LEU  30          2HD2      LEU  30  12.279 -13.295  -0.401
  268   HD23  LEU  30          3HD2      LEU  30  12.984 -12.787  -1.954
  269    H    THR  31           H        THR  31   7.402 -14.317  -1.929
  270    HA   THR  31           HA       THR  31   6.734 -13.451  -4.563
  271    HB   THR  31           HB       THR  31   5.623 -15.711  -2.829
  272    HG1  THR  31          1HG       THR  31   7.079 -16.973  -4.134
  273   HG21  THR  31          1HG2      THR  31   4.851 -16.674  -4.969
  274   HG22  THR  31          2HG2      THR  31   4.100 -15.087  -4.673
  275   HG23  THR  31          3HG2      THR  31   5.443 -15.234  -5.831
  276    H    ILE  32           H        ILE  32   5.000 -13.589  -1.411
  277    HA   ILE  32           HA       ILE  32   2.870 -12.038  -2.708
  278    HB   ILE  32           HB       ILE  32   2.629 -14.309  -0.679
  279   HG12  ILE  32          1HG1      ILE  32   2.858 -15.013  -2.970
  280   HG13  ILE  32          2HG1      ILE  32   1.246 -15.373  -2.308
  281   HG21  ILE  32          1HG2      ILE  32   0.205 -13.822  -0.675
  282   HG22  ILE  32          2HG2      ILE  32   1.137 -12.438  -0.059
  283   HG23  ILE  32          3HG2      ILE  32   0.488 -12.406  -1.715
  284   HD11  ILE  32          1HD1      ILE  32   1.095 -14.568  -4.632
  285   HD12  ILE  32          2HD1      ILE  32   0.320 -13.429  -3.505
  286   HD13  ILE  32          3HD1      ILE  32   1.932 -13.069  -4.167
  287    HA   PRO  33           HA       PRO  33   3.874  -9.293   0.514
  288    HB2  PRO  33          1HB       PRO  33   2.024  -7.351   0.045
  289    HB3  PRO  33          2HB       PRO  33   3.440  -7.515  -1.002
  290    HG2  PRO  33          1HG       PRO  33   0.640  -8.622  -1.397
  291    HG3  PRO  33          2HG       PRO  33   1.684  -7.800  -2.564
  292    HD2  PRO  33          1HD       PRO  33   1.476 -10.533  -2.518
  293    HD3  PRO  33          2HD       PRO  33   2.994  -9.739  -2.961
  294    H    VAL  34           H        VAL  34   2.958  -8.283   2.505
  295    HA   VAL  34           HA       VAL  34   1.099 -10.346   3.467
  296    HB   VAL  34           HB       VAL  34   2.230 -10.116   5.655
  297   HG11  VAL  34          1HG1      VAL  34   4.413 -11.103   5.043
  298   HG12  VAL  34          2HG1      VAL  34   3.101 -11.783   4.051
  299   HG13  VAL  34          3HG1      VAL  34   4.191 -10.553   3.366
  300   HG21  VAL  34          1HG2      VAL  34   4.270  -8.789   5.886
  301   HG22  VAL  34          2HG2      VAL  34   4.043  -8.157   4.238
  302   HG23  VAL  34          3HG2      VAL  34   2.855  -7.779   5.509
  303    H    LYS  35           H        LYS  35   1.897  -6.914   3.223
  304    HA   LYS  35           HA       LYS  35  -0.707  -6.321   4.370
  305    HB2  LYS  35          1HB       LYS  35   1.949  -5.230   5.320
  306    HB3  LYS  35          2HB       LYS  35   0.420  -4.352   5.559
  307    HG2  LYS  35          1HG       LYS  35  -0.431  -6.457   6.734
  308    HG3  LYS  35          2HG       LYS  35   1.258  -7.016   6.730
  309    HD2  LYS  35          1HD       LYS  35   1.005  -5.983   8.828
  310    HD3  LYS  35          2HD       LYS  35   1.816  -4.756   7.828
  311    HE2  LYS  35          1HE       LYS  35  -0.274  -3.604   7.446
  312    HE3  LYS  35          2HE       LYS  35  -1.178  -4.889   8.278
  313    HZ1  LYS  35          1HZ       LYS  35  -0.831  -2.985   9.697
  314    HZ2  LYS  35          2HZ       LYS  35  -0.032  -4.295  10.304
  315    HZ3  LYS  35          3HZ       LYS  35   0.806  -3.103   9.532
  316    H    ARG  36           H        ARG  36  -1.718  -4.586   3.363
  317    HA   ARG  36           HA       ARG  36  -0.028  -2.961   1.669
  318    HB2  ARG  36          1HB       ARG  36  -2.657  -4.230   0.776
  319    HB3  ARG  36          2HB       ARG  36  -1.699  -3.092  -0.188
  320    HG2  ARG  36          1HG       ARG  36  -0.898  -5.067  -1.058
  321    HG3  ARG  36          2HG       ARG  36   0.226  -4.915   0.302
  322    HD2  ARG  36          1HD       ARG  36  -0.794  -7.198   0.101
  323    HD3  ARG  36          2HD       ARG  36  -1.153  -6.432   1.655
  324    HE   ARG  36           HE       ARG  36  -3.420  -6.324   1.045
  325   HH11  ARG  36          1HH1      ARG  36  -4.990  -7.274  -1.913
  326   HH12  ARG  36          2HH1      ARG  36  -5.205  -6.782  -0.245
  327   HH21  ARG  36          1HH2      ARG  36  -2.854  -7.456  -2.805
  328   HH22  ARG  36          2HH2      ARG  36  -1.478  -7.104  -1.814
  329    H    GLY  37           H        GLY  37  -1.067  -0.838   1.112
  330    HA2  GLY  37          1HA       GLY  37  -3.529   0.020   2.074
  331    HA3  GLY  37          2HA       GLY  37  -2.374   0.261   3.370
  332    H    CYS  38           H        CYS  38  -2.755   2.605   3.089
  333    HA   CYS  38           HA       CYS  38  -1.727   3.665   0.577
  334    HB2  CYS  38          1HB       CYS  38  -3.261   5.070   2.764
  335    HB3  CYS  38          2HB       CYS  38  -2.806   5.750   1.200
  336    HG   CYS  38           HG       CYS  38  -5.402   5.313   1.256
  337    H    ILE  39           H        ILE  39  -0.137   5.457   0.681
  338    HA   ILE  39           HA       ILE  39   0.949   6.146   3.243
  339    HB   ILE  39           HB       ILE  39   2.186   4.006   2.647
  340   HG12  ILE  39          1HG1      ILE  39   4.057   6.330   2.509
  341   HG13  ILE  39          2HG1      ILE  39   3.059   6.032   3.952
  342   HG21  ILE  39          1HG2      ILE  39   3.832   4.124   0.808
  343   HG22  ILE  39          2HG2      ILE  39   2.173   4.301   0.193
  344   HG23  ILE  39          3HG2      ILE  39   3.218   5.732   0.359
  345   HD11  ILE  39          1HD1      ILE  39   5.303   5.047   4.204
  346   HD12  ILE  39          2HD1      ILE  39   4.047   3.786   4.174
  347   HD13  ILE  39          3HD1      ILE  39   5.046   4.084   2.732
  348    H    ASP  40           H        ASP  40   2.455   7.984   3.070
  349    HA   ASP  40           HA       ASP  40   1.796   9.535   0.744
  350    HB2  ASP  40          1HB       ASP  40   2.900  11.429   2.088
  351    HB3  ASP  40          2HB       ASP  40   1.484  10.543   2.707
  352    HD2  ASP  40           HD       ASP  40   4.122  10.857   5.274
  353    H    VAL  41           H        VAL  41   4.726   8.480   2.641
  354    HA   VAL  41           HA       VAL  41   6.330   8.991   0.233
  355    HB   VAL  41           HB       VAL  41   7.140   9.189   3.172
  356   HG11  VAL  41          1HG1      VAL  41   9.299  10.008   2.287
  357   HG12  VAL  41          2HG1      VAL  41   8.968   8.349   1.735
  358   HG13  VAL  41          3HG1      VAL  41   8.728   9.720   0.628
  359   HG21  VAL  41          1HG2      VAL  41   7.442  11.572   2.722
  360   HG22  VAL  41          2HG2      VAL  41   6.803  11.340   1.077
  361   HG23  VAL  41          3HG2      VAL  41   5.755  11.056   2.487
  362    H    CYS  42           H        CYS  42   7.135   7.181  -0.686
  363    HA   CYS  42           HA       CYS  42   6.751   4.693   0.587
  364    HB2  CYS  42          1HB       CYS  42   6.605   5.045  -1.841
  365    HB3  CYS  42          2HB       CYS  42   8.343   5.352  -1.900
  366    HG   CYS  42           HG       CYS  42   7.826   2.983  -2.922
  367    HA   PRO  43           HA       PRO  43  10.627   4.871   2.692
  368    HB2  PRO  43          1HB       PRO  43  10.351   2.718   4.314
  369    HB3  PRO  43          2HB       PRO  43   9.457   4.204   4.663
  370    HG2  PRO  43          1HG       PRO  43   8.525   1.715   3.199
  371    HG3  PRO  43          2HG       PRO  43   7.679   2.666   4.427
  372    HD2  PRO  43          1HD       PRO  43   7.181   2.975   1.729
  373    HD3  PRO  43          2HD       PRO  43   6.998   4.310   2.874
  374    H    LYS  44           H        LYS  44  12.694   4.028   2.511
  375    HA   LYS  44           HA       LYS  44  13.014   2.382   0.241
  376    HB2  LYS  44          1HB       LYS  44  14.880   3.192   2.488
  377    HB3  LYS  44          2HB       LYS  44  15.394   2.301   1.035
  378    HG2  LYS  44          1HG       LYS  44  14.704   4.191  -0.377
  379    HG3  LYS  44          2HG       LYS  44  14.175   5.083   1.070
  380    HD2  LYS  44          1HD       LYS  44  16.462   5.091   1.933
  381    HD3  LYS  44          2HD       LYS  44  17.010   4.133   0.536
  382    HE2  LYS  44          1HE       LYS  44  16.348   5.954  -0.975
  383    HE3  LYS  44          2HE       LYS  44  15.801   6.913   0.419
  384    HZ1  LYS  44          1HZ       LYS  44  18.004   7.553  -0.290
  385    HZ2  LYS  44          2HZ       LYS  44  18.063   6.909   1.227
  386    HZ3  LYS  44          3HZ       LYS  44  18.570   6.020  -0.066
  387    H    ASN  45           H        ASN  45  14.341   0.273   0.338
  388    HA   ASN  45           HA       ASN  45  12.628  -1.466   1.712
  389    HB2  ASN  45          1HB       ASN  45  15.117  -2.246   0.025
  390    HB3  ASN  45          2HB       ASN  45  13.885  -3.127   0.961
  391   HD21  ASN  45          1HD2      ASN  45  13.083  -2.568  -2.749
  392   HD22  ASN  45          2HD2      ASN  45  14.597  -2.894  -1.971
  393    H    SER  46           H        SER  46  13.155  -2.921   3.486
  394    HA   SER  46           HA       SER  46  15.570  -2.121   4.909
  395    HB2  SER  46          1HB       SER  46  14.430  -2.825   6.939
  396    HB3  SER  46          2HB       SER  46  13.402  -1.692   6.034
  397    HG   SER  46           HG       SER  46  12.224  -3.471   5.278
  398    H    LEU  47           H        LEU  47  16.162  -4.136   6.565
  399    HA   LEU  47           HA       LEU  47  17.045  -6.141   4.728
  400    HB2  LEU  47          1HB       LEU  47  17.202  -5.737   7.650
  401    HB3  LEU  47          2HB       LEU  47  18.118  -7.069   6.911
  402    HG   LEU  47           HG       LEU  47  18.521  -4.093   6.413
  403   HD11  LEU  47          1HD1      LEU  47  20.748  -4.486   7.500
  404   HD12  LEU  47          2HD1      LEU  47  19.410  -4.879   8.605
  405   HD13  LEU  47          3HD1      LEU  47  20.295  -6.184   7.779
  406   HD21  LEU  47          1HD2      LEU  47  20.456  -4.783   5.040
  407   HD22  LEU  47          2HD2      LEU  47  19.991  -6.486   5.270
  408   HD23  LEU  47          3HD2      LEU  47  18.908  -5.378   4.394
  409    H    LEU  48           H        LEU  48  14.362  -5.702   6.946
  410    HA   LEU  48           HA       LEU  48  14.006  -8.586   7.189
  411    HB2  LEU  48          1HB       LEU  48  12.738  -6.202   8.390
  412    HB3  LEU  48          2HB       LEU  48  12.207  -7.824   8.892
  413    HG   LEU  48           HG       LEU  48  14.951  -6.579   9.325
  414   HD11  LEU  48          1HD1      LEU  48  14.350  -6.780  11.752
  415   HD12  LEU  48          2HD1      LEU  48  13.187  -5.753  10.881
  416   HD13  LEU  48          3HD1      LEU  48  12.761  -7.433  11.289
  417   HD21  LEU  48          1HD2      LEU  48  15.496  -8.648  10.558
  418   HD22  LEU  48          2HD2      LEU  48  13.929  -9.335  10.065
  419   HD23  LEU  48          3HD2      LEU  48  15.156  -8.945   8.837
  420    H    VAL  49           H        VAL  49  12.299  -5.582   6.119
  421    HA   VAL  49           HA       VAL  49  10.457  -7.339   4.651
  422    HB   VAL  49           HB       VAL  49   8.705  -5.572   5.037
  423   HG11  VAL  49          1HG1      VAL  49   8.237  -6.167   7.391
  424   HG12  VAL  49          2HG1      VAL  49   8.778  -7.588   6.466
  425   HG13  VAL  49          3HG1      VAL  49   9.903  -6.763   7.572
  426   HG21  VAL  49          1HG2      VAL  49   9.043  -3.912   6.798
  427   HG22  VAL  49          2HG2      VAL  49  10.739  -4.428   6.957
  428   HG23  VAL  49          3HG2      VAL  49  10.171  -3.686   5.442
  429    H    LYS  50           H        LYS  50   9.772  -6.572   2.585
  430    HA   LYS  50           HA       LYS  50  11.490  -4.428   1.563
  431    HB2  LYS  50          1HB       LYS  50  11.724  -6.591   0.460
  432    HB3  LYS  50          2HB       LYS  50   9.966  -6.662   0.190
  433    HG2  LYS  50          1HG       LYS  50  10.135  -4.673  -1.281
  434    HG3  LYS  50          2HG       LYS  50  11.900  -4.672  -1.046
  435    HD2  LYS  50          1HD       LYS  50  12.059  -6.894  -2.056
  436    HD3  LYS  50          2HD       LYS  50  10.290  -6.954  -2.241
  437    HE2  LYS  50          1HE       LYS  50  10.393  -4.979  -3.720
  438    HE3  LYS  50          2HE       LYS  50  12.165  -4.965  -3.561
  439    HZ1  LYS  50          1HZ       LYS  50  11.462  -6.063  -5.578
  440    HZ2  LYS  50          2HZ       LYS  50  12.209  -7.142  -4.577
  441    HZ3  LYS  50          3HZ       LYS  50  10.565  -7.154  -4.725
  442    H    TYR  51           H        TYR  51  10.588  -2.710   0.332
  443    HA   TYR  51           HA       TYR  51   7.700  -2.402   0.809
  444    HB2  TYR  51          1HB       TYR  51   9.934  -0.372   0.762
  445    HB3  TYR  51          2HB       TYR  51   8.201   0.028   0.822
  446    HD1  TYR  51          1HD       TYR  51  11.096  -1.108   2.730
  447    HD2  TYR  51          2HD       TYR  51   6.869  -0.562   2.841
  448    HE1  TYR  51          1HE       TYR  51  11.143  -1.308   5.199
  449    HE2  TYR  51          2HE       TYR  51   6.897  -0.760   5.305
  450    HH   TYR  51           HH       TYR  51   8.175  -1.072   7.164
  451    H    VAL  52           H        VAL  52   6.442  -2.257  -0.992
  452    HA   VAL  52           HA       VAL  52   7.682  -0.952  -3.314
  453    HB   VAL  52           HB       VAL  52   5.530  -3.124  -3.314
  454   HG11  VAL  52          1HG1      VAL  52   5.752  -3.012  -5.774
  455   HG12  VAL  52          2HG1      VAL  52   5.219  -1.451  -5.107
  456   HG13  VAL  52          3HG1      VAL  52   6.913  -1.674  -5.608
  457   HG21  VAL  52          1HG2      VAL  52   7.195  -4.509  -4.447
  458   HG22  VAL  52          2HG2      VAL  52   8.408  -3.224  -4.233
  459   HG23  VAL  52          3HG2      VAL  52   7.716  -4.041  -2.811
  460    H    CYS  53           H        CYS  53   6.639   0.856  -4.049
  461    HA   CYS  53           HA       CYS  53   3.893   1.221  -3.096
  462    HB2  CYS  53          1HB       CYS  53   5.844   3.468  -3.562
  463    HB3  CYS  53          2HB       CYS  53   4.238   3.559  -2.836
  464    HG   CYS  53           HG       CYS  53   6.070   4.038  -1.006
  465    H    CYS  54           H        CYS  54   2.607   2.673  -4.637
  466    HA   CYS  54           HA       CYS  54   3.772   3.255  -7.163
  467    HB2  CYS  54          1HB       CYS  54   1.937   1.936  -8.396
  468    HB3  CYS  54          2HB       CYS  54   3.408   1.103  -7.882
  469    HG   CYS  54           HG       CYS  54   1.343  -0.516  -7.650
  470    H    ASN  55           H        ASN  55   2.133   4.557  -8.500
  471    HA   ASN  55           HA       ASN  55   0.860   6.094  -6.390
  472    HB2  ASN  55          1HB       ASN  55   1.572   8.162  -7.693
  473    HB3  ASN  55          2HB       ASN  55   2.711   6.841  -7.338
  474   HD21  ASN  55          1HD2      ASN  55   3.126   8.128 -10.831
  475   HD22  ASN  55          2HD2      ASN  55   3.042   8.888  -9.276
  476    H    THR  56           H        THR  56  -0.492   3.887  -7.854
  477    HA   THR  56           HA       THR  56  -2.672   5.496  -8.975
  478    HB   THR  56           HB       THR  56  -3.065   3.673 -10.654
  479    HG1  THR  56          1HG       THR  56  -1.309   2.183 -10.981
  480   HG21  THR  56          1HG2      THR  56  -1.213   4.256 -12.181
  481   HG22  THR  56          2HG2      THR  56  -1.813   5.696 -11.324
  482   HG23  THR  56          3HG2      THR  56  -0.294   4.924 -10.812
  483    H    ASP  57           H        ASP  57  -4.695   3.920  -9.248
  484    HA   ASP  57           HA       ASP  57  -5.180   3.423  -6.513
  485    HB2  ASP  57          1HB       ASP  57  -6.999   3.230  -8.976
  486    HB3  ASP  57          2HB       ASP  57  -7.383   2.813  -7.287
  487    HD2  ASP  57           HD       ASP  57  -7.480   6.555  -8.324
  488    H    ARG  58           H        ARG  58  -5.322   1.384  -5.482
  489    HA   ARG  58           HA       ARG  58  -5.185  -0.756  -5.180
  490    HB2  ARG  58          1HB       ARG  58  -6.827  -0.821  -7.751
  491    HB3  ARG  58          2HB       ARG  58  -6.643  -2.211  -6.667
  492    HG2  ARG  58          1HG       ARG  58  -7.849  -1.149  -4.926
  493    HG3  ARG  58          2HG       ARG  58  -7.653   0.464  -5.638
  494    HD2  ARG  58          1HD       ARG  58  -9.204  -1.757  -7.022
  495    HD3  ARG  58          2HD       ARG  58  -9.977  -0.659  -5.871
  496    HE   ARG  58           HE       ARG  58  -8.638   1.009  -7.664
  497   HH11  ARG  58          1HH1      ARG  58 -10.960   1.152 -10.252
  498   HH12  ARG  58          2HH1      ARG  58  -9.578   1.916  -9.495
  499   HH21  ARG  58          1HH2      ARG  58 -11.834  -0.808  -9.370
  500   HH22  ARG  58          2HH2      ARG  58 -11.111  -1.509  -7.959
  501    H    CYS  59           H        CYS  59  -2.960   0.422  -6.658
  502    HA   CYS  59           HA       CYS  59  -2.381  -1.301  -8.864
  503    HB2  CYS  59          1HB       CYS  59  -0.325   0.241  -8.824
  504    HB3  CYS  59          2HB       CYS  59  -1.788   1.209  -8.522
  505    HG   CYS  59           HG       CYS  59   0.183   2.126  -7.140
  506    H    ASN  60           H        ASN  60  -1.904  -1.201  -5.380
  507    HA   ASN  60           HA       ASN  60   0.103  -3.249  -5.491
  508    HB2  ASN  60          1HB       ASN  60  -0.171  -3.219  -2.975
  509    HB3  ASN  60          2HB       ASN  60   0.232  -1.633  -3.648
  510   HD21  ASN  60          1HD2      ASN  60  -0.676  -1.163  -1.420
  511   HD22  ASN  60          2HD2      ASN  60  -2.367  -0.801  -1.313
  Start of MODEL    3
    1    H1   MET   0          1H        MET   0  -8.271  11.968  -2.801
    2    H2   MET   0          2H        MET   0  -6.789  11.923  -3.029
    3    H    MET   0           H        MET   0  -7.703  11.012  -3.836
    4    H3   MET   0          3H        MET   0  -7.699  11.044  -3.835
    5    HA   MET   0           HA       MET   0  -6.424  10.357  -1.452
    6    HB2  MET   0          1HB       MET   0  -9.444  10.442  -1.274
    7    HB3  MET   0          2HB       MET   0  -8.405   9.574  -0.119
    8    HG2  MET   0          1HG       MET   0  -7.383  11.635   0.602
    9    HG3  MET   0          2HG       MET   0  -8.230  12.550  -0.667
   10    HE1  MET   0          1HE       MET   0 -10.157  10.790   3.156
   11    HE2  MET   0          2HE       MET   0  -9.411   9.757   1.910
   12    HE3  MET   0          3HE       MET   0  -8.408  10.896   2.842
   13    H    LEU   1           H        LEU   1  -5.519   8.631  -2.605
   14    HA   LEU   1           HA       LEU   1  -7.081   7.251  -4.520
   15    HB2  LEU   1          1HB       LEU   1  -4.415   7.284  -3.408
   16    HB3  LEU   1          2HB       LEU   1  -4.770   5.728  -4.193
   17    HG   LEU   1           HG       LEU   1  -5.538   7.312  -6.185
   18   HD11  LEU   1          1HD1      LEU   1  -4.021   9.303  -6.358
   19   HD12  LEU   1          2HD1      LEU   1  -5.087   9.423  -4.938
   20   HD13  LEU   1          3HD1      LEU   1  -3.386   8.940  -4.736
   21   HD21  LEU   1          1HD2      LEU   1  -3.289   7.062  -7.177
   22   HD22  LEU   1          2HD2      LEU   1  -2.644   6.651  -5.569
   23   HD23  LEU   1          3HD2      LEU   1  -3.840   5.588  -6.347
   24    H    LYS   2           H        LYS   2  -6.705   4.628  -4.452
   25    HA   LYS   2           HA       LYS   2  -7.632   3.798  -1.789
   26    HB2  LYS   2          1HB       LYS   2  -8.348   2.561  -4.459
   27    HB3  LYS   2          2HB       LYS   2  -9.019   2.151  -2.863
   28    HG2  LYS   2          1HG       LYS   2  -9.400   4.787  -4.325
   29    HG3  LYS   2          2HG       LYS   2 -10.600   3.477  -4.224
   30    HD2  LYS   2          1HD       LYS   2 -10.618   3.702  -1.760
   31    HD3  LYS   2          2HD       LYS   2  -9.451   5.040  -1.885
   32    HE2  LYS   2          1HE       LYS   2 -12.225   4.996  -3.114
   33    HE3  LYS   2          2HE       LYS   2 -11.777   5.835  -1.611
   34    HZ1  LYS   2          1HZ       LYS   2 -11.786   7.326  -3.492
   35    HZ2  LYS   2          2HZ       LYS   2 -10.256   7.183  -2.891
   36    HZ3  LYS   2          3HZ       LYS   2 -10.671   6.404  -4.285
   37    H    CYS   3           H        CYS   3  -6.633   2.027  -0.863
   38    HA   CYS   3           HA       CYS   3  -4.688   0.659  -2.581
   39    HB2  CYS   3          1HB       CYS   3  -4.469   1.137   0.393
   40    HB3  CYS   3          2HB       CYS   3  -3.299   0.287  -0.620
   41    HG   CYS   3           HG       CYS   3  -2.314   2.617   0.103
   42    H    ASN   4           H        ASN   4  -4.506  -1.677  -2.189
   43    HA   ASN   4           HA       ASN   4  -7.070  -2.735  -1.599
   44    HB2  ASN   4          1HB       ASN   4  -4.572  -4.351  -2.492
   45    HB3  ASN   4          2HB       ASN   4  -6.272  -4.707  -2.099
   46   HD21  ASN   4          1HD2      ASN   4  -5.390  -3.819  -5.787
   47   HD22  ASN   4          2HD2      ASN   4  -4.363  -4.534  -4.590
   48    H    LYS   5           H        LYS   5  -7.483  -4.409   0.073
   49    HA   LYS   5           HA       LYS   5  -5.425  -4.622   2.130
   50    HB2  LYS   5          1HB       LYS   5  -8.288  -3.712   2.526
   51    HB3  LYS   5          2HB       LYS   5  -7.221  -4.252   3.843
   52    HG2  LYS   5          1HG       LYS   5  -6.719  -1.868   2.027
   53    HG3  LYS   5          2HG       LYS   5  -7.356  -1.783   3.687
   54    HD2  LYS   5          1HD       LYS   5  -4.617  -2.700   2.773
   55    HD3  LYS   5          2HD       LYS   5  -5.018  -1.327   3.831
   56    HE2  LYS   5          1HE       LYS   5  -6.070  -3.136   5.375
   57    HE3  LYS   5          2HE       LYS   5  -5.087  -4.280   4.429
   58    HZ1  LYS   5          1HZ       LYS   5  -3.933  -3.530   6.398
   59    HZ2  LYS   5          2HZ       LYS   5  -3.140  -3.014   5.046
   60    HZ3  LYS   5          3HZ       LYS   5  -4.051  -1.955   5.922
   61    H    LEU   6           H        LEU   6  -8.930  -5.460   2.163
   62    HA   LEU   6           HA       LEU   6  -8.177  -8.188   2.727
   63    HB2  LEU   6          1HB       LEU   6  -9.804  -7.114   3.970
   64    HB3  LEU   6          2HB       LEU   6 -10.885  -6.730   2.609
   65    HG   LEU   6           HG       LEU   6 -11.081  -9.241   2.229
   66   HD11  LEU   6          1HD1      LEU   6 -10.584 -10.685   4.221
   67   HD12  LEU   6          2HD1      LEU   6  -9.108  -9.910   3.598
   68   HD13  LEU   6          3HD1      LEU   6  -9.902  -9.270   5.056
   69   HD21  LEU   6          1HD2      LEU   6 -12.784  -9.528   3.996
   70   HD22  LEU   6          2HD2      LEU   6 -12.144  -8.087   4.823
   71   HD23  LEU   6          3HD2      LEU   6 -12.875  -7.936   3.208
   72    H    VAL   7           H        VAL   7  -8.367  -9.930   1.361
   73    HA   VAL   7           HA       VAL   7  -8.572  -9.424  -1.401
   74    HB   VAL   7           HB       VAL   7  -8.580 -11.917  -1.598
   75   HG11  VAL   7          1HG1      VAL   7  -6.407 -12.325  -0.492
   76   HG12  VAL   7          2HG1      VAL   7  -6.435 -10.729  -1.280
   77   HG13  VAL   7          3HG1      VAL   7  -6.628 -10.853   0.484
   78   HG21  VAL   7          1HG2      VAL   7  -8.482 -13.309   0.408
   79   HG22  VAL   7          2HG2      VAL   7  -8.778 -11.872   1.417
   80   HG23  VAL   7          3HG2      VAL   7 -10.025 -12.433   0.277
   81    HA   PRO   8           HA       PRO   8  -9.032 -10.693  -2.916
   82    HB2  PRO   8          1HB       PRO   8 -10.144 -10.639  -5.368
   83    HB3  PRO   8          2HB       PRO   8 -10.390 -12.058  -4.341
   84    HG2  PRO   8          1HG       PRO   8 -12.222  -9.686  -4.790
   85    HG3  PRO   8          2HG       PRO   8 -12.628 -11.404  -4.698
   86    HD2  PRO   8          1HD       PRO   8 -12.903  -9.649  -2.547
   87    HD3  PRO   8          2HD       PRO   8 -12.679 -11.392  -2.351
   88    H    ILE   9           H        ILE   9 -11.394  -8.141  -3.360
   89    HA   ILE   9           HA       ILE   9  -9.243  -6.581  -4.613
   90    HB   ILE   9           HB       ILE   9 -12.199  -6.624  -5.231
   91   HG12  ILE   9          1HG1      ILE   9 -11.028  -8.559  -6.103
   92   HG13  ILE   9          2HG1      ILE   9 -11.498  -7.471  -7.422
   93   HG21  ILE   9          1HG2      ILE   9 -11.322  -4.352  -5.380
   94   HG22  ILE   9          2HG2      ILE   9  -9.994  -4.916  -6.423
   95   HG23  ILE   9          3HG2      ILE   9 -11.677  -5.004  -6.997
   96   HD11  ILE   9          1HD1      ILE   9  -9.131  -8.414  -7.564
   97   HD12  ILE   9          2HD1      ILE   9  -9.236  -6.639  -7.632
   98   HD13  ILE   9          3HD1      ILE   9  -8.738  -7.442  -6.125
   99    H    ALA  10           H        ALA  10 -11.365  -6.939  -1.947
  100    HA   ALA  10           HA       ALA  10 -12.444  -4.508  -1.493
  101    HB1  ALA  10          1HB       ALA  10 -11.929  -6.878  -0.047
  102    HB2  ALA  10          2HB       ALA  10 -11.293  -5.556   0.960
  103    HB3  ALA  10          3HB       ALA  10 -12.991  -5.534   0.432
  104    H    TYR  11           H        TYR  11 -11.785  -2.474  -0.815
  105    HA   TYR  11           HA       TYR  11  -8.905  -2.144  -0.371
  106    HB2  TYR  11          1HB       TYR  11  -8.925  -0.208  -1.851
  107    HB3  TYR  11          2HB       TYR  11  -9.283  -1.731  -2.702
  108    HD1  TYR  11          1HD       TYR  11 -10.660   1.496  -1.576
  109    HD2  TYR  11          2HD       TYR  11 -11.486  -2.131  -3.659
  110    HE1  TYR  11          1HE       TYR  11 -12.735   2.499  -2.483
  111    HE2  TYR  11          2HE       TYR  11 -13.560  -1.147  -4.573
  112    HH   TYR  11           HH       TYR  11 -14.906   0.688  -4.659
  113    H    LYS  12           H        LYS  12  -8.356   0.002   0.594
  114    HA   LYS  12           HA       LYS  12 -10.661   1.147   2.008
  115    HB2  LYS  12          1HB       LYS  12  -7.843   0.561   2.933
  116    HB3  LYS  12          2HB       LYS  12  -8.883   1.748   3.755
  117    HG2  LYS  12          1HG       LYS  12 -10.573  -0.098   4.080
  118    HG3  LYS  12          2HG       LYS  12  -9.350  -1.236   3.467
  119    HD2  LYS  12          1HD       LYS  12  -7.828  -0.614   5.276
  120    HD3  LYS  12          2HD       LYS  12  -8.998   0.588   5.871
  121    HE2  LYS  12          1HE       LYS  12 -10.633  -1.246   6.243
  122    HE3  LYS  12          2HE       LYS  12  -9.390  -2.418   5.749
  123    HZ1  LYS  12          1HZ       LYS  12  -9.510  -2.205   8.137
  124    HZ2  LYS  12          2HZ       LYS  12  -8.046  -1.673   7.595
  125    HZ3  LYS  12          3HZ       LYS  12  -9.199  -0.587   8.054
  126    H    THR  13           H        THR  13 -10.434   3.471   2.533
  127    HA   THR  13           HA       THR  13  -9.273   4.788   0.228
  128    HB   THR  13           HB       THR  13 -10.923   5.867   2.564
  129    HG1  THR  13          1HG       THR  13 -12.617   5.816   0.969
  130   HG21  THR  13          1HG2      THR  13 -11.297   7.813   1.089
  131   HG22  THR  13          2HG2      THR  13  -9.565   7.599   1.440
  132   HG23  THR  13          3HG2      THR  13 -10.223   7.094  -0.133
  133    H    CYS  14           H        CYS  14  -7.433   5.933   0.161
  134    HA   CYS  14           HA       CYS  14  -5.716   5.833   2.385
  135    HB2  CYS  14          1HB       CYS  14  -5.572   7.306  -0.242
  136    HB3  CYS  14          2HB       CYS  14  -4.283   7.354   0.965
  137    HG   CYS  14           HG       CYS  14  -3.581   5.773  -1.020
  138    HA   PRO  15           HA       PRO  15  -6.983   9.518   4.333
  139    HB2  PRO  15          1HB       PRO  15  -4.919  10.049   6.008
  140    HB3  PRO  15          2HB       PRO  15  -5.948   8.640   6.298
  141    HG2  PRO  15          1HG       PRO  15  -3.273   8.785   4.868
  142    HG3  PRO  15          2HG       PRO  15  -3.824   7.616   6.075
  143    HD2  PRO  15          1HD       PRO  15  -3.892   7.062   3.378
  144    HD3  PRO  15          2HD       PRO  15  -5.078   6.378   4.496
  145    H    GLU  16           H        GLU  16  -6.828  11.809   4.440
  146    HA   GLU  16           HA       GLU  16  -5.816  12.843   2.111
  147    HB2  GLU  16          1HB       GLU  16  -7.547  13.893   3.476
  148    HB3  GLU  16          2HB       GLU  16  -6.362  14.191   4.771
  149    HG2  GLU  16          1HG       GLU  16  -5.134  15.791   3.225
  150    HG3  GLU  16          2HG       GLU  16  -6.354  15.340   2.012
  151    HE2  GLU  16           HE       GLU  16  -7.455  18.352   3.664
  152    H    GLY  17           H        GLY  17  -3.860  13.787   1.490
  153    HA2  GLY  17          1HA       GLY  17  -1.791  14.786   1.911
  154    HA3  GLY  17          2HA       GLY  17  -1.792  14.140   3.540
  155    H    LYS  18           H        LYS  18  -2.835  11.447   2.295
  156    HA   LYS  18           HA       LYS  18  -0.209  10.554   1.349
  157    HB2  LYS  18          1HB       LYS  18  -2.589   8.924   2.269
  158    HB3  LYS  18          2HB       LYS  18  -0.945   8.332   1.935
  159    HG2  LYS  18          1HG       LYS  18  -1.769  10.190   4.193
  160    HG3  LYS  18          2HG       LYS  18  -1.345   8.468   4.348
  161    HD2  LYS  18          1HD       LYS  18   0.921   8.987   3.453
  162    HD3  LYS  18          2HD       LYS  18   0.485  10.712   3.432
  163    HE2  LYS  18          1HE       LYS  18  -0.012  10.504   5.903
  164    HE3  LYS  18          2HE       LYS  18   0.719   8.883   5.835
  165    HZ1  LYS  18          1HZ       LYS  18   2.305  10.545   6.532
  166    HZ2  LYS  18          2HZ       LYS  18   2.759   9.904   5.081
  167    HZ3  LYS  18          3HZ       LYS  18   2.081  11.407   5.145
  168    H    ASN  19           H        ASN  19  -0.141   9.070  -0.521
  169    HA   ASN  19           HA       ASN  19  -2.319   9.724  -2.333
  170    HB2  ASN  19          1HB       ASN  19  -0.368  11.491  -2.652
  171    HB3  ASN  19          2HB       ASN  19   0.476   9.937  -2.853
  172   HD21  ASN  19          1HD2      ASN  19  -1.562  11.660  -5.898
  173   HD22  ASN  19          2HD2      ASN  19  -1.526  12.331  -4.302
  174    H    LEU  20           H        LEU  20   0.785   7.941  -1.699
  175    HA   LEU  20           HA       LEU  20   0.295   6.246  -3.994
  176    HB2  LEU  20          1HB       LEU  20   2.416   6.223  -1.939
  177    HB3  LEU  20          2HB       LEU  20   2.616   5.426  -3.517
  178    HG   LEU  20           HG       LEU  20   2.482   8.417  -2.972
  179   HD11  LEU  20          1HD1      LEU  20   4.821   8.398  -3.880
  180   HD12  LEU  20          2HD1      LEU  20   4.677   7.360  -2.442
  181   HD13  LEU  20          3HD1      LEU  20   4.717   6.631  -4.066
  182   HD21  LEU  20          1HD2      LEU  20   2.863   8.700  -5.396
  183   HD22  LEU  20          2HD2      LEU  20   2.717   6.938  -5.608
  184   HD23  LEU  20          3HD2      LEU  20   1.323   7.886  -5.034
  185    H    CYS  21           H        CYS  21   0.313   3.879  -3.842
  186    HA   CYS  21           HA       CYS  21  -0.466   2.955  -1.174
  187    HB2  CYS  21          1HB       CYS  21  -0.966   2.162  -4.122
  188    HB3  CYS  21          2HB       CYS  21  -1.374   1.025  -2.814
  189    HG   CYS  21           HG       CYS  21  -3.520   2.065  -3.790
  190    H    TYR  22           H        TYR  22   0.812   1.351  -0.205
  191    HA   TYR  22           HA       TYR  22   3.027   0.322  -1.849
  192    HB2  TYR  22          1HB       TYR  22   4.481   0.490  -0.001
  193    HB3  TYR  22          2HB       TYR  22   3.694   2.072  -0.226
  194    HD1  TYR  22          1HD       TYR  22   3.967  -0.885   1.957
  195    HD2  TYR  22          2HD       TYR  22   2.125   2.925   1.429
  196    HE1  TYR  22          1HE       TYR  22   3.232  -0.921   4.323
  197    HE2  TYR  22          2HE       TYR  22   1.384   2.905   3.788
  198    HH   TYR  22           HH       TYR  22   1.364   1.759   5.756
  199    H    LYS  23           H        LYS  23   3.854  -1.809  -1.200
  200    HA   LYS  23           HA       LYS  23   2.058  -3.250   0.614
  201    HB2  LYS  23          1HB       LYS  23   2.342  -5.240  -0.817
  202    HB3  LYS  23          2HB       LYS  23   1.463  -3.920  -1.625
  203    HG2  LYS  23          1HG       LYS  23   3.436  -3.330  -2.913
  204    HG3  LYS  23          2HG       LYS  23   4.407  -4.536  -2.034
  205    HD2  LYS  23          1HD       LYS  23   3.628  -5.249  -4.331
  206    HD3  LYS  23          2HD       LYS  23   3.197  -6.351  -3.001
  207    HE2  LYS  23          1HE       LYS  23   0.948  -5.421  -2.915
  208    HE3  LYS  23          2HE       LYS  23   1.365  -4.237  -4.177
  209    HZ1  LYS  23          1HZ       LYS  23   0.174  -6.117  -5.078
  210    HZ2  LYS  23          2HZ       LYS  23   1.705  -6.072  -5.692
  211    HZ3  LYS  23          3HZ       LYS  23   1.317  -7.167  -4.521
  212    H    MET  24           H        MET  24   3.085  -4.951   1.836
  213    HA   MET  24           HA       MET  24   5.963  -4.476   1.965
  214    HB2  MET  24          1HB       MET  24   3.943  -5.146   4.116
  215    HB3  MET  24          2HB       MET  24   5.703  -5.120   4.379
  216    HG2  MET  24          1HG       MET  24   5.719  -2.722   3.710
  217    HG3  MET  24          2HG       MET  24   3.944  -2.776   3.594
  218    HE1  MET  24          1HE       MET  24   2.730  -3.017   7.218
  219    HE2  MET  24          2HE       MET  24   2.339  -2.553   5.545
  220    HE3  MET  24          3HE       MET  24   2.770  -4.239   5.923
  221    H    PHE  25           H        PHE  25   7.345  -6.237   1.859
  222    HA   PHE  25           HA       PHE  25   6.065  -8.875   1.962
  223    HB2  PHE  25          1HB       PHE  25   8.676  -7.836   0.719
  224    HB3  PHE  25          2HB       PHE  25   8.143  -9.520   0.626
  225    HD1  PHE  25          1HD       PHE  25   7.378  -6.078  -0.441
  226    HD2  PHE  25          2HD       PHE  25   6.568 -10.198  -1.011
  227    HE1  PHE  25          1HE       PHE  25   6.122  -5.537  -2.559
  228    HE2  PHE  25          2HE       PHE  25   5.316  -9.666  -3.121
  229    HZ   PHE  25           HZ       PHE  25   5.108  -7.342  -3.871
  230    H    MET  26           H        MET  26   7.513 -10.667   2.872
  231    HA   MET  26           HA       MET  26   9.548  -9.546   4.640
  232    HB2  MET  26          1HB       MET  26   8.019 -12.154   4.767
  233    HB3  MET  26          2HB       MET  26   9.374 -11.734   5.842
  234    HG2  MET  26          1HG       MET  26   8.100  -9.826   6.712
  235    HG3  MET  26          2HG       MET  26   6.747 -10.231   5.629
  236    HE1  MET  26          1HE       MET  26   5.346 -11.174   9.194
  237    HE2  MET  26          2HE       MET  26   6.431  -9.819   8.796
  238    HE3  MET  26          3HE       MET  26   5.077 -10.223   7.713
  239    H    MET  27           H        MET  27  11.667 -10.515   4.638
  240    HA   MET  27           HA       MET  27  12.617 -10.914   2.153
  241    HB2  MET  27          1HB       MET  27  13.608 -11.739   4.873
  242    HB3  MET  27          2HB       MET  27  14.569 -12.063   3.410
  243    HG2  MET  27          1HG       MET  27  13.659  -9.341   4.398
  244    HG3  MET  27          2HG       MET  27  15.305 -10.006   4.527
  245    HE1  MET  27          1HE       MET  27  16.527 -10.086   0.835
  246    HE2  MET  27          2HE       MET  27  16.977 -10.251   2.551
  247    HE3  MET  27          3HE       MET  27  15.849 -11.412   1.809
  248    H    SER  28           H        SER  28  11.282 -13.351   4.402
  249    HA   SER  28           HA       SER  28  12.000 -15.602   2.974
  250    HB2  SER  28          1HB       SER  28  11.017 -15.675   5.196
  251    HB3  SER  28          2HB       SER  28   9.502 -14.974   4.581
  252    HG   SER  28           HG       SER  28   9.397 -17.250   4.817
  253    H    ASP  29           H        ASP  29   8.663 -14.144   2.999
  254    HA   ASP  29           HA       ASP  29   8.234 -15.383   0.451
  255    HB2  ASP  29          1HB       ASP  29   6.506 -15.488   2.346
  256    HB3  ASP  29          2HB       ASP  29   6.465 -13.722   2.124
  257    HD2  ASP  29           HD       ASP  29   3.757 -15.195   0.202
  258    H    LEU  30           H        LEU  30   9.691 -13.945  -0.830
  259    HA   LEU  30           HA       LEU  30   9.042 -11.162  -1.001
  260    HB2  LEU  30          1HB       LEU  30  10.799 -13.129  -2.181
  261    HB3  LEU  30          2HB       LEU  30  10.543 -11.743  -3.266
  262    HG   LEU  30           HG       LEU  30  11.892 -10.396  -2.055
  263   HD11  LEU  30          1HD1      LEU  30  11.881 -10.318   0.453
  264   HD12  LEU  30          2HD1      LEU  30  10.228 -10.258  -0.203
  265   HD13  LEU  30          3HD1      LEU  30  10.861 -11.776   0.478
  266   HD21  LEU  30          1HD2      LEU  30  13.665 -11.553  -0.781
  267   HD22  LEU  30          2HD2      LEU  30  12.677 -13.035  -0.786
  268   HD23  LEU  30          3HD2      LEU  30  13.283 -12.364  -2.318
  269    H    THR  31           H        THR  31   7.733 -14.122  -2.230
  270    HA   THR  31           HA       THR  31   7.037 -13.156  -4.823
  271    HB   THR  31           HB       THR  31   5.986 -15.523  -3.195
  272    HG1  THR  31          1HG       THR  31   7.485 -16.685  -4.543
  273   HG21  THR  31          1HG2      THR  31   5.256 -16.411  -5.381
  274   HG22  THR  31          2HG2      THR  31   4.458 -14.861  -5.021
  275   HG23  THR  31          3HG2      THR  31   5.813 -14.919  -6.174
  276    H    ILE  32           H        ILE  32   5.318 -13.478  -1.677
  277    HA   ILE  32           HA       ILE  32   3.136 -11.946  -2.903
  278    HB   ILE  32           HB       ILE  32   2.971 -14.330  -1.001
  279   HG12  ILE  32          1HG1      ILE  32   3.217 -14.887  -3.335
  280   HG13  ILE  32          2HG1      ILE  32   1.628 -15.351  -2.684
  281   HG21  ILE  32          1HG2      ILE  32   0.533 -13.924  -0.966
  282   HG22  ILE  32          2HG2      ILE  32   1.421 -12.547  -0.274
  283   HG23  ILE  32          3HG2      ILE  32   0.765 -12.444  -1.924
  284   HD11  ILE  32          1HD1      ILE  32   1.421 -14.419  -4.955
  285   HD12  ILE  32          2HD1      ILE  32   0.612 -13.379  -3.758
  286   HD13  ILE  32          3HD1      ILE  32   2.200 -12.916  -4.410
  287    HA   PRO  33           HA       PRO  33   4.034  -9.365   0.491
  288    HB2  PRO  33          1HB       PRO  33   2.215  -7.392   0.052
  289    HB3  PRO  33          2HB       PRO  33   3.655  -7.517  -0.967
  290    HG2  PRO  33          1HG       PRO  33   0.859  -8.584  -1.480
  291    HG3  PRO  33          2HG       PRO  33   1.934  -7.714  -2.582
  292    HD2  PRO  33          1HD       PRO  33   1.709 -10.450  -2.656
  293    HD3  PRO  33          2HD       PRO  33   3.229  -9.642  -3.052
  294    H    VAL  34           H        VAL  34   3.008  -8.438   2.480
  295    HA   VAL  34           HA       VAL  34   1.161 -10.580   3.273
  296    HB   VAL  34           HB       VAL  34   2.184 -10.418   5.513
  297   HG11  VAL  34          1HG1      VAL  34   4.447 -11.255   4.974
  298   HG12  VAL  34          2HG1      VAL  34   3.230 -11.946   3.876
  299   HG13  VAL  34          3HG1      VAL  34   4.285 -10.626   3.317
  300   HG21  VAL  34          1HG2      VAL  34   4.131  -9.001   5.926
  301   HG22  VAL  34          2HG2      VAL  34   3.957  -8.291   4.303
  302   HG23  VAL  34          3HG2      VAL  34   2.684  -8.048   5.523
  303    H    LYS  35           H        LYS  35   1.960  -7.107   3.371
  304    HA   LYS  35           HA       LYS  35  -0.775  -6.579   4.143
  305    HB2  LYS  35          1HB       LYS  35   1.648  -5.881   5.796
  306    HB3  LYS  35          2HB       LYS  35   0.212  -4.829   5.802
  307    HG2  LYS  35          1HG       LYS  35  -1.116  -6.937   6.427
  308    HG3  LYS  35          2HG       LYS  35   0.461  -7.686   6.766
  309    HD2  LYS  35          1HD       LYS  35  -0.211  -6.859   8.854
  310    HD3  LYS  35          2HD       LYS  35   0.905  -5.614   8.243
  311    HE2  LYS  35          1HE       LYS  35  -0.920  -4.208   7.566
  312    HE3  LYS  35          2HE       LYS  35  -2.104  -5.490   7.908
  313    HZ1  LYS  35          1HZ       LYS  35  -2.035  -3.853   9.662
  314    HZ2  LYS  35          2HZ       LYS  35  -1.525  -5.314  10.233
  315    HZ3  LYS  35          3HZ       LYS  35  -0.428  -4.124   9.915
  316    H    ARG  36           H        ARG  36  -1.475  -4.480   3.492
  317    HA   ARG  36           HA       ARG  36   0.579  -2.923   2.159
  318    HB2  ARG  36          1HB       ARG  36  -2.226  -3.454   1.079
  319    HB3  ARG  36          2HB       ARG  36  -1.014  -2.418   0.306
  320    HG2  ARG  36          1HG       ARG  36  -0.710  -4.402  -0.864
  321    HG3  ARG  36          2HG       ARG  36   0.479  -4.618   0.431
  322    HD2  ARG  36          1HD       ARG  36  -0.718  -6.672   0.348
  323    HD3  ARG  36          2HD       ARG  36  -1.422  -5.820   1.729
  324    HE   ARG  36           HE       ARG  36  -2.886  -5.153  -0.648
  325   HH11  ARG  36          1HH1      ARG  36  -5.374  -7.555  -0.254
  326   HH12  ARG  36          2HH1      ARG  36  -4.897  -6.072  -1.055
  327   HH21  ARG  36          1HH2      ARG  36  -3.929  -8.586   1.241
  328   HH22  ARG  36          2HH2      ARG  36  -2.377  -7.881   1.558
  329    H    GLY  37           H        GLY  37  -0.433  -0.598   1.604
  330    HA2  GLY  37          1HA       GLY  37  -2.586   0.360   3.153
  331    HA3  GLY  37          2HA       GLY  37  -1.089   0.617   4.027
  332    H    CYS  38           H        CYS  38  -1.887   2.962   3.631
  333    HA   CYS  38           HA       CYS  38  -1.122   3.825   0.943
  334    HB2  CYS  38          1HB       CYS  38  -2.844   4.937   3.276
  335    HB3  CYS  38          2HB       CYS  38  -2.597   5.840   1.761
  336    HG   CYS  38           HG       CYS  38  -5.010   4.944   1.879
  337    H    ILE  39           H        ILE  39   0.391   5.614   0.761
  338    HA   ILE  39           HA       ILE  39   1.137   7.029   3.123
  339    HB   ILE  39           HB       ILE  39   2.642   4.955   3.177
  340   HG12  ILE  39          1HG1      ILE  39   4.232   7.448   2.733
  341   HG13  ILE  39          2HG1      ILE  39   3.106   7.289   4.101
  342   HG21  ILE  39          1HG2      ILE  39   4.505   4.906   1.554
  343   HG22  ILE  39          2HG2      ILE  39   2.937   4.725   0.733
  344   HG23  ILE  39          3HG2      ILE  39   3.789   6.287   0.689
  345   HD11  ILE  39          1HD1      ILE  39   5.406   6.714   4.770
  346   HD12  ILE  39          2HD1      ILE  39   4.333   5.298   4.880
  347   HD13  ILE  39          3HD1      ILE  39   5.459   5.459   3.511
  348    H    ASP  40           H        ASP  40   2.682   8.847   2.552
  349    HA   ASP  40           HA       ASP  40   1.958   9.794  -0.052
  350    HB2  ASP  40          1HB       ASP  40   3.013  11.970   0.776
  351    HB3  ASP  40          2HB       ASP  40   1.692  11.197   1.686
  352    HD2  ASP  40           HD       ASP  40   4.527  12.186   3.869
  353    H    VAL  41           H        VAL  41   4.913   9.048   1.922
  354    HA   VAL  41           HA       VAL  41   6.465   9.062  -0.574
  355    HB   VAL  41           HB       VAL  41   7.392   9.536   2.299
  356   HG11  VAL  41          1HG1      VAL  41   9.588  10.023   1.272
  357   HG12  VAL  41          2HG1      VAL  41   9.081   8.349   0.940
  358   HG13  VAL  41          3HG1      VAL  41   8.935   9.592  -0.326
  359   HG21  VAL  41          1HG2      VAL  41   7.904  11.804   1.548
  360   HG22  VAL  41          2HG2      VAL  41   7.191  11.438  -0.041
  361   HG23  VAL  41          3HG2      VAL  41   6.170  11.433   1.416
  362    H    CYS  42           H        CYS  42   7.397   7.162  -1.202
  363    HA   CYS  42           HA       CYS  42   6.501   4.844   0.120
  364    HB2  CYS  42          1HB       CYS  42   6.902   5.204  -2.383
  365    HB3  CYS  42          2HB       CYS  42   8.632   5.468  -2.057
  366    HG   CYS  42           HG       CYS  42   8.297   3.257  -3.337
  367    HA   PRO  43           HA       PRO  43   9.853   4.637   2.939
  368    HB2  PRO  43          1HB       PRO  43   9.275   2.245   4.135
  369    HB3  PRO  43          2HB       PRO  43   8.368   3.709   4.540
  370    HG2  PRO  43          1HG       PRO  43   7.671   1.521   2.556
  371    HG3  PRO  43          2HG       PRO  43   6.630   2.322   3.740
  372    HD2  PRO  43          1HD       PRO  43   6.606   3.062   1.105
  373    HD3  PRO  43          2HD       PRO  43   6.349   4.253   2.387
  374    H    LYS  44           H        LYS  44  11.955   3.954   3.003
  375    HA   LYS  44           HA       LYS  44  12.738   2.503   0.700
  376    HB2  LYS  44          1HB       LYS  44  14.198   3.335   3.221
  377    HB3  LYS  44          2HB       LYS  44  14.983   2.579   1.814
  378    HG2  LYS  44          1HG       LYS  44  14.320   4.485   0.411
  379    HG3  LYS  44          2HG       LYS  44  13.519   5.241   1.810
  380    HD2  LYS  44          1HD       LYS  44  15.659   5.388   2.986
  381    HD3  LYS  44          2HD       LYS  44  16.476   4.571   1.631
  382    HE2  LYS  44          1HE       LYS  44  15.859   6.422   0.139
  383    HE3  LYS  44          2HE       LYS  44  15.035   7.238   1.487
  384    HZ1  LYS  44          1HZ       LYS  44  17.243   8.113   1.134
  385    HZ2  LYS  44          2HZ       LYS  44  17.154   7.381   2.610
  386    HZ3  LYS  44          3HZ       LYS  44  17.918   6.624   1.359
  387    H    ASN  45           H        ASN  45  14.127   0.488   0.807
  388    HA   ASN  45           HA       ASN  45  12.477  -1.441   1.995
  389    HB2  ASN  45          1HB       ASN  45  15.118  -1.946   0.442
  390    HB3  ASN  45          2HB       ASN  45  13.910  -2.964   1.265
  391   HD21  ASN  45          1HD2      ASN  45  13.287  -2.315  -2.464
  392   HD22  ASN  45          2HD2      ASN  45  14.772  -2.552  -1.605
  393    H    SER  46           H        SER  46  12.973  -2.872   3.780
  394    HA   SER  46           HA       SER  46  15.291  -2.028   5.329
  395    HB2  SER  46          1HB       SER  46  14.112  -2.915   7.275
  396    HB3  SER  46          2HB       SER  46  13.088  -1.751   6.403
  397    HG   SER  46           HG       SER  46  12.012  -3.527   5.468
  398    H    LEU  47           H        LEU  47  15.947  -4.074   6.904
  399    HA   LEU  47           HA       LEU  47  16.969  -5.964   5.017
  400    HB2  LEU  47          1HB       LEU  47  17.039  -5.664   7.955
  401    HB3  LEU  47          2HB       LEU  47  18.039  -6.919   7.187
  402    HG   LEU  47           HG       LEU  47  18.300  -3.910   6.815
  403   HD11  LEU  47          1HD1      LEU  47  20.520  -4.234   7.939
  404   HD12  LEU  47          2HD1      LEU  47  19.179  -4.737   8.996
  405   HD13  LEU  47          3HD1      LEU  47  20.147  -5.962   8.141
  406   HD21  LEU  47          1HD2      LEU  47  20.297  -4.446   5.463
  407   HD22  LEU  47          2HD2      LEU  47  19.914  -6.178   5.615
  408   HD23  LEU  47          3HD2      LEU  47  18.796  -5.091   4.757
  409    H    LEU  48           H        LEU  48  14.190  -5.720   7.122
  410    HA   LEU  48           HA       LEU  48  13.955  -8.627   7.263
  411    HB2  LEU  48          1HB       LEU  48  12.549  -6.342   8.504
  412    HB3  LEU  48          2HB       LEU  48  12.065  -8.002   8.924
  413    HG   LEU  48           HG       LEU  48  14.737  -6.667   9.510
  414   HD11  LEU  48          1HD1      LEU  48  14.057  -6.998  11.903
  415   HD12  LEU  48          2HD1      LEU  48  12.883  -5.984  11.031
  416   HD13  LEU  48          3HD1      LEU  48  12.516  -7.696  11.351
  417   HD21  LEU  48          1HD2      LEU  48  15.326  -8.763  10.677
  418   HD22  LEU  48          2HD2      LEU  48  13.809  -9.494  10.097
  419   HD23  LEU  48          3HD2      LEU  48  15.063  -8.999   8.933
  420    H    VAL  49           H        VAL  49  12.164  -5.653   6.245
  421    HA   VAL  49           HA       VAL  49  10.435  -7.422   4.661
  422    HB   VAL  49           HB       VAL  49   8.606  -5.730   5.069
  423   HG11  VAL  49          1HG1      VAL  49   8.082  -6.479   7.366
  424   HG12  VAL  49          2HG1      VAL  49   8.702  -7.824   6.379
  425   HG13  VAL  49          3HG1      VAL  49   9.761  -7.031   7.570
  426   HG21  VAL  49          1HG2      VAL  49   8.827  -4.168   6.934
  427   HG22  VAL  49          2HG2      VAL  49  10.534  -4.637   7.123
  428   HG23  VAL  49          3HG2      VAL  49   9.992  -3.825   5.634
  429    H    LYS  50           H        LYS  50   9.784  -6.609   2.606
  430    HA   LYS  50           HA       LYS  50  11.469  -4.383   1.714
  431    HB2  LYS  50          1HB       LYS  50  11.812  -6.518   0.575
  432    HB3  LYS  50          2HB       LYS  50  10.074  -6.615   0.208
  433    HG2  LYS  50          1HG       LYS  50  10.267  -4.603  -1.209
  434    HG3  LYS  50          2HG       LYS  50  12.009  -4.529  -0.854
  435    HD2  LYS  50          1HD       LYS  50  12.318  -6.741  -1.886
  436    HD3  LYS  50          2HD       LYS  50  10.575  -6.822  -2.235
  437    HE2  LYS  50          1HE       LYS  50  10.781  -4.793  -3.633
  438    HE3  LYS  50          2HE       LYS  50  12.531  -4.772  -3.319
  439    HZ1  LYS  50          1HZ       LYS  50  12.017  -5.808  -5.424
  440    HZ2  LYS  50          2HZ       LYS  50  12.684  -6.914  -4.396
  441    HZ3  LYS  50          3HZ       LYS  50  11.060  -6.933  -4.688
  442    H    TYR  51           H        TYR  51  10.561  -2.661   0.492
  443    HA   TYR  51           HA       TYR  51   7.639  -2.481   0.804
  444    HB2  TYR  51          1HB       TYR  51   9.780  -0.358   0.965
  445    HB3  TYR  51          2HB       TYR  51   8.028  -0.040   0.943
  446    HD1  TYR  51          1HD       TYR  51  10.857  -1.213   2.956
  447    HD2  TYR  51          2HD       TYR  51   6.628  -0.672   2.872
  448    HE1  TYR  51          1HE       TYR  51  10.778  -1.508   5.414
  449    HE2  TYR  51          2HE       TYR  51   6.531  -0.965   5.324
  450    HH   TYR  51           HH       TYR  51   7.714  -1.348   7.233
  451    H    VAL  52           H        VAL  52   6.497  -2.325  -1.064
  452    HA   VAL  52           HA       VAL  52   7.847  -0.986  -3.304
  453    HB   VAL  52           HB       VAL  52   5.843  -3.289  -3.452
  454   HG11  VAL  52          1HG1      VAL  52   6.275  -3.191  -5.885
  455   HG12  VAL  52          2HG1      VAL  52   5.591  -1.658  -5.294
  456   HG13  VAL  52          3HG1      VAL  52   7.333  -1.781  -5.640
  457   HG21  VAL  52          1HG2      VAL  52   7.683  -4.581  -4.410
  458   HG22  VAL  52          2HG2      VAL  52   8.791  -3.220  -4.113
  459   HG23  VAL  52          3HG2      VAL  52   8.028  -4.062  -2.744
  460    H    CYS  53           H        CYS  53   6.762   0.748  -4.141
  461    HA   CYS  53           HA       CYS  53   4.028   1.114  -3.145
  462    HB2  CYS  53          1HB       CYS  53   5.924   3.343  -3.848
  463    HB3  CYS  53          2HB       CYS  53   4.381   3.449  -3.000
  464    HG   CYS  53           HG       CYS  53   6.345   4.030  -1.346
  465    H    CYS  54           H        CYS  54   2.636   2.436  -4.689
  466    HA   CYS  54           HA       CYS  54   3.679   2.839  -7.321
  467    HB2  CYS  54          1HB       CYS  54   1.722   1.544  -8.345
  468    HB3  CYS  54          2HB       CYS  54   3.151   0.648  -7.822
  469    HG   CYS  54           HG       CYS  54   0.991  -0.787  -7.370
  470    H    ASN  55           H        ASN  55   2.069   4.174  -8.616
  471    HA   ASN  55           HA       ASN  55   0.917   5.864  -6.554
  472    HB2  ASN  55          1HB       ASN  55   1.649   7.838  -7.989
  473    HB3  ASN  55          2HB       ASN  55   2.758   6.503  -7.594
  474   HD21  ASN  55          1HD2      ASN  55   3.115   7.581 -11.161
  475   HD22  ASN  55          2HD2      ASN  55   3.104   8.425  -9.647
  476    H    THR  56           H        THR  56  -0.532   3.622  -7.883
  477    HA   THR  56           HA       THR  56  -2.699   5.234  -9.026
  478    HB   THR  56           HB       THR  56  -3.182   3.337 -10.599
  479    HG1  THR  56          1HG       THR  56  -1.470   1.788 -10.892
  480   HG21  THR  56          1HG2      THR  56  -1.356   3.794 -12.199
  481   HG22  THR  56          2HG2      THR  56  -1.900   5.291 -11.403
  482   HG23  THR  56          3HG2      THR  56  -0.387   4.509 -10.889
  483    H    ASP  57           H        ASP  57  -4.780   3.756  -9.151
  484    HA   ASP  57           HA       ASP  57  -5.186   3.314  -6.390
  485    HB2  ASP  57          1HB       ASP  57  -7.095   3.160  -8.787
  486    HB3  ASP  57          2HB       ASP  57  -7.434   2.768  -7.083
  487    HD2  ASP  57           HD       ASP  57  -7.475   6.498  -8.142
  488    H    ARG  58           H        ARG  58  -5.371   1.291  -5.328
  489    HA   ARG  58           HA       ARG  58  -5.466  -0.842  -4.995
  490    HB2  ARG  58          1HB       ARG  58  -7.041  -0.897  -7.539
  491    HB3  ARG  58          2HB       ARG  58  -6.923  -2.225  -6.362
  492    HG2  ARG  58          1HG       ARG  58  -8.261  -1.172  -4.823
  493    HG3  ARG  58          2HG       ARG  58  -7.803   0.456  -5.379
  494    HD2  ARG  58          1HD       ARG  58  -9.489  -1.366  -7.038
  495    HD3  ARG  58          2HD       ARG  58 -10.178  -0.340  -5.759
  496    HE   ARG  58           HE       ARG  58  -8.804   1.466  -7.476
  497   HH11  ARG  58          1HH1      ARG  58 -11.310  -0.914  -7.935
  498   HH12  ARG  58          2HH1      ARG  58 -11.989   0.042  -9.238
  499   HH21  ARG  58          1HH2      ARG  58  -9.564   2.569  -8.970
  500   HH22  ARG  58          2HH2      ARG  58 -10.993   2.029  -9.830
  501    H    CYS  59           H        CYS  59  -3.129   0.198  -6.469
  502    HA   CYS  59           HA       CYS  59  -2.601  -1.688  -8.567
  503    HB2  CYS  59          1HB       CYS  59  -0.506  -0.180  -8.637
  504    HB3  CYS  59          2HB       CYS  59  -1.972   0.818  -8.484
  505    HG   CYS  59           HG       CYS  59  -0.035   1.875  -7.155
  506    H    ASN  60           H        ASN  60  -1.943  -1.178  -5.114
  507    HA   ASN  60           HA       ASN  60  -0.151  -3.447  -5.132
  508    HB2  ASN  60          1HB       ASN  60   0.214  -2.907  -2.752
  509    HB3  ASN  60          2HB       ASN  60   0.409  -1.441  -3.722
  510   HD21  ASN  60          1HD2      ASN  60   0.053  -0.847  -1.282
  511   HD22  ASN  60          2HD2      ASN  60  -1.561  -0.374  -0.866
  Start of MODEL    4
    1    H1   MET   0          1H        MET   0  -6.428  10.807   0.107
    2    H2   MET   0          2H        MET   0  -7.915  10.948   0.231
    3    H    MET   0           H        MET   0  -7.297   9.562   0.131
    4    H3   MET   0          3H        MET   0  -7.295   9.585   0.153
    5    HA   MET   0           HA       MET   0  -8.256  11.082  -1.993
    6    HB2  MET   0          1HB       MET   0  -5.271  10.619  -2.019
    7    HB3  MET   0          2HB       MET   0  -6.212  11.015  -3.476
    8    HG2  MET   0          1HG       MET   0  -6.872  13.151  -2.499
    9    HG3  MET   0          2HG       MET   0  -6.000  12.753  -1.000
   10    HE1  MET   0          1HE       MET   0  -4.029  13.720  -5.078
   11    HE2  MET   0          2HE       MET   0  -5.036  12.273  -4.825
   12    HE3  MET   0          3HE       MET   0  -5.763  13.895  -4.719
   13    H    LEU   1           H        LEU   1  -5.522   8.824  -2.554
   14    HA   LEU   1           HA       LEU   1  -7.187   7.470  -4.390
   15    HB2  LEU   1          1HB       LEU   1  -4.479   7.421  -3.373
   16    HB3  LEU   1          2HB       LEU   1  -4.910   5.898  -4.184
   17    HG   LEU   1           HG       LEU   1  -5.712   7.612  -6.084
   18   HD11  LEU   1          1HD1      LEU   1  -4.043   9.476  -6.277
   19   HD12  LEU   1          2HD1      LEU   1  -5.012   9.626  -4.791
   20   HD13  LEU   1          3HD1      LEU   1  -3.350   8.996  -4.711
   21   HD21  LEU   1          1HD2      LEU   1  -3.553   7.217  -7.219
   22   HD22  LEU   1          2HD2      LEU   1  -2.854   6.689  -5.669
   23   HD23  LEU   1          3HD2      LEU   1  -4.180   5.761  -6.410
   24    H    LYS   2           H        LYS   2  -6.831   4.830  -4.325
   25    HA   LYS   2           HA       LYS   2  -7.693   4.028  -1.632
   26    HB2  LYS   2          1HB       LYS   2  -8.492   2.739  -4.250
   27    HB3  LYS   2          2HB       LYS   2  -9.155   2.424  -2.629
   28    HG2  LYS   2          1HG       LYS   2  -9.460   5.022  -4.175
   29    HG3  LYS   2          2HG       LYS   2 -10.696   3.746  -4.065
   30    HD2  LYS   2          1HD       LYS   2 -10.724   4.016  -1.601
   31    HD3  LYS   2          2HD       LYS   2  -9.537   5.335  -1.750
   32    HE2  LYS   2          1HE       LYS   2 -12.275   5.317  -3.052
   33    HE3  LYS   2          2HE       LYS   2 -11.899   6.118  -1.509
   34    HZ1  LYS   2          1HZ       LYS   2 -11.811   7.654  -3.354
   35    HZ2  LYS   2          2HZ       LYS   2 -10.312   7.488  -2.684
   36    HZ3  LYS   2          3HZ       LYS   2 -10.663   6.745  -4.114
   37    H    CYS   3           H        CYS   3  -6.731   2.206  -0.745
   38    HA   CYS   3           HA       CYS   3  -4.684   0.971  -2.440
   39    HB2  CYS   3          1HB       CYS   3  -4.561   1.575   0.516
   40    HB3  CYS   3          2HB       CYS   3  -3.368   0.617  -0.366
   41    HG   CYS   3           HG       CYS   3  -2.363   2.982   0.199
   42    H    ASN   4           H        ASN   4  -4.328  -1.355  -2.004
   43    HA   ASN   4           HA       ASN   4  -6.846  -2.572  -1.552
   44    HB2  ASN   4          1HB       ASN   4  -4.180  -3.954  -2.351
   45    HB3  ASN   4          2HB       ASN   4  -5.814  -4.519  -1.923
   46   HD21  ASN   4          1HD2      ASN   4  -5.140  -3.754  -5.653
   47   HD22  ASN   4          2HD2      ASN   4  -4.046  -4.342  -4.446
   48    H    LYS   5           H        LYS   5  -7.165  -4.392   0.043
   49    HA   LYS   5           HA       LYS   5  -5.166  -4.476   2.174
   50    HB2  LYS   5          1HB       LYS   5  -8.165  -4.183   2.521
   51    HB3  LYS   5          2HB       LYS   5  -7.011  -4.531   3.829
   52    HG2  LYS   5          1HG       LYS   5  -6.922  -2.028   2.115
   53    HG3  LYS   5          2HG       LYS   5  -7.767  -2.125   3.678
   54    HD2  LYS   5          1HD       LYS   5  -5.699  -2.644   4.826
   55    HD3  LYS   5          2HD       LYS   5  -4.823  -2.744   3.282
   56    HE2  LYS   5          1HE       LYS   5  -4.967  -0.428   2.910
   57    HE3  LYS   5          2HE       LYS   5  -6.265  -0.229   4.111
   58    HZ1  LYS   5          1HZ       LYS   5  -4.157   0.568   4.940
   59    HZ2  LYS   5          2HZ       LYS   5  -4.662  -0.725   5.830
   60    HZ3  LYS   5          3HZ       LYS   5  -3.459  -0.910   4.716
   61    H    LEU   6           H        LEU   6  -8.464  -5.901   2.003
   62    HA   LEU   6           HA       LEU   6  -7.227  -8.520   2.153
   63    HB2  LEU   6          1HB       LEU   6  -8.906  -7.956   3.635
   64    HB3  LEU   6          2HB       LEU   6 -10.134  -7.550   2.415
   65    HG   LEU   6           HG       LEU   6  -9.949  -9.966   1.623
   66   HD11  LEU   6          1HD1      LEU   6  -9.087 -11.599   3.322
   67   HD12  LEU   6          2HD1      LEU   6  -7.802 -10.497   2.776
   68   HD13  LEU   6          3HD1      LEU   6  -8.586 -10.239   4.353
   69   HD21  LEU   6          1HD2      LEU   6 -11.455 -10.814   3.388
   70   HD22  LEU   6          2HD2      LEU   6 -11.000  -9.433   4.415
   71   HD23  LEU   6          3HD2      LEU   6 -11.857  -9.156   2.880
   72    H    VAL   7           H        VAL   7  -7.175  -9.997   0.505
   73    HA   VAL   7           HA       VAL   7  -7.686  -9.174  -2.112
   74    HB   VAL   7           HB       VAL   7  -7.419 -11.598  -2.678
   75   HG11  VAL   7          1HG1      VAL   7  -5.133 -11.866  -1.776
   76   HG12  VAL   7          2HG1      VAL   7  -5.414 -10.196  -2.322
   77   HG13  VAL   7          3HG1      VAL   7  -5.452 -10.583  -0.585
   78   HG21  VAL   7          1HG2      VAL   7  -6.997 -13.225  -0.903
   79   HG22  VAL   7          2HG2      VAL   7  -7.383 -11.990   0.319
   80   HG23  VAL   7          3HG2      VAL   7  -8.640 -12.548  -0.812
   81    HA   PRO   8           HA       PRO   8  -8.096 -10.294  -3.776
   82    HB2  PRO   8          1HB       PRO   8  -9.382 -10.021  -6.132
   83    HB3  PRO   8          2HB       PRO   8  -9.399 -11.590  -5.315
   84    HG2  PRO   8          1HG       PRO   8 -11.503  -9.408  -5.300
   85    HG3  PRO   8          2HG       PRO   8 -11.714 -11.158  -5.445
   86    HD2  PRO   8          1HD       PRO   8 -12.026  -9.781  -3.044
   87    HD3  PRO   8          2HD       PRO   8 -11.582 -11.491  -3.122
   88    H    ILE   9           H        ILE   9 -10.718  -7.969  -3.690
   89    HA   ILE   9           HA       ILE   9  -8.858  -6.061  -4.930
   90    HB   ILE   9           HB       ILE   9 -11.902  -6.251  -5.168
   91   HG12  ILE   9          1HG1      ILE   9 -10.818  -7.966  -6.422
   92   HG13  ILE   9          2HG1      ILE   9 -11.514  -6.733  -7.498
   93   HG21  ILE   9          1HG2      ILE   9 -11.668  -4.395  -6.784
   94   HG22  ILE   9          2HG2      ILE   9 -11.095  -3.915  -5.170
   95   HG23  ILE   9          3HG2      ILE   9  -9.922  -4.320  -6.446
   96   HD11  ILE   9          1HD1      ILE   9  -9.304  -7.470  -8.301
   97   HD12  ILE   9          2HD1      ILE   9  -9.276  -5.756  -7.826
   98   HD13  ILE   9          3HD1      ILE   9  -8.580  -6.989  -6.750
   99    H    ALA  10           H        ALA  10 -10.854  -6.891  -2.207
  100    HA   ALA  10           HA       ALA  10 -12.063  -4.620  -1.455
  101    HB1  ALA  10          1HB       ALA  10 -10.687  -5.854   0.815
  102    HB2  ALA  10          2HB       ALA  10 -12.423  -5.820   0.420
  103    HB3  ALA  10          3HB       ALA  10 -11.371  -7.069  -0.289
  104    H    TYR  11           H        TYR  11 -11.542  -2.609  -0.604
  105    HA   TYR  11           HA       TYR  11  -8.692  -2.056  -0.243
  106    HB2  TYR  11          1HB       TYR  11  -8.853  -0.127  -1.719
  107    HB3  TYR  11          2HB       TYR  11  -9.118  -1.665  -2.577
  108    HD1  TYR  11          1HD       TYR  11 -10.672   1.475  -1.452
  109    HD2  TYR  11          2HD       TYR  11 -11.318  -2.217  -3.485
  110    HE1  TYR  11          1HE       TYR  11 -12.816   2.347  -2.336
  111    HE2  TYR  11          2HE       TYR  11 -13.460  -1.363  -4.377
  112    HH   TYR  11           HH       TYR  11 -14.922   0.383  -4.440
  113    H    LYS  12           H        LYS  12  -8.316   0.150   0.702
  114    HA   LYS  12           HA       LYS  12 -10.715   1.158   2.061
  115    HB2  LYS  12          1HB       LYS  12  -7.915   0.690   3.096
  116    HB3  LYS  12          2HB       LYS  12  -9.018   1.858   3.861
  117    HG2  LYS  12          1HG       LYS  12 -10.646   0.025   4.250
  118    HG3  LYS  12          2HG       LYS  12  -9.483  -1.128   3.552
  119    HD2  LYS  12          1HD       LYS  12  -7.868  -0.601   5.310
  120    HD3  LYS  12          2HD       LYS  12  -8.976   0.615   5.987
  121    HE2  LYS  12          1HE       LYS  12 -10.644  -1.172   6.395
  122    HE3  LYS  12          2HE       LYS  12  -9.476  -2.370   5.792
  123    HZ1  LYS  12          1HZ       LYS  12  -9.459  -2.241   8.189
  124    HZ2  LYS  12          2HZ       LYS  12  -8.006  -1.745   7.585
  125    HZ3  LYS  12          3HZ       LYS  12  -9.089  -0.634   8.145
  126    H    THR  13           H        THR  13 -10.557   3.502   2.635
  127    HA   THR  13           HA       THR  13  -9.453   4.857   0.324
  128    HB   THR  13           HB       THR  13 -11.143   5.861   2.667
  129    HG1  THR  13          1HG       THR  13 -12.823   5.777   1.058
  130   HG21  THR  13          1HG2      THR  13 -11.572   7.815   1.217
  131   HG22  THR  13          2HG2      THR  13  -9.837   7.654   1.577
  132   HG23  THR  13          3HG2      THR  13 -10.467   7.149  -0.008
  133    H    CYS  14           H        CYS  14  -7.615   5.989   0.248
  134    HA   CYS  14           HA       CYS  14  -5.934   6.005   2.506
  135    HB2  CYS  14          1HB       CYS  14  -5.738   7.406  -0.160
  136    HB3  CYS  14          2HB       CYS  14  -4.460   7.420   1.062
  137    HG   CYS  14           HG       CYS  14  -3.789   5.805  -0.906
  138    HA   PRO  15           HA       PRO  15  -7.204   9.857   4.191
  139    HB2  PRO  15          1HB       PRO  15  -5.158  10.478   5.843
  140    HB3  PRO  15          2HB       PRO  15  -6.219   9.120   6.238
  141    HG2  PRO  15          1HG       PRO  15  -3.524   9.088   4.840
  142    HG3  PRO  15          2HG       PRO  15  -4.112   8.041   6.138
  143    HD2  PRO  15          1HD       PRO  15  -4.161   7.262   3.491
  144    HD3  PRO  15          2HD       PRO  15  -5.358   6.685   4.657
  145    H    GLU  16           H        GLU  16  -6.986  12.137   4.056
  146    HA   GLU  16           HA       GLU  16  -5.750  12.984   1.756
  147    HB2  GLU  16          1HB       GLU  16  -7.503  14.208   2.937
  148    HB3  GLU  16          2HB       GLU  16  -6.398  14.502   4.303
  149    HG2  GLU  16          1HG       GLU  16  -4.961  15.941   2.777
  150    HG3  GLU  16          2HG       GLU  16  -6.116  15.501   1.499
  151    HE2  GLU  16           HE       GLU  16  -7.140  18.658   2.918
  152    H    GLY  17           H        GLY  17  -3.709  13.825   1.245
  153    HA2  GLY  17          1HA       GLY  17  -1.628  14.745   1.807
  154    HA3  GLY  17          2HA       GLY  17  -1.767  14.099   3.431
  155    H    LYS  18           H        LYS  18  -2.838  11.445   2.197
  156    HA   LYS  18           HA       LYS  18  -0.240  10.438   1.305
  157    HB2  LYS  18          1HB       LYS  18  -2.757   9.091   2.320
  158    HB3  LYS  18          2HB       LYS  18  -1.360   8.208   1.662
  159    HG2  LYS  18          1HG       LYS  18   0.036   9.349   3.465
  160    HG3  LYS  18          2HG       LYS  18  -1.503   9.866   4.194
  161    HD2  LYS  18          1HD       LYS  18  -2.185   7.625   4.592
  162    HD3  LYS  18          2HD       LYS  18  -0.907   6.971   3.541
  163    HE2  LYS  18          1HE       LYS  18   0.788   7.881   5.136
  164    HE3  LYS  18          2HE       LYS  18  -0.545   8.360   6.214
  165    HZ1  LYS  18          1HZ       LYS  18   0.391   6.240   6.844
  166    HZ2  LYS  18          2HZ       LYS  18  -1.174   6.045   6.358
  167    HZ3  LYS  18          3HZ       LYS  18   0.062   5.602   5.359
  168    H    ASN  19           H        ASN  19  -0.158   9.013  -0.590
  169    HA   ASN  19           HA       ASN  19  -2.307   9.645  -2.440
  170    HB2  ASN  19          1HB       ASN  19  -0.335  11.391  -2.783
  171    HB3  ASN  19          2HB       ASN  19   0.492   9.823  -2.951
  172   HD21  ASN  19          1HD2      ASN  19  -1.497  11.517  -6.040
  173   HD22  ASN  19          2HD2      ASN  19  -1.441  12.225  -4.460
  174    H    LEU  20           H        LEU  20   0.768   7.848  -1.710
  175    HA   LEU  20           HA       LEU  20   0.331   6.173  -4.034
  176    HB2  LEU  20          1HB       LEU  20   2.438   6.195  -1.962
  177    HB3  LEU  20          2HB       LEU  20   2.662   5.376  -3.526
  178    HG   LEU  20           HG       LEU  20   2.490   8.371  -3.017
  179   HD11  LEU  20          1HD1      LEU  20   4.818   8.367  -3.951
  180   HD12  LEU  20          2HD1      LEU  20   4.700   7.339  -2.504
  181   HD13  LEU  20          3HD1      LEU  20   4.730   6.599  -4.122
  182   HD21  LEU  20          1HD2      LEU  20   2.839   8.638  -5.448
  183   HD22  LEU  20          2HD2      LEU  20   2.707   6.873  -5.644
  184   HD23  LEU  20          3HD2      LEU  20   1.312   7.812  -5.061
  185    H    CYS  21           H        CYS  21   0.433   3.802  -3.892
  186    HA   CYS  21           HA       CYS  21  -0.547   2.876  -1.290
  187    HB2  CYS  21          1HB       CYS  21  -1.169   1.907  -4.075
  188    HB3  CYS  21          2HB       CYS  21  -1.570   0.990  -2.619
  189    HG   CYS  21           HG       CYS  21  -3.746   2.103  -3.596
  190    H    TYR  22           H        TYR  22   0.661   1.261  -0.284
  191    HA   TYR  22           HA       TYR  22   2.910   0.192  -1.855
  192    HB2  TYR  22          1HB       TYR  22   4.312   0.387   0.011
  193    HB3  TYR  22          2HB       TYR  22   3.491   1.955  -0.187
  194    HD1  TYR  22          1HD       TYR  22   3.734  -1.084   1.901
  195    HD2  TYR  22          2HD       TYR  22   1.935   2.759   1.484
  196    HE1  TYR  22          1HE       TYR  22   2.957  -1.201   4.251
  197    HE2  TYR  22          2HE       TYR  22   1.152   2.660   3.826
  198    HH   TYR  22           HH       TYR  22   1.088   1.441   5.750
  199    H    LYS  23           H        LYS  23   3.691  -1.950  -1.195
  200    HA   LYS  23           HA       LYS  23   1.938  -3.317   0.710
  201    HB2  LYS  23          1HB       LYS  23   2.104  -5.350  -0.630
  202    HB3  LYS  23          2HB       LYS  23   1.300  -4.042  -1.529
  203    HG2  LYS  23          1HG       LYS  23   3.368  -3.613  -2.779
  204    HG3  LYS  23          2HG       LYS  23   4.194  -4.898  -1.867
  205    HD2  LYS  23          1HD       LYS  23   3.378  -5.563  -4.167
  206    HD3  LYS  23          2HD       LYS  23   2.818  -6.593  -2.829
  207    HE2  LYS  23          1HE       LYS  23   0.676  -5.428  -2.791
  208    HE3  LYS  23          2HE       LYS  23   1.232  -4.324  -4.069
  209    HZ1  LYS  23          1HZ       LYS  23  -0.138  -6.087  -4.953
  210    HZ2  LYS  23          2HZ       LYS  23   1.398  -6.214  -5.542
  211    HZ3  LYS  23          3HZ       LYS  23   0.882  -7.239  -4.357
  212    H    MET  24           H        MET  24   2.999  -4.973   1.963
  213    HA   MET  24           HA       MET  24   5.880  -4.517   1.982
  214    HB2  MET  24          1HB       MET  24   3.902  -5.198   4.162
  215    HB3  MET  24          2HB       MET  24   5.665  -5.273   4.393
  216    HG2  MET  24          1HG       MET  24   5.862  -2.893   3.947
  217    HG3  MET  24          2HG       MET  24   4.123  -2.789   3.586
  218    HE1  MET  24          1HE       MET  24   5.824  -3.716   7.799
  219    HE2  MET  24          2HE       MET  24   5.855  -4.881   6.454
  220    HE3  MET  24          3HE       MET  24   6.839  -3.399   6.373
  221    H    PHE  25           H        PHE  25   7.296  -6.277   1.918
  222    HA   PHE  25           HA       PHE  25   6.025  -8.923   2.029
  223    HB2  PHE  25          1HB       PHE  25   8.557  -7.854   0.657
  224    HB3  PHE  25          2HB       PHE  25   8.087  -9.558   0.637
  225    HD1  PHE  25          1HD       PHE  25   7.308  -6.207  -0.613
  226    HD2  PHE  25          2HD       PHE  25   6.299 -10.320  -0.791
  227    HE1  PHE  25          1HE       PHE  25   5.940  -5.783  -2.687
  228    HE2  PHE  25          2HE       PHE  25   4.935  -9.901  -2.858
  229    HZ   PHE  25           HZ       PHE  25   4.773  -7.640  -3.780
  230    H    MET  26           H        MET  26   7.521 -10.696   2.890
  231    HA   MET  26           HA       MET  26   9.598  -9.550   4.592
  232    HB2  MET  26          1HB       MET  26   8.042 -12.134   4.834
  233    HB3  MET  26          2HB       MET  26   9.428 -11.699   5.862
  234    HG2  MET  26          1HG       MET  26   8.194  -9.747   6.699
  235    HG3  MET  26          2HG       MET  26   6.808 -10.179   5.669
  236    HE1  MET  26          1HE       MET  26   5.507 -10.986   9.307
  237    HE2  MET  26          2HE       MET  26   6.591  -9.655   8.830
  238    HE3  MET  26          3HE       MET  26   5.201 -10.084   7.803
  239    H    MET  27           H        MET  27  11.711 -10.515   4.539
  240    HA   MET  27           HA       MET  27  12.556 -10.964   2.026
  241    HB2  MET  27          1HB       MET  27  13.674 -11.716   4.716
  242    HB3  MET  27          2HB       MET  27  14.575 -12.064   3.221
  243    HG2  MET  27          1HG       MET  27  13.673  -9.327   4.173
  244    HG3  MET  27          2HG       MET  27  15.329  -9.971   4.267
  245    HE1  MET  27          1HE       MET  27  16.440 -10.136   0.546
  246    HE2  MET  27          2HE       MET  27  16.944 -10.245   2.251
  247    HE3  MET  27          3HE       MET  27  15.811 -11.443   1.578
  248    H    SER  28           H        SER  28  11.361 -13.360   4.394
  249    HA   SER  28           HA       SER  28  12.082 -15.619   2.942
  250    HB2  SER  28          1HB       SER  28  11.360 -15.694   5.265
  251    HB3  SER  28          2HB       SER  28   9.748 -15.095   4.810
  252    HG   SER  28           HG       SER  28   9.805 -17.367   5.092
  253    H    ASP  29           H        ASP  29   8.808 -14.035   3.231
  254    HA   ASP  29           HA       ASP  29   8.046 -15.445   0.841
  255    HB2  ASP  29          1HB       ASP  29   6.538 -15.415   2.915
  256    HB3  ASP  29          2HB       ASP  29   6.516 -13.659   2.616
  257    HD2  ASP  29           HD       ASP  29   3.570 -15.113   1.079
  258    H    LEU  30           H        LEU  30   9.449 -14.076  -0.608
  259    HA   LEU  30           HA       LEU  30   8.752 -11.311  -0.899
  260    HB2  LEU  30          1HB       LEU  30  10.448 -13.332  -2.090
  261    HB3  LEU  30          2HB       LEU  30  10.105 -12.004  -3.222
  262    HG   LEU  30           HG       LEU  30  11.508 -10.579  -2.166
  263   HD11  LEU  30          1HD1      LEU  30  11.696 -10.411   0.330
  264   HD12  LEU  30          2HD1      LEU  30   9.996 -10.400  -0.192
  265   HD13  LEU  30          3HD1      LEU  30  10.709 -11.882   0.489
  266   HD21  LEU  30          1HD2      LEU  30  13.397 -11.662  -1.000
  267   HD22  LEU  30          2HD2      LEU  30  12.440 -13.158  -0.874
  268   HD23  LEU  30          3HD2      LEU  30  12.909 -12.534  -2.474
  269    H    THR  31           H        THR  31   7.385 -14.348  -1.829
  270    HA   THR  31           HA       THR  31   6.538 -13.585  -4.442
  271    HB   THR  31           HB       THR  31   5.589 -15.817  -2.578
  272    HG1  THR  31          1HG       THR  31   7.016 -17.082  -3.911
  273   HG21  THR  31          1HG2      THR  31   4.743 -16.874  -4.644
  274   HG22  THR  31          2HG2      THR  31   3.961 -15.299  -4.364
  275   HG23  THR  31          3HG2      THR  31   5.250 -15.448  -5.581
  276    H    ILE  32           H        ILE  32   5.008 -13.649  -1.184
  277    HA   ILE  32           HA       ILE  32   2.744 -12.233  -2.404
  278    HB   ILE  32           HB       ILE  32   2.711 -14.447  -0.299
  279   HG12  ILE  32          1HG1      ILE  32   2.817 -15.195  -2.591
  280   HG13  ILE  32          2HG1      ILE  32   1.277 -15.608  -1.805
  281   HG21  ILE  32          1HG2      ILE  32   0.277 -14.042  -0.147
  282   HG22  ILE  32          2HG2      ILE  32   1.197 -12.611   0.370
  283   HG23  ILE  32          3HG2      ILE  32   0.441 -12.647  -1.239
  284   HD11  ILE  32          1HD1      ILE  32   0.919 -14.869  -4.128
  285   HD12  ILE  32          2HD1      ILE  32   0.178 -13.736  -2.972
  286   HD13  ILE  32          3HD1      ILE  32   1.719 -13.325  -3.759
  287    HA   PRO  33           HA       PRO  33   3.826  -9.371   0.702
  288    HB2  PRO  33          1HB       PRO  33   1.983  -7.441   0.185
  289    HB3  PRO  33          2HB       PRO  33   3.374  -7.654  -0.885
  290    HG2  PRO  33          1HG       PRO  33   0.559  -8.752  -1.176
  291    HG3  PRO  33          2HG       PRO  33   1.584  -7.987  -2.398
  292    HD2  PRO  33          1HD       PRO  33   1.352 -10.719  -2.220
  293    HD3  PRO  33          2HD       PRO  33   2.855  -9.956  -2.755
  294    H    VAL  34           H        VAL  34   2.929  -8.297   2.665
  295    HA   VAL  34           HA       VAL  34   1.051 -10.307   3.704
  296    HB   VAL  34           HB       VAL  34   2.291 -10.126   5.855
  297   HG11  VAL  34          1HG1      VAL  34   4.366 -11.273   5.152
  298   HG12  VAL  34          2HG1      VAL  34   2.963 -11.869   4.235
  299   HG13  VAL  34          3HG1      VAL  34   4.100 -10.727   3.480
  300   HG21  VAL  34          1HG2      VAL  34   4.427  -8.944   5.967
  301   HG22  VAL  34          2HG2      VAL  34   4.163  -8.316   4.323
  302   HG23  VAL  34          3HG2      VAL  34   3.069  -7.842   5.644
  303    H    LYS  35           H        LYS  35   1.947  -6.933   3.346
  304    HA   LYS  35           HA       LYS  35  -0.553  -6.227   4.646
  305    HB2  LYS  35          1HB       LYS  35   2.184  -5.191   5.396
  306    HB3  LYS  35          2HB       LYS  35   0.701  -4.256   5.696
  307    HG2  LYS  35          1HG       LYS  35  -0.126  -6.352   6.959
  308    HG3  LYS  35          2HG       LYS  35   1.576  -6.872   6.932
  309    HD2  LYS  35          1HD       LYS  35   1.360  -5.757   8.989
  310    HD3  LYS  35          2HD       LYS  35   2.105  -4.550   7.915
  311    HE2  LYS  35          1HE       LYS  35  -0.010  -3.457   7.565
  312    HE3  LYS  35          2HE       LYS  35  -0.874  -4.744   8.437
  313    HZ1  LYS  35          1HZ       LYS  35  -0.552  -2.802   9.811
  314    HZ2  LYS  35          2HZ       LYS  35   0.285  -4.081  10.433
  315    HZ3  LYS  35          3HZ       LYS  35   1.086  -2.886   9.625
  316    H    ARG  36           H        ARG  36  -1.540  -4.404   3.716
  317    HA   ARG  36           HA       ARG  36   0.138  -2.882   1.917
  318    HB2  ARG  36          1HB       ARG  36  -2.583  -3.858   1.146
  319    HB3  ARG  36          2HB       ARG  36  -1.539  -2.759   0.215
  320    HG2  ARG  36          1HG       ARG  36  -1.083  -4.740  -0.851
  321    HG3  ARG  36          2HG       ARG  36   0.178  -4.756   0.406
  322    HD2  ARG  36          1HD       ARG  36  -0.779  -6.907   0.248
  323    HD3  ARG  36          2HD       ARG  36  -1.295  -6.163   1.781
  324    HE   ARG  36           HE       ARG  36  -3.604  -6.324   0.940
  325   HH11  ARG  36          1HH1      ARG  36  -1.379  -6.811  -1.701
  326   HH12  ARG  36          2HH1      ARG  36  -2.701  -7.336  -2.725
  327   HH21  ARG  36          1HH2      ARG  36  -5.129  -6.913  -0.223
  328   HH22  ARG  36          2HH2      ARG  36  -4.840  -7.393  -1.884
  329    H    GLY  37           H        GLY  37  -0.700  -0.648   1.546
  330    HA2  GLY  37          1HA       GLY  37  -2.960   0.364   2.901
  331    HA3  GLY  37          2HA       GLY  37  -1.550   0.534   3.925
  332    H    CYS  38           H        CYS  38  -2.135   2.921   3.553
  333    HA   CYS  38           HA       CYS  38  -1.282   3.816   0.907
  334    HB2  CYS  38          1HB       CYS  38  -2.860   5.039   3.291
  335    HB3  CYS  38          2HB       CYS  38  -2.651   5.867   1.729
  336    HG   CYS  38           HG       CYS  38  -5.096   5.108   2.009
  337    H    ILE  39           H        ILE  39   0.306   5.577   0.787
  338    HA   ILE  39           HA       ILE  39   1.104   6.838   3.222
  339    HB   ILE  39           HB       ILE  39   2.579   4.747   3.129
  340   HG12  ILE  39          1HG1      ILE  39   4.225   7.215   2.777
  341   HG13  ILE  39          2HG1      ILE  39   3.104   7.040   4.148
  342   HG21  ILE  39          1HG2      ILE  39   4.405   4.753   1.464
  343   HG22  ILE  39          2HG2      ILE  39   2.816   4.643   0.672
  344   HG23  ILE  39          3HG2      ILE  39   3.696   6.190   0.691
  345   HD11  ILE  39          1HD1      ILE  39   5.389   6.367   4.776
  346   HD12  ILE  39          2HD1      ILE  39   4.271   4.984   4.841
  347   HD13  ILE  39          3HD1      ILE  39   5.393   5.159   3.470
  348    H    ASP  40           H        ASP  40   2.656   8.671   2.744
  349    HA   ASP  40           HA       ASP  40   1.865   9.789   0.226
  350    HB2  ASP  40          1HB       ASP  40   2.910  11.918   1.189
  351    HB3  ASP  40          2HB       ASP  40   1.603  11.069   2.051
  352    HD2  ASP  40           HD       ASP  40   4.417  11.938   4.296
  353    H    VAL  41           H        VAL  41   4.864   8.952   2.100
  354    HA   VAL  41           HA       VAL  41   6.380   9.190  -0.405
  355    HB   VAL  41           HB       VAL  41   7.331   9.466   2.484
  356   HG11  VAL  41          1HG1      VAL  41   9.503  10.079   1.474
  357   HG12  VAL  41          2HG1      VAL  41   9.029   8.425   1.019
  358   HG13  VAL  41          3HG1      VAL  41   8.839   9.758  -0.145
  359   HG21  VAL  41          1HG2      VAL  41   7.783  11.795   1.904
  360   HG22  VAL  41          2HG2      VAL  41   7.059  11.535   0.300
  361   HG23  VAL  41          3HG2      VAL  41   6.055  11.394   1.764
  362    H    CYS  42           H        CYS  42   7.431   7.386  -1.160
  363    HA   CYS  42           HA       CYS  42   6.524   4.949  -0.077
  364    HB2  CYS  42          1HB       CYS  42   6.855   5.322  -2.466
  365    HB3  CYS  42          2HB       CYS  42   8.597   5.476  -2.216
  366    HG   CYS  42           HG       CYS  42   8.068   3.180  -3.391
  367    HA   PRO  43           HA       PRO  43   9.816   4.570   2.801
  368    HB2  PRO  43          1HB       PRO  43   9.177   2.135   3.869
  369    HB3  PRO  43          2HB       PRO  43   8.284   3.593   4.324
  370    HG2  PRO  43          1HG       PRO  43   7.595   1.508   2.232
  371    HG3  PRO  43          2HG       PRO  43   6.540   2.279   3.425
  372    HD2  PRO  43          1HD       PRO  43   6.598   3.126   0.820
  373    HD3  PRO  43          2HD       PRO  43   6.322   4.266   2.143
  374    H    LYS  44           H        LYS  44  11.914   3.933   2.793
  375    HA   LYS  44           HA       LYS  44  12.689   2.480   0.487
  376    HB2  LYS  44          1HB       LYS  44  14.158   3.324   3.002
  377    HB3  LYS  44          2HB       LYS  44  14.942   2.570   1.593
  378    HG2  LYS  44          1HG       LYS  44  14.262   4.471   0.190
  379    HG3  LYS  44          2HG       LYS  44  13.466   5.224   1.591
  380    HD2  LYS  44          1HD       LYS  44  15.613   5.381   2.755
  381    HD3  LYS  44          2HD       LYS  44  16.425   4.568   1.396
  382    HE2  LYS  44          1HE       LYS  44  15.791   6.415  -0.093
  383    HE3  LYS  44          2HE       LYS  44  14.972   7.229   1.260
  384    HZ1  LYS  44          1HZ       LYS  44  17.174   8.113   0.893
  385    HZ2  LYS  44          2HZ       LYS  44  17.097   7.381   2.370
  386    HZ3  LYS  44          3HZ       LYS  44  17.856   6.627   1.114
  387    H    ASN  45           H        ASN  45  14.038   0.457   0.560
  388    HA   ASN  45           HA       ASN  45  12.430  -1.459   1.830
  389    HB2  ASN  45          1HB       ASN  45  14.992  -1.990   0.160
  390    HB3  ASN  45          2HB       ASN  45  13.815  -2.993   1.041
  391   HD21  ASN  45          1HD2      ASN  45  13.025  -2.363  -2.658
  392   HD22  ASN  45          2HD2      ASN  45  14.546  -2.612  -1.866
  393    H    SER  46           H        SER  46  12.998  -2.865   3.609
  394    HA   SER  46           HA       SER  46  15.402  -2.037   5.026
  395    HB2  SER  46          1HB       SER  46  14.313  -2.885   7.040
  396    HB3  SER  46          2HB       SER  46  13.262  -1.717   6.208
  397    HG   SER  46           HG       SER  46  12.139  -3.511   5.327
  398    H    LEU  47           H        LEU  47  16.129  -4.068   6.581
  399    HA   LEU  47           HA       LEU  47  17.036  -5.979   4.665
  400    HB2  LEU  47          1HB       LEU  47  17.239  -5.662   7.595
  401    HB3  LEU  47          2HB       LEU  47  18.188  -6.937   6.797
  402    HG   LEU  47           HG       LEU  47  18.473  -3.936   6.379
  403   HD11  LEU  47          1HD1      LEU  47  20.730  -4.273   7.421
  404   HD12  LEU  47          2HD1      LEU  47  19.425  -4.744   8.536
  405   HD13  LEU  47          3HD1      LEU  47  20.344  -5.993   7.662
  406   HD21  LEU  47          1HD2      LEU  47  20.409  -4.517   4.958
  407   HD22  LEU  47          2HD2      LEU  47  20.010  -6.242   5.151
  408   HD23  LEU  47          3HD2      LEU  47  18.874  -5.152   4.321
  409    H    LEU  48           H        LEU  48  14.362  -5.706   6.903
  410    HA   LEU  48           HA       LEU  48  14.115  -8.608   7.073
  411    HB2  LEU  48          1HB       LEU  48  12.772  -6.306   8.349
  412    HB3  LEU  48          2HB       LEU  48  12.301  -7.959   8.806
  413    HG   LEU  48           HG       LEU  48  15.002  -6.632   9.262
  414   HD11  LEU  48          1HD1      LEU  48  14.423  -6.927  11.686
  415   HD12  LEU  48          2HD1      LEU  48  13.220  -5.915  10.852
  416   HD13  LEU  48          3HD1      LEU  48  12.855  -7.620  11.210
  417   HD21  LEU  48          1HD2      LEU  48  15.626  -8.718  10.432
  418   HD22  LEU  48          2HD2      LEU  48  14.082  -9.443   9.926
  419   HD23  LEU  48          3HD2      LEU  48  15.287  -8.976   8.703
  420    H    VAL  49           H        VAL  49  12.279  -5.639   6.119
  421    HA   VAL  49           HA       VAL  49  10.492  -7.420   4.612
  422    HB   VAL  49           HB       VAL  49   8.683  -5.721   5.074
  423   HG11  VAL  49          1HG1      VAL  49   8.249  -6.443   7.399
  424   HG12  VAL  49          2HG1      VAL  49   8.829  -7.800   6.404
  425   HG13  VAL  49          3HG1      VAL  49   9.934  -6.993   7.543
  426   HG21  VAL  49          1HG2      VAL  49   8.979  -4.138   6.911
  427   HG22  VAL  49          2HG2      VAL  49  10.691  -4.606   7.037
  428   HG23  VAL  49          3HG2      VAL  49  10.092  -3.812   5.560
  429    H    LYS  50           H        LYS  50   9.794  -6.646   2.566
  430    HA   LYS  50           HA       LYS  50  11.428  -4.420   1.592
  431    HB2  LYS  50          1HB       LYS  50  11.738  -6.567   0.464
  432    HB3  LYS  50          2HB       LYS  50   9.987  -6.674   0.164
  433    HG2  LYS  50          1HG       LYS  50  10.118  -4.682  -1.284
  434    HG3  LYS  50          2HG       LYS  50  11.871  -4.591  -0.993
  435    HD2  LYS  50          1HD       LYS  50  12.161  -6.811  -2.009
  436    HD3  LYS  50          2HD       LYS  50  10.407  -6.912  -2.293
  437    HE2  LYS  50          1HE       LYS  50  10.544  -4.899  -3.723
  438    HE3  LYS  50          2HE       LYS  50  12.304  -4.859  -3.473
  439    HZ1  LYS  50          1HZ       LYS  50  11.723  -5.926  -5.544
  440    HZ2  LYS  50          2HZ       LYS  50  12.437  -7.013  -4.529
  441    HZ3  LYS  50          3HZ       LYS  50  10.804  -7.050  -4.760
  442    H    TYR  51           H        TYR  51  10.471  -2.718   0.377
  443    HA   TYR  51           HA       TYR  51   7.557  -2.557   0.759
  444    HB2  TYR  51          1HB       TYR  51   9.677  -0.408   0.828
  445    HB3  TYR  51          2HB       TYR  51   7.922  -0.110   0.840
  446    HD1  TYR  51          1HD       TYR  51  10.807  -1.242   2.805
  447    HD2  TYR  51          2HD       TYR  51   6.579  -0.688   2.817
  448    HE1  TYR  51          1HE       TYR  51  10.789  -1.489   5.270
  449    HE2  TYR  51          2HE       TYR  51   6.543  -0.933   5.276
  450    HH   TYR  51           HH       TYR  51   9.524  -1.514   7.156
  451    H    VAL  52           H        VAL  52   6.380  -2.479  -1.092
  452    HA   VAL  52           HA       VAL  52   7.667  -1.177  -3.394
  453    HB   VAL  52           HB       VAL  52   5.632  -3.456  -3.418
  454   HG11  VAL  52          1HG1      VAL  52   5.977  -3.419  -5.866
  455   HG12  VAL  52          2HG1      VAL  52   5.329  -1.865  -5.285
  456   HG13  VAL  52          3HG1      VAL  52   7.056  -2.015  -5.693
  457   HG21  VAL  52          1HG2      VAL  52   7.423  -4.790  -4.412
  458   HG22  VAL  52          2HG2      VAL  52   8.555  -3.435  -4.187
  459   HG23  VAL  52          3HG2      VAL  52   7.833  -4.238  -2.772
  460    H    CYS  53           H        CYS  53   6.582   0.557  -4.232
  461    HA   CYS  53           HA       CYS  53   3.871   0.965  -3.195
  462    HB2  CYS  53          1HB       CYS  53   5.795   3.173  -3.895
  463    HB3  CYS  53          2HB       CYS  53   4.252   3.297  -3.043
  464    HG   CYS  53           HG       CYS  53   6.226   3.845  -1.390
  465    H    CYS  54           H        CYS  54   2.512   2.366  -4.726
  466    HA   CYS  54           HA       CYS  54   3.548   2.753  -7.357
  467    HB2  CYS  54          1HB       CYS  54   1.548   1.498  -8.373
  468    HB3  CYS  54          2HB       CYS  54   2.989   0.591  -7.901
  469    HG   CYS  54           HG       CYS  54   0.840  -0.851  -7.427
  470    H    ASN  55           H        ASN  55   1.925   4.094  -8.654
  471    HA   ASN  55           HA       ASN  55   0.836   5.817  -6.584
  472    HB2  ASN  55          1HB       ASN  55   1.556   7.766  -8.059
  473    HB3  ASN  55          2HB       ASN  55   2.658   6.424  -7.666
  474   HD21  ASN  55          1HD2      ASN  55   2.954   7.458 -11.254
  475   HD22  ASN  55          2HD2      ASN  55   2.974   8.323  -9.753
  476    H    THR  56           H        THR  56  -0.683   3.585  -7.835
  477    HA   THR  56           HA       THR  56  -2.854   5.220  -8.939
  478    HB   THR  56           HB       THR  56  -3.424   3.323 -10.467
  479    HG1  THR  56          1HG       THR  56  -1.773   1.715 -10.778
  480   HG21  THR  56          1HG2      THR  56  -1.628   3.694 -12.120
  481   HG22  THR  56          2HG2      THR  56  -2.101   5.221 -11.335
  482   HG23  THR  56          3HG2      THR  56  -0.602   4.397 -10.847
  483    H    ASP  57           H        ASP  57  -4.957   3.745  -8.986
  484    HA   ASP  57           HA       ASP  57  -5.292   3.355  -6.204
  485    HB2  ASP  57          1HB       ASP  57  -7.275   3.196  -8.543
  486    HB3  ASP  57          2HB       ASP  57  -7.567   2.842  -6.821
  487    HD2  ASP  57           HD       ASP  57  -7.601   6.547  -7.948
  488    H    ARG  58           H        ARG  58  -5.511   1.343  -5.115
  489    HA   ARG  58           HA       ARG  58  -5.604  -0.786  -4.761
  490    HB2  ARG  58          1HB       ARG  58  -7.198  -0.784  -7.363
  491    HB3  ARG  58          2HB       ARG  58  -7.138  -2.161  -6.250
  492    HG2  ARG  58          1HG       ARG  58  -8.309  -0.993  -4.563
  493    HG3  ARG  58          2HG       ARG  58  -7.952   0.594  -5.268
  494    HD2  ARG  58          1HD       ARG  58  -9.658  -1.487  -6.685
  495    HD3  ARG  58          2HD       ARG  58 -10.357  -0.305  -5.569
  496    HE   ARG  58           HE       ARG  58  -8.809   1.197  -7.346
  497   HH11  ARG  58          1HH1      ARG  58 -11.054   1.546  -9.981
  498   HH12  ARG  58          2HH1      ARG  58  -9.615   2.172  -9.207
  499   HH21  ARG  58          1HH2      ARG  58 -12.144  -0.299  -9.096
  500   HH22  ARG  58          2HH2      ARG  58 -11.527  -1.052  -7.663
  501    H    CYS  59           H        CYS  59  -3.264   0.176  -6.221
  502    HA   CYS  59           HA       CYS  59  -2.863  -1.649  -8.411
  503    HB2  CYS  59          1HB       CYS  59  -0.801  -0.123  -8.595
  504    HB3  CYS  59          2HB       CYS  59  -2.242   0.874  -8.278
  505    HG   CYS  59           HG       CYS  59  -0.191   1.870  -7.077
  506    H    ASN  60           H        ASN  60  -2.121  -1.269  -4.981
  507    HA   ASN  60           HA       ASN  60   0.082  -3.107  -5.142
  508    HB2  ASN  60          1HB       ASN  60   0.307  -2.664  -2.711
  509    HB3  ASN  60          2HB       ASN  60   0.196  -1.140  -3.603
  510   HD21  ASN  60          1HD2      ASN  60  -0.298  -0.764  -1.145
  511   HD22  ASN  60          2HD2      ASN  60  -1.977  -0.664  -0.734
  Start of MODEL    5
    1    H1   MET   0          1H        MET   0  -9.323  11.077  -0.911
    2    H2   MET   0          2H        MET   0  -9.092  11.737  -2.237
    3    H    MET   0           H        MET   0  -9.692  10.340  -2.187
    4    H3   MET   0          3H        MET   0  -9.702  10.369  -2.178
    5    HA   MET   0           HA       MET   0  -6.990  10.955  -2.450
    6    HB2  MET   0          1HB       MET   0  -7.697   9.524   0.121
    7    HB3  MET   0          2HB       MET   0  -6.054   9.611  -0.558
    8    HG2  MET   0          1HG       MET   0  -7.702  12.039   0.193
    9    HG3  MET   0          2HG       MET   0  -6.552  11.250   1.300
   10    HE1  MET   0          1HE       MET   0  -5.647  14.285  -1.936
   11    HE2  MET   0          2HE       MET   0  -6.957  13.101  -2.168
   12    HE3  MET   0          3HE       MET   0  -6.989  14.201  -0.768
   13    H    LEU   1           H        LEU   1  -5.580   8.784  -2.568
   14    HA   LEU   1           HA       LEU   1  -6.946   7.270  -4.510
   15    HB2  LEU   1          1HB       LEU   1  -4.394   7.223  -3.080
   16    HB3  LEU   1          2HB       LEU   1  -4.689   5.818  -4.130
   17    HG   LEU   1           HG       LEU   1  -3.274   7.625  -5.176
   18   HD11  LEU   1          1HD1      LEU   1  -4.549   7.671  -7.337
   19   HD12  LEU   1          2HD1      LEU   1  -4.608   6.059  -6.586
   20   HD13  LEU   1          3HD1      LEU   1  -6.010   7.148  -6.467
   21   HD21  LEU   1          1HD2      LEU   1  -4.390   9.707  -5.902
   22   HD22  LEU   1          2HD2      LEU   1  -5.845   9.221  -4.999
   23   HD23  LEU   1          3HD2      LEU   1  -4.326   9.544  -4.131
   24    H    LYS   2           H        LYS   2  -6.603   4.679  -4.349
   25    HA   LYS   2           HA       LYS   2  -7.614   3.889  -1.707
   26    HB2  LYS   2          1HB       LYS   2  -8.381   2.678  -4.375
   27    HB3  LYS   2          2HB       LYS   2  -9.073   2.310  -2.776
   28    HG2  LYS   2          1HG       LYS   2  -9.317   4.978  -4.207
   29    HG3  LYS   2          2HG       LYS   2 -10.566   3.710  -4.203
   30    HD2  LYS   2          1HD       LYS   2 -10.630   3.843  -1.713
   31    HD3  LYS   2          2HD       LYS   2  -9.476   5.196  -1.788
   32    HE2  LYS   2          1HE       LYS   2 -12.262   5.114  -2.983
   33    HE3  LYS   2          2HE       LYS   2 -11.746   6.043  -1.556
   34    HZ1  LYS   2          1HZ       LYS   2 -11.837   7.414  -3.526
   35    HZ2  LYS   2          2HZ       LYS   2 -10.282   7.301  -2.986
   36    HZ3  LYS   2          3HZ       LYS   2 -10.761   6.439  -4.310
   37    H    CYS   3           H        CYS   3  -6.729   2.031  -0.813
   38    HA   CYS   3           HA       CYS   3  -4.671   0.755  -2.468
   39    HB2  CYS   3          1HB       CYS   3  -4.590   1.305   0.501
   40    HB3  CYS   3          2HB       CYS   3  -3.384   0.379  -0.401
   41    HG   CYS   3           HG       CYS   3  -2.393   2.730   0.252
   42    H    ASN   4           H        ASN   4  -4.351  -1.583  -1.966
   43    HA   ASN   4           HA       ASN   4  -6.916  -2.742  -1.666
   44    HB2  ASN   4          1HB       ASN   4  -4.231  -4.178  -2.291
   45    HB3  ASN   4          2HB       ASN   4  -5.895  -4.716  -1.952
   46   HD21  ASN   4          1HD2      ASN   4  -4.940  -3.886  -5.641
   47   HD22  ASN   4          2HD2      ASN   4  -3.891  -4.408  -4.364
   48    H    LYS   5           H        LYS   5  -7.490  -4.377  -0.019
   49    HA   LYS   5           HA       LYS   5  -5.597  -4.654   2.184
   50    HB2  LYS   5          1HB       LYS   5  -8.526  -3.904   2.434
   51    HB3  LYS   5          2HB       LYS   5  -7.459  -4.354   3.786
   52    HG2  LYS   5          1HG       LYS   5  -6.977  -1.973   1.967
   53    HG3  LYS   5          2HG       LYS   5  -7.853  -1.875   3.514
   54    HD2  LYS   5          1HD       LYS   5  -5.887  -2.686   4.712
   55    HD3  LYS   5          2HD       LYS   5  -5.008  -2.883   3.177
   56    HE2  LYS   5          1HE       LYS   5  -4.891  -0.560   2.812
   57    HE3  LYS   5          2HE       LYS   5  -6.153  -0.221   4.017
   58    HZ1  LYS   5          1HZ       LYS   5  -3.965   0.318   4.846
   59    HZ2  LYS   5          2HZ       LYS   5  -4.615  -0.915   5.728
   60    HZ3  LYS   5          3HZ       LYS   5  -3.445  -1.229   4.609
   61    H    LEU   6           H        LEU   6  -9.069  -5.566   1.946
   62    HA   LEU   6           HA       LEU   6  -8.279  -8.317   2.356
   63    HB2  LEU   6          1HB       LEU   6  -9.982  -7.357   3.597
   64    HB3  LEU   6          2HB       LEU   6 -11.014  -6.913   2.218
   65    HG   LEU   6           HG       LEU   6 -11.125  -9.397   1.670
   66   HD11  LEU   6          1HD1      LEU   6 -10.671 -10.955   3.583
   67   HD12  LEU   6          2HD1      LEU   6  -9.192 -10.105   3.076
   68   HD13  LEU   6          3HD1      LEU   6 -10.063  -9.582   4.537
   69   HD21  LEU   6          1HD2      LEU   6 -12.891  -9.842   3.340
   70   HD22  LEU   6          2HD2      LEU   6 -12.326  -8.442   4.285
   71   HD23  LEU   6          3HD2      LEU   6 -12.993  -8.204   2.652
   72    H    VAL   7           H        VAL   7  -8.443  -9.979   0.872
   73    HA   VAL   7           HA       VAL   7  -8.518  -9.263  -1.858
   74    HB   VAL   7           HB       VAL   7  -8.472 -11.734  -2.239
   75   HG11  VAL   7          1HG1      VAL   7  -6.344 -12.195  -1.067
   76   HG12  VAL   7          2HG1      VAL   7  -6.363 -10.546  -1.735
   77   HG13  VAL   7          3HG1      VAL   7  -6.633 -10.806   0.005
   78   HG21  VAL   7          1HG2      VAL   7  -8.442 -13.272  -0.340
   79   HG22  VAL   7          2HG2      VAL   7  -8.805 -11.920   0.759
   80   HG23  VAL   7          3HG2      VAL   7  -9.991 -12.409  -0.477
   81    HA   PRO   8           HA       PRO   8  -8.895 -10.421  -3.482
   82    HB2  PRO   8          1HB       PRO   8  -9.912 -10.197  -5.965
   83    HB3  PRO   8          2HB       PRO   8 -10.180 -11.692  -5.057
   84    HG2  PRO   8          1HG       PRO   8 -12.022  -9.309  -5.398
   85    HG3  PRO   8          2HG       PRO   8 -12.409 -11.033  -5.462
   86    HD2  PRO   8          1HD       PRO   8 -12.802  -9.465  -3.192
   87    HD3  PRO   8          2HD       PRO   8 -12.549 -11.214  -3.123
   88    H    ILE   9           H        ILE   9 -11.273  -7.867  -3.815
   89    HA   ILE   9           HA       ILE   9  -9.106  -6.204  -4.897
   90    HB   ILE   9           HB       ILE   9 -12.046  -6.223  -5.587
   91   HG12  ILE   9          1HG1      ILE   9 -10.841  -8.085  -6.564
   92   HG13  ILE   9          2HG1      ILE   9 -11.287  -6.913  -7.814
   93   HG21  ILE   9          1HG2      ILE   9 -11.259  -3.946  -5.589
   94   HG22  ILE   9          2HG2      ILE   9  -9.818  -4.400  -6.527
   95   HG23  ILE   9          3HG2      ILE   9 -11.433  -4.505  -7.269
   96   HD11  ILE   9          1HD1      ILE   9  -8.915  -7.821  -7.975
   97   HD12  ILE   9          2HD1      ILE   9  -9.025  -6.046  -7.900
   98   HD13  ILE   9          3HD1      ILE   9  -8.559  -6.971  -6.452
   99    H    ALA  10           H        ALA  10 -11.294  -6.762  -2.317
  100    HA   ALA  10           HA       ALA  10 -12.419  -4.388  -1.725
  101    HB1  ALA  10          1HB       ALA  10 -12.949  -5.486   0.171
  102    HB2  ALA  10          2HB       ALA  10 -11.963  -6.833  -0.445
  103    HB3  ALA  10          3HB       ALA  10 -11.242  -5.631   0.651
  104    H    TYR  11           H        TYR  11 -11.815  -2.388  -0.901
  105    HA   TYR  11           HA       TYR  11  -8.943  -2.017  -0.446
  106    HB2  TYR  11          1HB       TYR  11  -8.992  -0.033  -1.859
  107    HB3  TYR  11          2HB       TYR  11  -9.319  -1.531  -2.764
  108    HD1  TYR  11          1HD       TYR  11 -10.739   1.644  -1.561
  109    HD2  TYR  11          2HD       TYR  11 -11.531  -1.951  -3.714
  110    HE1  TYR  11          1HE       TYR  11 -12.829   2.640  -2.443
  111    HE2  TYR  11          2HE       TYR  11 -13.619  -0.972  -4.603
  112    HH   TYR  11           HH       TYR  11 -14.987   0.850  -4.647
  113    H    LYS  12           H        LYS  12  -8.438   0.099   0.601
  114    HA   LYS  12           HA       LYS  12 -10.786   1.221   1.962
  115    HB2  LYS  12          1HB       LYS  12  -8.025   0.555   2.984
  116    HB3  LYS  12          2HB       LYS  12  -9.035   1.792   3.771
  117    HG2  LYS  12          1HG       LYS  12 -10.802   0.062   4.111
  118    HG3  LYS  12          2HG       LYS  12  -9.691  -1.156   3.439
  119    HD2  LYS  12          1HD       LYS  12  -8.082  -0.702   5.231
  120    HD3  LYS  12          2HD       LYS  12  -9.153   0.559   5.889
  121    HE2  LYS  12          1HE       LYS  12 -10.906  -1.162   6.242
  122    HE3  LYS  12          2HE       LYS  12  -9.770  -2.404   5.670
  123    HZ1  LYS  12          1HZ       LYS  12  -9.815  -2.276   8.068
  124    HZ2  LYS  12          2HZ       LYS  12  -8.327  -1.837   7.505
  125    HZ3  LYS  12          3HZ       LYS  12  -9.382  -0.685   8.036
  126    H    THR  13           H        THR  13 -10.553   3.534   2.547
  127    HA   THR  13           HA       THR  13  -9.342   4.881   0.288
  128    HB   THR  13           HB       THR  13 -11.000   5.928   2.634
  129    HG1  THR  13          1HG       THR  13 -12.674   5.947   1.018
  130   HG21  THR  13          1HG2      THR  13 -11.327   7.920   1.210
  131   HG22  THR  13          2HG2      THR  13  -9.602   7.670   1.576
  132   HG23  THR  13          3HG2      THR  13 -10.248   7.218  -0.018
  133    H    CYS  14           H        CYS  14  -7.513   6.051   0.258
  134    HA   CYS  14           HA       CYS  14  -5.777   5.797   2.451
  135    HB2  CYS  14          1HB       CYS  14  -5.628   7.384  -0.105
  136    HB3  CYS  14          2HB       CYS  14  -4.330   7.374   1.091
  137    HG   CYS  14           HG       CYS  14  -3.660   5.864  -0.959
  138    HA   PRO  15           HA       PRO  15  -6.868   9.453   4.572
  139    HB2  PRO  15          1HB       PRO  15  -4.742   9.887   6.188
  140    HB3  PRO  15          2HB       PRO  15  -5.777   8.479   6.463
  141    HG2  PRO  15          1HG       PRO  15  -3.152   8.650   4.945
  142    HG3  PRO  15          2HG       PRO  15  -3.677   7.441   6.124
  143    HD2  PRO  15          1HD       PRO  15  -3.847   7.008   3.403
  144    HD3  PRO  15          2HD       PRO  15  -4.983   6.271   4.541
  145    H    GLU  16           H        GLU  16  -6.646  11.738   4.747
  146    HA   GLU  16           HA       GLU  16  -5.705  12.827   2.414
  147    HB2  GLU  16          1HB       GLU  16  -7.333  13.878   3.907
  148    HB3  GLU  16          2HB       GLU  16  -6.075  14.094   5.148
  149    HG2  GLU  16          1HG       GLU  16  -4.877  15.709   3.592
  150    HG3  GLU  16          2HG       GLU  16  -6.172  15.339   2.432
  151    HE2  GLU  16           HE       GLU  16  -7.079  18.324   4.252
  152    H    GLY  17           H        GLY  17  -3.749  13.716   1.730
  153    HA2  GLY  17          1HA       GLY  17  -1.650  14.676   2.093
  154    HA3  GLY  17          2HA       GLY  17  -1.591  13.981   3.701
  155    H    LYS  18           H        LYS  18  -2.723  11.341   2.431
  156    HA   LYS  18           HA       LYS  18  -0.132  10.427   1.415
  157    HB2  LYS  18          1HB       LYS  18  -2.497   8.808   2.388
  158    HB3  LYS  18          2HB       LYS  18  -0.858   8.215   2.029
  159    HG2  LYS  18          1HG       LYS  18  -1.650  10.072   4.299
  160    HG3  LYS  18          2HG       LYS  18  -1.214   8.353   4.446
  161    HD2  LYS  18          1HD       LYS  18   1.033   8.896   3.495
  162    HD3  LYS  18          2HD       LYS  18   0.583  10.617   3.518
  163    HE2  LYS  18          1HE       LYS  18   0.135  10.342   5.999
  164    HE3  LYS  18          2HE       LYS  18   0.899   8.741   5.874
  165    HZ1  LYS  18          1HZ       LYS  18   2.465  10.421   6.576
  166    HZ2  LYS  18          2HZ       LYS  18   2.897   9.827   5.099
  167    HZ3  LYS  18          3HZ       LYS  18   2.188  11.312   5.216
  168    H    ASN  19           H        ASN  19  -0.110   8.972  -0.466
  169    HA   ASN  19           HA       ASN  19  -2.354   9.599  -2.204
  170    HB2  ASN  19          1HB       ASN  19  -0.435  11.384  -2.600
  171    HB3  ASN  19          2HB       ASN  19   0.422   9.838  -2.812
  172   HD21  ASN  19          1HD2      ASN  19  -1.706  11.517  -5.817
  173   HD22  ASN  19          2HD2      ASN  19  -1.625  12.206  -4.229
  174    H    LEU  20           H        LEU  20   0.779   7.836  -1.661
  175    HA   LEU  20           HA       LEU  20   0.271   6.211  -4.001
  176    HB2  LEU  20          1HB       LEU  20   2.436   6.195  -1.986
  177    HB3  LEU  20          2HB       LEU  20   2.621   5.406  -3.570
  178    HG   LEU  20           HG       LEU  20   2.433   8.392  -3.017
  179   HD11  LEU  20          1HD1      LEU  20   4.753   8.425  -3.969
  180   HD12  LEU  20          2HD1      LEU  20   4.660   7.383  -2.531
  181   HD13  LEU  20          3HD1      LEU  20   4.686   6.657  -4.155
  182   HD21  LEU  20          1HD2      LEU  20   2.760   8.686  -5.448
  183   HD22  LEU  20          2HD2      LEU  20   2.648   6.922  -5.659
  184   HD23  LEU  20          3HD2      LEU  20   1.245   7.836  -5.057
  185    H    CYS  21           H        CYS  21   0.377   3.838  -3.927
  186    HA   CYS  21           HA       CYS  21  -0.541   2.840  -1.331
  187    HB2  CYS  21          1HB       CYS  21  -1.213   1.969  -4.135
  188    HB3  CYS  21          2HB       CYS  21  -1.550   0.966  -2.721
  189    HG   CYS  21           HG       CYS  21  -3.780   2.076  -3.572
  190    H    TYR  22           H        TYR  22   0.740   1.271  -0.363
  191    HA   TYR  22           HA       TYR  22   2.939   0.215  -2.011
  192    HB2  TYR  22          1HB       TYR  22   4.391   0.400  -0.158
  193    HB3  TYR  22          2HB       TYR  22   3.599   1.976  -0.398
  194    HD1  TYR  22          1HD       TYR  22   3.783  -1.007   1.780
  195    HD2  TYR  22          2HD       TYR  22   2.116   2.885   1.276
  196    HE1  TYR  22          1HE       TYR  22   3.042  -1.027   4.144
  197    HE2  TYR  22          2HE       TYR  22   1.369   2.882   3.633
  198    HH   TYR  22           HH       TYR  22   1.293   1.723   5.592
  199    H    LYS  23           H        LYS  23   3.786  -1.908  -1.332
  200    HA   LYS  23           HA       LYS  23   2.036  -3.309   0.556
  201    HB2  LYS  23          1HB       LYS  23   2.317  -5.344  -0.775
  202    HB3  LYS  23          2HB       LYS  23   1.486  -4.065  -1.692
  203    HG2  LYS  23          1HG       LYS  23   3.579  -3.554  -2.883
  204    HG3  LYS  23          2HG       LYS  23   4.415  -4.828  -1.961
  205    HD2  LYS  23          1HD       LYS  23   3.648  -5.459  -4.307
  206    HD3  LYS  23          2HD       LYS  23   3.151  -6.551  -2.992
  207    HE2  LYS  23          1HE       LYS  23   0.949  -5.513  -2.922
  208    HE3  LYS  23          2HE       LYS  23   1.437  -4.341  -4.166
  209    HZ1  LYS  23          1HZ       LYS  23   0.166  -6.152  -5.101
  210    HZ2  LYS  23          2HZ       LYS  23   1.705  -6.174  -5.697
  211    HZ3  LYS  23          3HZ       LYS  23   1.252  -7.261  -4.541
  212    H    MET  24           H        MET  24   3.113  -4.957   1.827
  213    HA   MET  24           HA       MET  24   5.987  -4.454   1.897
  214    HB2  MET  24          1HB       MET  24   4.033  -5.092   4.119
  215    HB3  MET  24          2HB       MET  24   5.797  -4.983   4.328
  216    HG2  MET  24          1HG       MET  24   5.692  -2.614   3.572
  217    HG3  MET  24          2HG       MET  24   3.919  -2.747   3.506
  218    HE1  MET  24          1HE       MET  24   2.848  -3.013   7.198
  219    HE2  MET  24          2HE       MET  24   2.347  -2.663   5.525
  220    HE3  MET  24          3HE       MET  24   2.966  -4.278   5.952
  221    H    PHE  25           H        PHE  25   7.376  -6.213   1.835
  222    HA   PHE  25           HA       PHE  25   6.099  -8.850   1.994
  223    HB2  PHE  25          1HB       PHE  25   8.694  -7.807   0.725
  224    HB3  PHE  25          2HB       PHE  25   8.209  -9.505   0.691
  225    HD1  PHE  25          1HD       PHE  25   7.472  -6.145  -0.572
  226    HD2  PHE  25          2HD       PHE  25   6.522 -10.267  -0.839
  227    HE1  PHE  25          1HE       PHE  25   6.192  -5.716  -2.706
  228    HE2  PHE  25          2HE       PHE  25   5.252  -9.844  -2.962
  229    HZ   PHE  25           HZ       PHE  25   5.102  -7.575  -3.869
  230    H    MET  26           H        MET  26   7.552 -10.624   2.928
  231    HA   MET  26           HA       MET  26   9.575  -9.474   4.691
  232    HB2  MET  26          1HB       MET  26   7.984 -12.038   4.912
  233    HB3  MET  26          2HB       MET  26   9.343 -11.608   5.979
  234    HG2  MET  26          1HG       MET  26   8.113  -9.644   6.772
  235    HG3  MET  26          2HG       MET  26   6.760 -10.043   5.685
  236    HE1  MET  26          1HE       MET  26   5.266 -10.829   9.244
  237    HE2  MET  26          2HE       MET  26   6.386  -9.512   8.816
  238    HE3  MET  26          3HE       MET  26   5.048  -9.935   7.720
  239    H    MET  27           H        MET  27  11.676 -10.461   4.729
  240    HA   MET  27           HA       MET  27  12.618 -10.998   2.266
  241    HB2  MET  27          1HB       MET  27  13.607 -11.698   5.024
  242    HB3  MET  27          2HB       MET  27  14.564 -12.091   3.576
  243    HG2  MET  27          1HG       MET  27  13.676  -9.327   4.457
  244    HG3  MET  27          2HG       MET  27  15.320  -9.993   4.586
  245    HE1  MET  27          1HE       MET  27  16.470 -10.239   0.875
  246    HE2  MET  27          2HE       MET  27  16.951 -10.351   2.585
  247    HE3  MET  27          3HE       MET  27  15.789 -11.518   1.908
  248    H    SER  28           H        SER  28  11.210 -13.278   4.613
  249    HA   SER  28           HA       SER  28  12.002 -15.610   3.329
  250    HB2  SER  28          1HB       SER  28  11.074 -15.571   5.575
  251    HB3  SER  28          2HB       SER  28   9.523 -14.964   4.952
  252    HG   SER  28           HG       SER  28   9.506 -17.221   5.332
  253    H    ASP  29           H        ASP  29   8.758 -13.942   3.243
  254    HA   ASP  29           HA       ASP  29   8.221 -15.412   0.817
  255    HB2  ASP  29          1HB       ASP  29   6.533 -15.398   2.757
  256    HB3  ASP  29          2HB       ASP  29   6.494 -13.648   2.427
  257    HD2  ASP  29           HD       ASP  29   3.757 -15.270   0.647
  258    H    LEU  30           H        LEU  30   9.659 -14.059  -0.566
  259    HA   LEU  30           HA       LEU  30   9.040 -11.272  -0.837
  260    HB2  LEU  30          1HB       LEU  30  10.771 -13.303  -1.959
  261    HB3  LEU  30          2HB       LEU  30  10.533 -11.941  -3.079
  262    HG   LEU  30           HG       LEU  30  11.944 -10.613  -1.931
  263   HD11  LEU  30          1HD1      LEU  30  11.883 -10.379   0.566
  264   HD12  LEU  30          2HD1      LEU  30  10.249 -10.294  -0.131
  265   HD13  LEU  30          3HD1      LEU  30  10.804 -11.790   0.657
  266   HD21  LEU  30          1HD2      LEU  30  13.640 -11.758  -0.547
  267   HD22  LEU  30          2HD2      LEU  30  12.592 -13.197  -0.485
  268   HD23  LEU  30          3HD2      LEU  30  13.259 -12.648  -2.040
  269    H    THR  31           H        THR  31   7.695 -14.265  -1.929
  270    HA   THR  31           HA       THR  31   6.979 -13.398  -4.553
  271    HB   THR  31           HB       THR  31   5.934 -15.690  -2.819
  272    HG1  THR  31          1HG       THR  31   7.400 -16.915  -4.148
  273   HG21  THR  31          1HG2      THR  31   5.159 -16.655  -4.956
  274   HG22  THR  31          2HG2      THR  31   4.379 -15.085  -4.643
  275   HG23  THR  31          3HG2      THR  31   5.712 -15.199  -5.816
  276    H    ILE  32           H        ILE  32   5.296 -13.585  -1.376
  277    HA   ILE  32           HA       ILE  32   3.107 -12.088  -2.637
  278    HB   ILE  32           HB       ILE  32   2.953 -14.378  -0.621
  279   HG12  ILE  32          1HG1      ILE  32   3.171 -15.065  -2.916
  280   HG13  ILE  32          2HG1      ILE  32   1.574 -15.464  -2.241
  281   HG21  ILE  32          1HG2      ILE  32   0.518 -13.957  -0.582
  282   HG22  ILE  32          2HG2      ILE  32   1.421 -12.552   0.032
  283   HG23  ILE  32          3HG2      ILE  32   0.748 -12.527  -1.615
  284   HD11  ILE  32          1HD1      ILE  32   1.382 -14.649  -4.558
  285   HD12  ILE  32          2HD1      ILE  32   0.593 -13.533  -3.417
  286   HD13  ILE  32          3HD1      ILE  32   2.190 -13.135  -4.093
  287    HA   PRO  33           HA       PRO  33   4.046  -9.361   0.631
  288    HB2  PRO  33          1HB       PRO  33   2.208  -7.419   0.142
  289    HB3  PRO  33          2HB       PRO  33   3.632  -7.577  -0.897
  290    HG2  PRO  33          1HG       PRO  33   0.834  -8.682  -1.316
  291    HG3  PRO  33          2HG       PRO  33   1.884  -7.851  -2.471
  292    HD2  PRO  33          1HD       PRO  33   1.676 -10.591  -2.428
  293    HD3  PRO  33          2HD       PRO  33   3.183  -9.789  -2.886
  294    H    VAL  34           H        VAL  34   3.060  -8.375   2.605
  295    HA   VAL  34           HA       VAL  34   1.229 -10.490   3.503
  296    HB   VAL  34           HB       VAL  34   2.290 -10.240   5.721
  297   HG11  VAL  34          1HG1      VAL  34   4.538 -11.114   5.170
  298   HG12  VAL  34          2HG1      VAL  34   3.294 -11.842   4.127
  299   HG13  VAL  34          3HG1      VAL  34   4.345 -10.553   3.493
  300   HG21  VAL  34          1HG2      VAL  34   4.255  -8.821   6.035
  301   HG22  VAL  34          2HG2      VAL  34   4.052  -8.178   4.388
  302   HG23  VAL  34          3HG2      VAL  34   2.806  -7.875   5.623
  303    H    LYS  35           H        LYS  35   2.021  -7.015   3.464
  304    HA   LYS  35           HA       LYS  35  -0.695  -6.466   4.284
  305    HB2  LYS  35          1HB       LYS  35   1.696  -5.849   5.966
  306    HB3  LYS  35          2HB       LYS  35   0.355  -4.689   5.928
  307    HG2  LYS  35          1HG       LYS  35  -1.140  -6.805   6.346
  308    HG3  LYS  35          2HG       LYS  35   0.370  -7.570   6.875
  309    HD2  LYS  35          1HD       LYS  35  -0.502  -6.693   8.867
  310    HD3  LYS  35          2HD       LYS  35   0.638  -5.429   8.373
  311    HE2  LYS  35          1HE       LYS  35  -1.167  -4.085   7.454
  312    HE3  LYS  35          2HE       LYS  35  -2.339  -5.389   7.700
  313    HZ1  LYS  35          1HZ       LYS  35  -2.159  -5.105  10.044
  314    HZ2  LYS  35          2HZ       LYS  35  -0.846  -4.148   9.939
  315    HZ3  LYS  35          3HZ       LYS  35  -2.299  -3.602   9.394
  316    H    ARG  36           H        ARG  36  -1.439  -4.424   3.533
  317    HA   ARG  36           HA       ARG  36   0.580  -2.857   2.162
  318    HB2  ARG  36          1HB       ARG  36  -2.198  -3.496   1.065
  319    HB3  ARG  36          2HB       ARG  36  -0.998  -2.455   0.276
  320    HG2  ARG  36          1HG       ARG  36  -0.612  -4.457  -0.828
  321    HG3  ARG  36          2HG       ARG  36   0.538  -4.629   0.510
  322    HD2  ARG  36          1HD       ARG  36  -0.613  -6.695   0.472
  323    HD3  ARG  36          2HD       ARG  36  -1.428  -5.805   1.766
  324    HE   ARG  36           HE       ARG  36  -2.637  -5.441  -0.883
  325   HH11  ARG  36          1HH1      ARG  36  -5.414  -7.377  -0.078
  326   HH12  ARG  36          2HH1      ARG  36  -4.711  -6.245  -1.213
  327   HH21  ARG  36          1HH2      ARG  36  -4.208  -8.059   1.784
  328   HH22  ARG  36          2HH2      ARG  36  -2.610  -7.443   2.041
  329    H    GLY  37           H        GLY  37  -0.493  -0.579   1.530
  330    HA2  GLY  37          1HA       GLY  37  -2.727   0.375   2.911
  331    HA3  GLY  37          2HA       GLY  37  -1.327   0.634   3.930
  332    H    CYS  38           H        CYS  38  -1.883   2.984   3.564
  333    HA   CYS  38           HA       CYS  38  -1.112   3.864   0.882
  334    HB2  CYS  38          1HB       CYS  38  -2.762   5.033   3.246
  335    HB3  CYS  38          2HB       CYS  38  -2.548   5.888   1.698
  336    HG   CYS  38           HG       CYS  38  -4.973   5.044   1.919
  337    H    ILE  39           H        ILE  39   0.445   5.624   0.722
  338    HA   ILE  39           HA       ILE  39   1.231   6.977   3.109
  339    HB   ILE  39           HB       ILE  39   2.692   4.872   3.112
  340   HG12  ILE  39          1HG1      ILE  39   4.324   7.348   2.709
  341   HG13  ILE  39          2HG1      ILE  39   3.214   7.167   4.088
  342   HG21  ILE  39          1HG2      ILE  39   4.544   4.817   1.476
  343   HG22  ILE  39          2HG2      ILE  39   2.967   4.686   0.662
  344   HG23  ILE  39          3HG2      ILE  39   3.852   6.229   0.644
  345   HD11  ILE  39          1HD1      ILE  39   5.514   6.540   4.709
  346   HD12  ILE  39          2HD1      ILE  39   4.421   5.138   4.795
  347   HD13  ILE  39          3HD1      ILE  39   5.531   5.320   3.416
  348    H    ASP  40           H        ASP  40   2.781   8.789   2.575
  349    HA   ASP  40           HA       ASP  40   2.020   9.797  -0.001
  350    HB2  ASP  40          1HB       ASP  40   3.028  11.972   0.888
  351    HB3  ASP  40          2HB       ASP  40   1.727  11.144   1.779
  352    HD2  ASP  40           HD       ASP  40   4.545  12.136   3.981
  353    H    VAL  41           H        VAL  41   4.989   9.045   1.949
  354    HA   VAL  41           HA       VAL  41   6.556   9.238  -0.531
  355    HB   VAL  41           HB       VAL  41   7.442   9.578   2.373
  356   HG11  VAL  41          1HG1      VAL  41   9.630  10.189   1.397
  357   HG12  VAL  41          2HG1      VAL  41   9.180   8.523   0.967
  358   HG13  VAL  41          3HG1      VAL  41   9.006   9.829  -0.230
  359   HG21  VAL  41          1HG2      VAL  41   7.889  11.900   1.754
  360   HG22  VAL  41          2HG2      VAL  41   7.202  11.601   0.139
  361   HG23  VAL  41          3HG2      VAL  41   6.168  11.483   1.584
  362    H    CYS  42           H        CYS  42   7.593   7.415  -1.244
  363    HA   CYS  42           HA       CYS  42   6.667   5.008  -0.113
  364    HB2  CYS  42          1HB       CYS  42   7.012   5.351  -2.514
  365    HB3  CYS  42          2HB       CYS  42   8.756   5.458  -2.256
  366    HG   CYS  42           HG       CYS  42   8.170   3.160  -3.396
  367    HA   PRO  43           HA       PRO  43   9.953   4.663   2.771
  368    HB2  PRO  43          1HB       PRO  43   9.288   2.265   3.903
  369    HB3  PRO  43          2HB       PRO  43   8.404   3.741   4.314
  370    HG2  PRO  43          1HG       PRO  43   7.709   1.605   2.275
  371    HG3  PRO  43          2HG       PRO  43   6.655   2.412   3.444
  372    HD2  PRO  43          1HD       PRO  43   6.727   3.193   0.819
  373    HD3  PRO  43          2HD       PRO  43   6.450   4.366   2.113
  374    H    LYS  44           H        LYS  44  12.042   3.982   2.804
  375    HA   LYS  44           HA       LYS  44  12.812   2.516   0.507
  376    HB2  LYS  44          1HB       LYS  44  14.282   3.345   3.023
  377    HB3  LYS  44          2HB       LYS  44  15.060   2.579   1.618
  378    HG2  LYS  44          1HG       LYS  44  14.409   4.485   0.209
  379    HG3  LYS  44          2HG       LYS  44  13.617   5.251   1.608
  380    HD2  LYS  44          1HD       LYS  44  15.761   5.384   2.779
  381    HD3  LYS  44          2HD       LYS  44  16.568   4.559   1.424
  382    HE2  LYS  44          1HE       LYS  44  15.962   6.411  -0.071
  383    HE3  LYS  44          2HE       LYS  44  15.147   7.236   1.278
  384    HZ1  LYS  44          1HZ       LYS  44  17.361   8.093   0.918
  385    HZ2  LYS  44          2HZ       LYS  44  17.270   7.366   2.396
  386    HZ3  LYS  44          3HZ       LYS  44  18.025   6.600   1.145
  387    H    ASN  45           H        ASN  45  14.141   0.480   0.587
  388    HA   ASN  45           HA       ASN  45  12.505  -1.418   1.851
  389    HB2  ASN  45          1HB       ASN  45  15.071  -1.982   0.195
  390    HB3  ASN  45          2HB       ASN  45  13.868  -2.966   1.062
  391   HD21  ASN  45          1HD2      ASN  45  13.126  -2.307  -2.642
  392   HD22  ASN  45          2HD2      ASN  45  14.635  -2.582  -1.837
  393    H    SER  46           H        SER  46  13.060  -2.848   3.621
  394    HA   SER  46           HA       SER  46  15.418  -1.975   5.091
  395    HB2  SER  46          1HB       SER  46  14.269  -2.742   7.097
  396    HB3  SER  46          2HB       SER  46  13.232  -1.617   6.189
  397    HG   SER  46           HG       SER  46  12.107  -3.414   5.387
  398    H    LEU  47           H        LEU  47  16.041  -3.983   6.749
  399    HA   LEU  47           HA       LEU  47  17.030  -5.938   4.914
  400    HB2  LEU  47          1HB       LEU  47  17.109  -5.558   7.843
  401    HB3  LEU  47          2HB       LEU  47  18.090  -6.849   7.110
  402    HG   LEU  47           HG       LEU  47  18.396  -3.856   6.653
  403   HD11  LEU  47          1HD1      LEU  47  20.612  -4.182   7.781
  404   HD12  LEU  47          2HD1      LEU  47  19.268  -4.635   8.854
  405   HD13  LEU  47          3HD1      LEU  47  20.215  -5.898   8.032
  406   HD21  LEU  47          1HD2      LEU  47  20.380  -4.459   5.312
  407   HD22  LEU  47          2HD2      LEU  47  19.972  -6.181   5.514
  408   HD23  LEU  47          3HD2      LEU  47  18.869  -5.101   4.627
  409    H    LEU  48           H        LEU  48  14.274  -5.605   7.051
  410    HA   LEU  48           HA       LEU  48  13.998  -8.504   7.249
  411    HB2  LEU  48          1HB       LEU  48  12.635  -6.176   8.454
  412    HB3  LEU  48          2HB       LEU  48  12.135  -7.819   8.915
  413    HG   LEU  48           HG       LEU  48  14.831  -6.510   9.443
  414   HD11  LEU  48          1HD1      LEU  48  14.172  -6.774  11.850
  415   HD12  LEU  48          2HD1      LEU  48  13.005  -5.763  10.967
  416   HD13  LEU  48          3HD1      LEU  48  12.615  -7.460  11.332
  417   HD21  LEU  48          1HD2      LEU  48  15.401  -8.587  10.652
  418   HD22  LEU  48          2HD2      LEU  48  13.867  -9.307  10.105
  419   HD23  LEU  48          3HD2      LEU  48  15.115  -8.860   8.917
  420    H    VAL  49           H        VAL  49  12.237  -5.529   6.183
  421    HA   VAL  49           HA       VAL  49  10.465  -7.310   4.661
  422    HB   VAL  49           HB       VAL  49   8.660  -5.596   5.050
  423   HG11  VAL  49          1HG1      VAL  49   8.169  -6.258   7.382
  424   HG12  VAL  49          2HG1      VAL  49   8.764  -7.642   6.434
  425   HG13  VAL  49          3HG1      VAL  49   9.848  -6.815   7.576
  426   HG21  VAL  49          1HG2      VAL  49   8.923  -3.969   6.855
  427   HG22  VAL  49          2HG2      VAL  49  10.629  -4.443   7.030
  428   HG23  VAL  49          3HG2      VAL  49  10.068  -3.682   5.522
  429    H    LYS  50           H        LYS  50   9.758  -6.499   2.609
  430    HA   LYS  50           HA       LYS  50  11.460  -4.309   1.649
  431    HB2  LYS  50          1HB       LYS  50  11.850  -6.458   0.565
  432    HB3  LYS  50          2HB       LYS  50  10.112  -6.618   0.216
  433    HG2  LYS  50          1HG       LYS  50  10.247  -4.627  -1.253
  434    HG3  LYS  50          2HG       LYS  50  11.996  -4.535  -0.941
  435    HD2  LYS  50          1HD       LYS  50  12.313  -6.750  -1.932
  436    HD3  LYS  50          2HD       LYS  50  10.559  -6.898  -2.197
  437    HE2  LYS  50          1HE       LYS  50  10.635  -4.915  -3.673
  438    HE3  LYS  50          2HE       LYS  50  12.396  -4.828  -3.442
  439    HZ1  LYS  50          1HZ       LYS  50  11.821  -5.957  -5.482
  440    HZ2  LYS  50          2HZ       LYS  50  12.570  -7.003  -4.449
  441    HZ3  LYS  50          3HZ       LYS  50  10.936  -7.082  -4.664
  442    H    TYR  51           H        TYR  51  10.533  -2.644   0.357
  443    HA   TYR  51           HA       TYR  51   7.613  -2.480   0.682
  444    HB2  TYR  51          1HB       TYR  51   9.729  -0.326   0.759
  445    HB3  TYR  51          2HB       TYR  51   7.971  -0.036   0.757
  446    HD1  TYR  51          1HD       TYR  51  10.846  -1.161   2.749
  447    HD2  TYR  51          2HD       TYR  51   6.620  -0.585   2.731
  448    HE1  TYR  51          1HE       TYR  51  10.812  -1.389   5.215
  449    HE2  TYR  51          2HE       TYR  51   6.568  -0.811   5.192
  450    HH   TYR  51           HH       TYR  51   7.784  -1.154   7.087
  451    H    VAL  52           H        VAL  52   6.459  -2.384  -1.186
  452    HA   VAL  52           HA       VAL  52   7.780  -1.070  -3.456
  453    HB   VAL  52           HB       VAL  52   5.790  -3.390  -3.551
  454   HG11  VAL  52          1HG1      VAL  52   6.197  -3.327  -5.988
  455   HG12  VAL  52          2HG1      VAL  52   5.508  -1.790  -5.414
  456   HG13  VAL  52          3HG1      VAL  52   7.247  -1.906  -5.777
  457   HG21  VAL  52          1HG2      VAL  52   7.630  -4.683  -4.508
  458   HG22  VAL  52          2HG2      VAL  52   8.732  -3.311  -4.243
  459   HG23  VAL  52          3HG2      VAL  52   7.988  -4.137  -2.852
  460    H    CYS  53           H        CYS  53   6.697   0.672  -4.260
  461    HA   CYS  53           HA       CYS  53   3.974   1.037  -3.238
  462    HB2  CYS  53          1HB       CYS  53   5.898   3.251  -3.921
  463    HB3  CYS  53          2HB       CYS  53   4.345   3.380  -3.092
  464    HG   CYS  53           HG       CYS  53   6.296   3.918  -1.409
  465    H    CYS  54           H        CYS  54   2.575   2.395  -4.747
  466    HA   CYS  54           HA       CYS  54   3.561   2.813  -7.393
  467    HB2  CYS  54          1HB       CYS  54   1.625   1.470  -8.397
  468    HB3  CYS  54          2HB       CYS  54   3.087   0.611  -7.901
  469    HG   CYS  54           HG       CYS  54   0.972  -0.886  -7.427
  470    H    ASN  55           H        ASN  55   1.841   4.069  -8.678
  471    HA   ASN  55           HA       ASN  55   0.805   5.786  -6.576
  472    HB2  ASN  55          1HB       ASN  55   1.488   7.743  -8.051
  473    HB3  ASN  55          2HB       ASN  55   2.602   6.396  -7.710
  474   HD21  ASN  55          1HD2      ASN  55   2.775   7.467 -11.296
  475   HD22  ASN  55          2HD2      ASN  55   2.846   8.318  -9.788
  476    H    THR  56           H        THR  56  -0.722   3.546  -7.819
  477    HA   THR  56           HA       THR  56  -2.923   5.159  -8.894
  478    HB   THR  56           HB       THR  56  -3.458   3.276 -10.460
  479    HG1  THR  56          1HG       THR  56  -1.773   1.709 -10.805
  480   HG21  THR  56          1HG2      THR  56  -1.673   3.717 -12.109
  481   HG22  THR  56          2HG2      THR  56  -2.178   5.218 -11.294
  482   HG23  THR  56          3HG2      THR  56  -0.659   4.417 -10.824
  483    H    ASP  57           H        ASP  57  -4.988   3.616  -8.987
  484    HA   ASP  57           HA       ASP  57  -5.348   3.172  -6.222
  485    HB2  ASP  57          1HB       ASP  57  -7.274   2.932  -8.600
  486    HB3  ASP  57          2HB       ASP  57  -7.582   2.537  -6.890
  487    HD2  ASP  57           HD       ASP  57  -7.716   6.270  -7.972
  488    H    ARG  58           H        ARG  58  -5.494   1.147  -5.146
  489    HA   ARG  58           HA       ARG  58  -5.475  -0.990  -4.808
  490    HB2  ARG  58          1HB       ARG  58  -7.062  -1.038  -7.412
  491    HB3  ARG  58          2HB       ARG  58  -6.950  -2.417  -6.306
  492    HG2  ARG  58          1HG       ARG  58  -8.166  -1.300  -4.614
  493    HG3  ARG  58          2HG       ARG  58  -7.882   0.300  -5.323
  494    HD2  ARG  58          1HD       ARG  58  -9.492  -1.861  -6.733
  495    HD3  ARG  58          2HD       ARG  58 -10.244  -0.708  -5.619
  496    HE   ARG  58           HE       ARG  58  -8.784   0.876  -7.386
  497   HH11  ARG  58          1HH1      ARG  58 -10.989   1.064 -10.072
  498   HH12  ARG  58          2HH1      ARG  58  -9.614   1.791  -9.265
  499   HH21  ARG  58          1HH2      ARG  58 -11.968  -0.852  -9.205
  500   HH22  ARG  58          2HH2      ARG  58 -11.330  -1.558  -7.757
  501    H    CYS  59           H        CYS  59  -3.185   0.098  -6.280
  502    HA   CYS  59           HA       CYS  59  -2.698  -1.689  -8.478
  503    HB2  CYS  59          1HB       CYS  59  -0.694  -0.096  -8.626
  504    HB3  CYS  59          2HB       CYS  59  -2.159   0.852  -8.275
  505    HG   CYS  59           HG       CYS  59  -0.129   1.871  -7.058
  506    H    ASN  60           H        ASN  60  -1.977  -1.329  -5.037
  507    HA   ASN  60           HA       ASN  60   0.213  -3.180  -5.187
  508    HB2  ASN  60          1HB       ASN  60   0.306  -2.841  -2.708
  509    HB3  ASN  60          2HB       ASN  60   0.330  -1.299  -3.576
  510   HD21  ASN  60          1HD2      ASN  60  -0.301  -0.775  -1.246
  511   HD22  ASN  60          2HD2      ASN  60  -1.994  -0.649  -0.903
  Start of MODEL    6
    1    H1   MET   0          1H        MET   0 -11.013  10.812  -0.622
    2    H2   MET   0          2H        MET   0 -10.976  11.507  -1.951
    3    H    MET   0           H        MET   0 -11.232  10.008  -1.893
    4    H3   MET   0          3H        MET   0 -11.248  10.034  -1.883
    5    HA   MET   0           HA       MET   0  -8.755  11.236  -2.222
    6    HB2  MET   0          1HB       MET   0  -9.054   9.694   0.365
    7    HB3  MET   0          2HB       MET   0  -7.488  10.134  -0.357
    8    HG2  MET   0          1HG       MET   0  -7.990  12.495  -0.107
    9    HG3  MET   0          2HG       MET   0  -9.620  12.114   0.497
   10    HE1  MET   0          1HE       MET   0  -9.037  10.759   4.049
   11    HE2  MET   0          2HE       MET   0 -10.197  11.467   2.897
   12    HE3  MET   0          3HE       MET   0  -9.436   9.896   2.544
   13    H    LEU   1           H        LEU   1  -6.874   9.401  -2.278
   14    HA   LEU   1           HA       LEU   1  -7.886   7.540  -4.162
   15    HB2  LEU   1          1HB       LEU   1  -5.320   7.856  -2.731
   16    HB3  LEU   1          2HB       LEU   1  -5.425   6.737  -4.108
   17    HG   LEU   1           HG       LEU   1  -5.788   9.756  -4.199
   18   HD11  LEU   1          1HD1      LEU   1  -3.688   9.703  -5.571
   19   HD12  LEU   1          2HD1      LEU   1  -3.414   9.041  -3.943
   20   HD13  LEU   1          3HD1      LEU   1  -3.595   7.942  -5.331
   21   HD21  LEU   1          1HD2      LEU   1  -5.927   9.468  -6.648
   22   HD22  LEU   1          2HD2      LEU   1  -5.882   7.701  -6.425
   23   HD23  LEU   1          3HD2      LEU   1  -7.248   8.646  -5.785
   24    H    LYS   2           H        LYS   2  -6.836   5.121  -3.871
   25    HA   LYS   2           HA       LYS   2  -7.585   4.181  -1.220
   26    HB2  LYS   2          1HB       LYS   2  -8.771   2.994  -3.734
   27    HB3  LYS   2          2HB       LYS   2  -9.204   2.653  -2.041
   28    HG2  LYS   2          1HG       LYS   2 -10.064   5.003  -1.862
   29    HG3  LYS   2          2HG       LYS   2  -9.776   5.188  -3.609
   30    HD2  LYS   2          1HD       LYS   2 -11.268   3.190  -3.978
   31    HD3  LYS   2          2HD       LYS   2 -11.669   3.249  -2.245
   32    HE2  LYS   2          1HE       LYS   2 -13.402   4.401  -3.427
   33    HE3  LYS   2          2HE       LYS   2 -12.424   5.615  -2.571
   34    HZ1  LYS   2          1HZ       LYS   2 -12.912   6.293  -4.823
   35    HZ2  LYS   2          2HZ       LYS   2 -11.288   6.064  -4.641
   36    HZ3  LYS   2          3HZ       LYS   2 -12.197   4.939  -5.434
   37    H    CYS   3           H        CYS   3  -6.499   2.309  -0.614
   38    HA   CYS   3           HA       CYS   3  -4.932   1.037  -2.736
   39    HB2  CYS   3          1HB       CYS   3  -4.308   1.785   0.216
   40    HB3  CYS   3          2HB       CYS   3  -3.181   0.854  -0.802
   41    HG   CYS   3           HG       CYS   3  -2.268   3.231  -0.409
   42    H    ASN   4           H        ASN   4  -4.304  -1.301  -2.020
   43    HA   ASN   4           HA       ASN   4  -6.845  -2.420  -1.413
   44    HB2  ASN   4          1HB       ASN   4  -4.280  -3.907  -2.342
   45    HB3  ASN   4          2HB       ASN   4  -5.899  -4.408  -1.798
   46   HD21  ASN   4          1HD2      ASN   4  -5.517  -3.873  -5.570
   47   HD22  ASN   4          2HD2      ASN   4  -4.411  -4.537  -4.414
   48    H    LYS   5           H        LYS   5  -7.024  -4.320   0.183
   49    HA   LYS   5           HA       LYS   5  -4.943  -4.296   2.232
   50    HB2  LYS   5          1HB       LYS   5  -7.935  -4.083   2.673
   51    HB3  LYS   5          2HB       LYS   5  -6.748  -4.444   3.950
   52    HG2  LYS   5          1HG       LYS   5  -6.718  -1.909   2.284
   53    HG3  LYS   5          2HG       LYS   5  -7.539  -2.044   3.857
   54    HD2  LYS   5          1HD       LYS   5  -5.447  -2.568   4.964
   55    HD3  LYS   5          2HD       LYS   5  -4.593  -2.618   3.403
   56    HE2  LYS   5          1HE       LYS   5  -4.873  -0.278   3.068
   57    HE3  LYS   5          2HE       LYS   5  -6.029  -0.155   4.414
   58    HZ1  LYS   5          1HZ       LYS   5  -3.855   0.651   5.035
   59    HZ2  LYS   5          2HZ       LYS   5  -4.235  -0.689   5.920
   60    HZ3  LYS   5          3HZ       LYS   5  -3.163  -0.802   4.672
   61    H    LEU   6           H        LEU   6  -8.183  -5.859   2.194
   62    HA   LEU   6           HA       LEU   6  -6.830  -8.423   2.334
   63    HB2  LEU   6          1HB       LEU   6  -8.488  -7.889   3.861
   64    HB3  LEU   6          2HB       LEU   6  -9.771  -7.585   2.667
   65    HG   LEU   6           HG       LEU   6  -9.475 -10.011   1.937
   66   HD11  LEU   6          1HD1      LEU   6  -8.484 -11.544   3.658
   67   HD12  LEU   6          2HD1      LEU   6  -7.275 -10.392   3.045
   68   HD13  LEU   6          3HD1      LEU   6  -8.030 -10.128   4.635
   69   HD21  LEU   6          1HD2      LEU   6 -10.889 -10.883   3.766
   70   HD22  LEU   6          2HD2      LEU   6 -10.481  -9.450   4.741
   71   HD23  LEU   6          3HD2      LEU   6 -11.391  -9.265   3.222
   72    H    VAL   7           H        VAL   7  -6.805  -9.945   0.720
   73    HA   VAL   7           HA       VAL   7  -7.411  -9.190  -1.898
   74    HB   VAL   7           HB       VAL   7  -7.131 -11.625  -2.413
   75   HG11  VAL   7          1HG1      VAL   7  -4.809 -11.832  -1.590
   76   HG12  VAL   7          2HG1      VAL   7  -5.139 -10.182  -2.168
   77   HG13  VAL   7          3HG1      VAL   7  -5.107 -10.523  -0.421
   78   HG21  VAL   7          1HG2      VAL   7  -6.618 -13.197  -0.614
   79   HG22  VAL   7          2HG2      VAL   7  -6.979 -11.937   0.589
   80   HG23  VAL   7          3HG2      VAL   7  -8.267 -12.544  -0.479
   81    HA   PRO   8           HA       PRO   8  -7.857 -10.348  -3.525
   82    HB2  PRO   8          1HB       PRO   8  -9.210 -10.142  -5.844
   83    HB3  PRO   8          2HB       PRO   8  -9.184 -11.693  -4.995
   84    HG2  PRO   8          1HG       PRO   8 -11.314  -9.536  -4.966
   85    HG3  PRO   8          2HG       PRO   8 -11.507 -11.290  -5.073
   86    HD2  PRO   8          1HD       PRO   8 -11.771  -9.873  -2.690
   87    HD3  PRO   8          2HD       PRO   8 -11.309 -11.579  -2.749
   88    H    ILE   9           H        ILE   9 -10.527  -8.069  -3.458
   89    HA   ILE   9           HA       ILE   9  -8.714  -6.164  -4.771
   90    HB   ILE   9           HB       ILE   9 -11.761  -6.381  -4.937
   91   HG12  ILE   9          1HG1      ILE   9 -10.697  -8.148  -6.140
   92   HG13  ILE   9          2HG1      ILE   9 -11.434  -6.968  -7.248
   93   HG21  ILE   9          1HG2      ILE   9 -11.565  -4.595  -6.634
   94   HG22  ILE   9          2HG2      ILE   9 -10.953  -4.048  -5.056
   95   HG23  ILE   9          3HG2      ILE   9  -9.813  -4.507  -6.341
   96   HD11  ILE   9          1HD1      ILE   9  -9.245  -7.724  -8.085
   97   HD12  ILE   9          2HD1      ILE   9  -9.216  -5.990  -7.685
   98   HD13  ILE   9          3HD1      ILE   9  -8.477  -7.172  -6.579
   99    H    ALA  10           H        ALA  10 -10.628  -6.947  -1.981
  100    HA   ALA  10           HA       ALA  10 -11.866  -4.686  -1.262
  101    HB1  ALA  10          1HB       ALA  10 -10.390  -5.816   1.002
  102    HB2  ALA  10          2HB       ALA  10 -12.137  -5.826   0.664
  103    HB3  ALA  10          3HB       ALA  10 -11.088  -7.079  -0.043
  104    H    TYR  11           H        TYR  11 -11.377  -2.640  -0.469
  105    HA   TYR  11           HA       TYR  11  -8.541  -2.001  -0.168
  106    HB2  TYR  11          1HB       TYR  11  -9.026  -0.066  -1.784
  107    HB3  TYR  11          2HB       TYR  11  -9.098  -1.653  -2.560
  108    HD1  TYR  11          1HD       TYR  11 -11.189  -2.538  -3.363
  109    HD2  TYR  11          2HD       TYR  11 -11.044   1.220  -1.368
  110    HE1  TYR  11          1HE       TYR  11 -13.553  -2.020  -4.182
  111    HE2  TYR  11          2HE       TYR  11 -13.401   1.754  -2.178
  112    HH   TYR  11           HH       TYR  11 -14.793   0.562  -4.565
  113    H    LYS  12           H        LYS  12  -8.205   0.215   0.730
  114    HA   LYS  12           HA       LYS  12 -10.600   1.179   2.126
  115    HB2  LYS  12          1HB       LYS  12  -7.806   0.671   3.157
  116    HB3  LYS  12          2HB       LYS  12  -8.908   1.822   3.952
  117    HG2  LYS  12          1HG       LYS  12 -10.555  -0.041   4.235
  118    HG3  LYS  12          2HG       LYS  12  -9.336  -1.161   3.582
  119    HD2  LYS  12          1HD       LYS  12  -7.805  -0.583   5.412
  120    HD3  LYS  12          2HD       LYS  12  -8.998   0.568   6.057
  121    HE2  LYS  12          1HE       LYS  12 -10.598  -1.304   6.355
  122    HE3  LYS  12          2HE       LYS  12  -9.345  -2.434   5.792
  123    HZ1  LYS  12          1HZ       LYS  12  -9.448  -2.343   8.189
  124    HZ2  LYS  12          2HZ       LYS  12  -7.995  -1.768   7.664
  125    HZ3  LYS  12          3HZ       LYS  12  -9.157  -0.720   8.185
  126    H    THR  13           H        THR  13 -10.422   3.504   2.781
  127    HA   THR  13           HA       THR  13  -9.293   4.953   0.548
  128    HB   THR  13           HB       THR  13 -10.885   5.883   2.989
  129    HG1  THR  13          1HG       THR  13 -12.606   5.959   1.425
  130   HG21  THR  13          1HG2      THR  13 -11.270   7.934   1.668
  131   HG22  THR  13          2HG2      THR  13  -9.534   7.685   1.971
  132   HG23  THR  13          3HG2      THR  13 -10.223   7.299   0.376
  133    H    CYS  14           H        CYS  14  -7.510   6.210   0.512
  134    HA   CYS  14           HA       CYS  14  -5.655   5.763   2.580
  135    HB2  CYS  14          1HB       CYS  14  -5.613   7.581   0.173
  136    HB3  CYS  14          2HB       CYS  14  -4.243   7.383   1.271
  137    HG   CYS  14           HG       CYS  14  -3.779   6.082  -0.968
  138    HA   PRO  15           HA       PRO  15  -6.453   9.352   5.005
  139    HB2  PRO  15          1HB       PRO  15  -4.101   9.785   6.266
  140    HB3  PRO  15          2HB       PRO  15  -5.077   8.375   6.696
  141    HG2  PRO  15          1HG       PRO  15  -2.734   8.554   4.768
  142    HG3  PRO  15          2HG       PRO  15  -3.045   7.351   6.027
  143    HD2  PRO  15          1HD       PRO  15  -3.658   6.873   3.388
  144    HD3  PRO  15          2HD       PRO  15  -4.612   6.173   4.701
  145    H    GLU  16           H        GLU  16  -6.149  11.645   5.203
  146    HA   GLU  16           HA       GLU  16  -5.664  12.743   2.733
  147    HB2  GLU  16          1HB       GLU  16  -6.999  13.784   4.497
  148    HB3  GLU  16          2HB       GLU  16  -5.538  13.996   5.493
  149    HG2  GLU  16          1HG       GLU  16  -4.641  15.622   3.757
  150    HG3  GLU  16          2HG       GLU  16  -6.123  15.254   2.846
  151    HE2  GLU  16           HE       GLU  16  -6.700  18.228   4.809
  152    H    GLY  17           H        GLY  17  -3.852  13.533   1.680
  153    HA2  GLY  17          1HA       GLY  17  -1.771  14.589   1.641
  154    HA3  GLY  17          2HA       GLY  17  -1.428  14.013   3.261
  155    H    LYS  18           H        LYS  18  -2.645  11.256   2.283
  156    HA   LYS  18           HA       LYS  18  -0.125  10.305   1.175
  157    HB2  LYS  18          1HB       LYS  18  -2.564   8.978   2.376
  158    HB3  LYS  18          2HB       LYS  18  -1.274   8.060   1.564
  159    HG2  LYS  18          1HG       LYS  18  -1.053   8.079   4.046
  160    HG3  LYS  18          2HG       LYS  18   0.351   8.778   3.204
  161    HD2  LYS  18          1HD       LYS  18  -0.369  11.015   3.695
  162    HD3  LYS  18          2HD       LYS  18  -1.937  10.435   4.305
  163    HE2  LYS  18          1HE       LYS  18  -0.403  11.047   6.136
  164    HE3  LYS  18          2HE       LYS  18  -0.846   9.325   6.172
  165    HZ1  LYS  18          1HZ       LYS  18   1.505   9.648   6.546
  166    HZ2  LYS  18          2HZ       LYS  18   1.264   8.829   5.134
  167    HZ3  LYS  18          3HZ       LYS  18   1.673  10.426   5.101
  168    H    ASN  19           H        ASN  19  -0.091   8.917  -0.738
  169    HA   ASN  19           HA       ASN  19  -2.315   9.559  -2.496
  170    HB2  ASN  19          1HB       ASN  19  -0.419  11.367  -2.860
  171    HB3  ASN  19          2HB       ASN  19   0.473   9.838  -3.048
  172   HD21  ASN  19          1HD2      ASN  19  -1.605  11.478  -6.110
  173   HD22  ASN  19          2HD2      ASN  19  -1.581  12.167  -4.521
  174    H    LEU  20           H        LEU  20   0.778   7.776  -1.864
  175    HA   LEU  20           HA       LEU  20   0.366   6.174  -4.238
  176    HB2  LEU  20          1HB       LEU  20   2.434   6.117  -2.125
  177    HB3  LEU  20          2HB       LEU  20   2.685   5.340  -3.705
  178    HG   LEU  20           HG       LEU  20   2.491   8.325  -3.145
  179   HD11  LEU  20          1HD1      LEU  20   4.867   8.347  -3.953
  180   HD12  LEU  20          2HD1      LEU  20   4.679   7.302  -2.525
  181   HD13  LEU  20          3HD1      LEU  20   4.800   6.580  -4.147
  182   HD21  LEU  20          1HD2      LEU  20   2.969   8.623  -5.551
  183   HD22  LEU  20          2HD2      LEU  20   2.861   6.860  -5.772
  184   HD23  LEU  20          3HD2      LEU  20   1.430   7.782  -5.255
  185    H    CYS  21           H        CYS  21   0.369   3.818  -4.196
  186    HA   CYS  21           HA       CYS  21  -0.624   2.799  -1.637
  187    HB2  CYS  21          1HB       CYS  21  -1.129   1.860  -4.461
  188    HB3  CYS  21          2HB       CYS  21  -1.608   0.954  -3.023
  189    HG   CYS  21           HG       CYS  21  -3.727   2.081  -4.109
  190    H    TYR  22           H        TYR  22   0.610   1.221  -0.618
  191    HA   TYR  22           HA       TYR  22   2.894   0.189  -2.162
  192    HB2  TYR  22          1HB       TYR  22   4.284   0.438  -0.297
  193    HB3  TYR  22          2HB       TYR  22   3.428   1.984  -0.511
  194    HD1  TYR  22          1HD       TYR  22   3.726  -1.034   1.603
  195    HD2  TYR  22          2HD       TYR  22   1.860   2.775   1.153
  196    HE1  TYR  22          1HE       TYR  22   2.948  -1.146   3.952
  197    HE2  TYR  22          2HE       TYR  22   1.075   2.678   3.495
  198    HH   TYR  22           HH       TYR  22   1.031   1.474   5.428
  199    H    LYS  23           H        LYS  23   3.728  -1.923  -1.443
  200    HA   LYS  23           HA       LYS  23   1.967  -3.313   0.437
  201    HB2  LYS  23          1HB       LYS  23   2.258  -5.366  -0.925
  202    HB3  LYS  23          2HB       LYS  23   1.306  -4.100  -1.736
  203    HG2  LYS  23          1HG       LYS  23   3.186  -3.509  -3.141
  204    HG3  LYS  23          2HG       LYS  23   4.249  -4.628  -2.255
  205    HD2  LYS  23          1HD       LYS  23   3.466  -5.539  -4.439
  206    HD3  LYS  23          2HD       LYS  23   2.993  -6.537  -3.043
  207    HE2  LYS  23          1HE       LYS  23   0.757  -5.582  -3.071
  208    HE3  LYS  23          2HE       LYS  23   1.215  -4.485  -4.394
  209    HZ1  LYS  23          1HZ       LYS  23   0.018  -6.403  -5.202
  210    HZ2  LYS  23          2HZ       LYS  23   1.561  -6.412  -5.785
  211    HZ3  LYS  23          3HZ       LYS  23   1.136  -7.430  -4.558
  212    H    MET  24           H        MET  24   3.032  -4.828   1.792
  213    HA   MET  24           HA       MET  24   5.926  -4.484   1.713
  214    HB2  MET  24          1HB       MET  24   4.002  -5.066   3.970
  215    HB3  MET  24          2HB       MET  24   5.772  -5.123   4.145
  216    HG2  MET  24          1HG       MET  24   5.810  -2.714   3.375
  217    HG3  MET  24          2HG       MET  24   4.037  -2.719   3.525
  218    HE1  MET  24          1HE       MET  24   3.382  -2.951   7.299
  219    HE2  MET  24          2HE       MET  24   2.742  -2.493   5.703
  220    HE3  MET  24          3HE       MET  24   3.216  -4.179   6.022
  221    H    PHE  25           H        PHE  25   7.290  -6.290   1.694
  222    HA   PHE  25           HA       PHE  25   5.927  -8.888   1.817
  223    HB2  PHE  25          1HB       PHE  25   8.568  -7.954   0.551
  224    HB3  PHE  25          2HB       PHE  25   7.969  -9.615   0.474
  225    HD1  PHE  25          1HD       PHE  25   6.337 -10.235  -1.117
  226    HD2  PHE  25          2HD       PHE  25   7.366  -6.152  -0.651
  227    HE1  PHE  25          1HE       PHE  25   5.092  -9.680  -3.238
  228    HE2  PHE  25          2HE       PHE  25   6.126  -5.592  -2.762
  229    HZ   PHE  25           HZ       PHE  25   5.004  -7.363  -4.031
  230    H    MET  26           H        MET  26   7.444 -10.712   2.634
  231    HA   MET  26           HA       MET  26   9.270  -9.611   4.632
  232    HB2  MET  26          1HB       MET  26   7.668 -12.178   4.607
  233    HB3  MET  26          2HB       MET  26   8.929 -11.805   5.807
  234    HG2  MET  26          1HG       MET  26   7.642  -9.850   6.551
  235    HG3  MET  26          2HG       MET  26   6.380 -10.223   5.354
  236    HE1  MET  26          1HE       MET  26   4.703 -11.089   8.840
  237    HE2  MET  26          2HE       MET  26   5.887  -9.796   8.531
  238    HE3  MET  26          3HE       MET  26   4.582 -10.107   7.361
  239    H    MET  27           H        MET  27  11.364 -10.582   4.843
  240    HA   MET  27           HA       MET  27  12.541 -11.527   2.576
  241    HB2  MET  27          1HB       MET  27  13.187 -11.800   5.504
  242    HB3  MET  27          2HB       MET  27  14.265 -12.456   4.249
  243    HG2  MET  27          1HG       MET  27  13.432  -9.552   4.542
  244    HG3  MET  27          2HG       MET  27  14.997 -10.237   5.040
  245    HE1  MET  27          1HE       MET  27  16.694 -11.151   1.666
  246    HE2  MET  27          2HE       MET  27  16.899 -10.953   3.424
  247    HE3  MET  27          3HE       MET  27  15.809 -12.211   2.789
  248    H    SER  28           H        SER  28  10.602 -13.255   4.981
  249    HA   SER  28           HA       SER  28  11.298 -15.827   4.131
  250    HB2  SER  28          1HB       SER  28  10.107 -15.391   6.209
  251    HB3  SER  28          2HB       SER  28   8.729 -14.717   5.307
  252    HG   SER  28           HG       SER  28   8.396 -16.891   5.943
  253    H    ASP  29           H        ASP  29   8.279 -13.898   3.433
  254    HA   ASP  29           HA       ASP  29   7.999 -15.540   1.056
  255    HB2  ASP  29          1HB       ASP  29   6.096 -15.563   2.756
  256    HB3  ASP  29          2HB       ASP  29   6.075 -13.806   2.463
  257    HD2  ASP  29           HD       ASP  29   3.579 -15.465   0.358
  258    H    LEU  30           H        LEU  30   9.357 -14.298  -0.398
  259    HA   LEU  30           HA       LEU  30   8.882 -11.482  -0.699
  260    HB2  LEU  30          1HB       LEU  30  10.621 -13.530  -2.014
  261    HB3  LEU  30          2HB       LEU  30  10.405 -11.930  -2.748
  262    HG   LEU  30           HG       LEU  30  12.374 -11.730  -1.532
  263   HD11  LEU  30          1HD1      LEU  30  10.920 -10.766   0.802
  264   HD12  LEU  30          2HD1      LEU  30  11.869  -9.873  -0.410
  265   HD13  LEU  30          3HD1      LEU  30  10.161 -10.260  -0.725
  266   HD21  LEU  30          1HD2      LEU  30  11.442 -12.754   1.082
  267   HD22  LEU  30          2HD2      LEU  30  11.633 -13.967  -0.205
  268   HD23  LEU  30          3HD2      LEU  30  13.008 -12.938   0.261
  269    H    THR  31           H        THR  31   7.582 -14.501  -1.950
  270    HA   THR  31           HA       THR  31   6.962 -13.546  -4.544
  271    HB   THR  31           HB       THR  31   5.803 -15.861  -2.914
  272    HG1  THR  31          1HG       THR  31   7.310 -17.075  -4.206
  273   HG21  THR  31          1HG2      THR  31   5.110 -16.768  -5.105
  274   HG22  THR  31          2HG2      THR  31   4.338 -15.194  -4.790
  275   HG23  THR  31          3HG2      THR  31   5.720 -15.299  -5.905
  276    H    ILE  32           H        ILE  32   5.160 -13.676  -1.442
  277    HA   ILE  32           HA       ILE  32   3.017 -12.204  -2.806
  278    HB   ILE  32           HB       ILE  32   2.797 -14.437  -0.732
  279   HG12  ILE  32          1HG1      ILE  32   3.075 -15.175  -3.012
  280   HG13  ILE  32          2HG1      ILE  32   1.470 -15.572  -2.353
  281   HG21  ILE  32          1HG2      ILE  32   0.364 -14.004  -0.769
  282   HG22  ILE  32          2HG2      ILE  32   1.257 -12.587  -0.171
  283   HG23  ILE  32          3HG2      ILE  32   0.629 -12.605  -1.835
  284   HD11  ILE  32          1HD1      ILE  32   1.309 -14.817  -4.692
  285   HD12  ILE  32          2HD1      ILE  32   0.492 -13.680  -3.592
  286   HD13  ILE  32          3HD1      ILE  32   2.096 -13.284  -4.252
  287    HA   PRO  33           HA       PRO  33   3.900  -9.369   0.377
  288    HB2  PRO  33          1HB       PRO  33   2.013  -7.480  -0.177
  289    HB3  PRO  33          2HB       PRO  33   3.454  -7.631  -1.190
  290    HG2  PRO  33          1HG       PRO  33   0.689  -8.809  -1.620
  291    HG3  PRO  33          2HG       PRO  33   1.743  -7.994  -2.784
  292    HD2  PRO  33          1HD       PRO  33   1.587 -10.730  -2.669
  293    HD3  PRO  33          2HD       PRO  33   3.094  -9.917  -3.107
  294    H    VAL  34           H        VAL  34   2.911  -8.336   2.325
  295    HA   VAL  34           HA       VAL  34   1.094 -10.434   3.288
  296    HB   VAL  34           HB       VAL  34   2.225 -10.206   5.475
  297   HG11  VAL  34          1HG1      VAL  34   4.421 -11.161   4.858
  298   HG12  VAL  34          2HG1      VAL  34   3.119 -11.852   3.861
  299   HG13  VAL  34          3HG1      VAL  34   4.193 -10.604   3.183
  300   HG21  VAL  34          1HG2      VAL  34   4.247  -8.855   5.714
  301   HG22  VAL  34          2HG2      VAL  34   4.013  -8.215   4.071
  302   HG23  VAL  34          3HG2      VAL  34   2.819  -7.861   5.343
  303    H    LYS  35           H        LYS  35   1.895  -6.989   3.099
  304    HA   LYS  35           HA       LYS  35  -0.704  -6.395   4.243
  305    HB2  LYS  35          1HB       LYS  35   1.961  -5.467   5.319
  306    HB3  LYS  35          2HB       LYS  35   0.484  -4.495   5.529
  307    HG2  LYS  35          1HG       LYS  35  -0.539  -6.611   6.578
  308    HG3  LYS  35          2HG       LYS  35   1.130  -7.224   6.665
  309    HD2  LYS  35          1HD       LYS  35   0.734  -6.227   8.772
  310    HD3  LYS  35          2HD       LYS  35   1.706  -5.042   7.867
  311    HE2  LYS  35          1HE       LYS  35  -0.219  -3.711   7.379
  312    HE3  LYS  35          2HE       LYS  35  -1.318  -4.969   7.990
  313    HZ1  LYS  35          1HZ       LYS  35  -1.028  -3.192   9.580
  314    HZ2  LYS  35          2HZ       LYS  35  -0.415  -4.600  10.185
  315    HZ3  LYS  35          3HZ       LYS  35   0.604  -3.433   9.618
  316    H    ARG  36           H        ARG  36  -1.579  -4.419   3.478
  317    HA   ARG  36           HA       ARG  36   0.166  -2.928   1.714
  318    HB2  ARG  36          1HB       ARG  36  -2.564  -3.862   0.919
  319    HB3  ARG  36          2HB       ARG  36  -1.536  -2.724   0.017
  320    HG2  ARG  36          1HG       ARG  36  -1.067  -4.671  -1.109
  321    HG3  ARG  36          2HG       ARG  36   0.202  -4.708   0.138
  322    HD2  ARG  36          1HD       ARG  36  -0.795  -6.865  -0.145
  323    HD3  ARG  36          2HD       ARG  36  -1.158  -6.206   1.467
  324    HE   ARG  36           HE       ARG  36  -3.540  -6.236   0.815
  325   HH11  ARG  36          1HH1      ARG  36  -1.543  -6.792  -1.988
  326   HH12  ARG  36          2HH1      ARG  36  -2.955  -7.280  -2.905
  327   HH21  ARG  36          1HH2      ARG  36  -5.168  -6.784  -0.223
  328   HH22  ARG  36          2HH2      ARG  36  -5.023  -7.275  -1.900
  329    H    GLY  37           H        GLY  37  -0.685  -0.677   1.282
  330    HA2  GLY  37          1HA       GLY  37  -2.858   0.367   2.776
  331    HA3  GLY  37          2HA       GLY  37  -1.358   0.573   3.662
  332    H    CYS  38           H        CYS  38  -2.182   2.940   3.188
  333    HA   CYS  38           HA       CYS  38  -1.178   3.767   0.570
  334    HB2  CYS  38          1HB       CYS  38  -2.835   5.168   2.800
  335    HB3  CYS  38          2HB       CYS  38  -2.666   5.764   1.131
  336    HG   CYS  38           HG       CYS  38  -5.087   4.993   1.558
  337    H    ILE  39           H        ILE  39   0.364   5.589   0.516
  338    HA   ILE  39           HA       ILE  39   1.082   6.823   2.989
  339    HB   ILE  39           HB       ILE  39   2.548   4.727   2.927
  340   HG12  ILE  39          1HG1      ILE  39   4.201   7.203   2.661
  341   HG13  ILE  39          2HG1      ILE  39   3.047   6.993   3.998
  342   HG21  ILE  39          1HG2      ILE  39   4.431   4.741   1.326
  343   HG22  ILE  39          2HG2      ILE  39   2.871   4.647   0.478
  344   HG23  ILE  39          3HG2      ILE  39   3.756   6.189   0.543
  345   HD11  ILE  39          1HD1      ILE  39   5.319   6.320   4.671
  346   HD12  ILE  39          2HD1      ILE  39   4.209   4.929   4.679
  347   HD13  ILE  39          3HD1      ILE  39   5.364   5.139   3.342
  348    H    ASP  40           H        ASP  40   2.652   8.657   2.583
  349    HA   ASP  40           HA       ASP  40   1.906   9.814   0.069
  350    HB2  ASP  40          1HB       ASP  40   2.912  11.933   1.093
  351    HB3  ASP  40          2HB       ASP  40   1.592  11.058   1.910
  352    HD2  ASP  40           HD       ASP  40   4.355  11.906   4.230
  353    H    VAL  41           H        VAL  41   4.875   8.983   1.991
  354    HA   VAL  41           HA       VAL  41   6.439   9.281  -0.480
  355    HB   VAL  41           HB       VAL  41   7.326   9.526   2.433
  356   HG11  VAL  41          1HG1      VAL  41   9.507  10.191   1.476
  357   HG12  VAL  41          2HG1      VAL  41   9.069   8.537   0.987
  358   HG13  VAL  41          3HG1      VAL  41   8.882   9.885  -0.161
  359   HG21  VAL  41          1HG2      VAL  41   7.751  11.872   1.898
  360   HG22  VAL  41          2HG2      VAL  41   7.064  11.626   0.275
  361   HG23  VAL  41          3HG2      VAL  41   6.034  11.447   1.716
  362    H    CYS  42           H        CYS  42   7.505   7.497  -1.249
  363    HA   CYS  42           HA       CYS  42   6.622   5.037  -0.206
  364    HB2  CYS  42          1HB       CYS  42   6.963   5.439  -2.588
  365    HB3  CYS  42          2HB       CYS  42   8.701   5.620  -2.325
  366    HG   CYS  42           HG       CYS  42   8.218   3.329  -3.530
  367    HA   PRO  43           HA       PRO  43   9.915   4.689   2.682
  368    HB2  PRO  43          1HB       PRO  43   9.247   2.295   3.813
  369    HB3  PRO  43          2HB       PRO  43   8.363   3.770   4.227
  370    HG2  PRO  43          1HG       PRO  43   7.664   1.636   2.187
  371    HG3  PRO  43          2HG       PRO  43   6.613   2.442   3.359
  372    HD2  PRO  43          1HD       PRO  43   6.688   3.225   0.731
  373    HD3  PRO  43          2HD       PRO  43   6.399   4.393   2.026
  374    H    LYS  44           H        LYS  44  11.997   3.985   2.714
  375    HA   LYS  44           HA       LYS  44  12.752   2.471   0.439
  376    HB2  LYS  44          1HB       LYS  44  14.220   3.317   2.955
  377    HB3  LYS  44          2HB       LYS  44  14.995   2.511   1.571
  378    HG2  LYS  44          1HG       LYS  44  14.397   4.404   0.123
  379    HG3  LYS  44          2HG       LYS  44  13.600   5.208   1.496
  380    HD2  LYS  44          1HD       LYS  44  15.729   5.332   2.692
  381    HD3  LYS  44          2HD       LYS  44  16.541   4.461   1.370
  382    HE2  LYS  44          1HE       LYS  44  15.990   6.288  -0.177
  383    HE3  LYS  44          2HE       LYS  44  15.174   7.160   1.140
  384    HZ1  LYS  44          1HZ       LYS  44  17.409   7.966   0.791
  385    HZ2  LYS  44          2HZ       LYS  44  17.284   7.275   2.283
  386    HZ3  LYS  44          3HZ       LYS  44  18.040   6.467   1.061
  387    H    ASN  45           H        ASN  45  14.100   0.424   0.606
  388    HA   ASN  45           HA       ASN  45  12.400  -1.444   1.821
  389    HB2  ASN  45          1HB       ASN  45  15.057  -2.021   0.314
  390    HB3  ASN  45          2HB       ASN  45  13.838  -3.007   1.157
  391   HD21  ASN  45          1HD2      ASN  45  13.244  -2.476  -2.594
  392   HD22  ASN  45          2HD2      ASN  45  14.721  -2.697  -1.715
  393    H    SER  46           H        SER  46  12.850  -2.845   3.643
  394    HA   SER  46           HA       SER  46  15.151  -1.995   5.212
  395    HB2  SER  46          1HB       SER  46  13.927  -2.810   7.156
  396    HB3  SER  46          2HB       SER  46  12.925  -1.668   6.230
  397    HG   SER  46           HG       SER  46  11.875  -3.483   5.315
  398    H    LEU  47           H        LEU  47  15.804  -3.988   6.822
  399    HA   LEU  47           HA       LEU  47  16.777  -5.968   5.005
  400    HB2  LEU  47          1HB       LEU  47  16.863  -5.561   7.930
  401    HB3  LEU  47          2HB       LEU  47  17.833  -6.865   7.209
  402    HG   LEU  47           HG       LEU  47  18.158  -3.878   6.722
  403   HD11  LEU  47          1HD1      LEU  47  20.373  -4.207   7.853
  404   HD12  LEU  47          2HD1      LEU  47  19.025  -4.641   8.931
  405   HD13  LEU  47          3HD1      LEU  47  19.965  -5.917   8.122
  406   HD21  LEU  47          1HD2      LEU  47  20.139  -4.509   5.387
  407   HD22  LEU  47          2HD2      LEU  47  19.719  -6.225   5.607
  408   HD23  LEU  47          3HD2      LEU  47  18.623  -5.148   4.709
  409    H    LEU  48           H        LEU  48  14.014  -5.591   7.117
  410    HA   LEU  48           HA       LEU  48  13.725  -8.475   7.393
  411    HB2  LEU  48          1HB       LEU  48  12.316  -6.106   8.456
  412    HB3  LEU  48          2HB       LEU  48  11.803  -7.732   8.965
  413    HG   LEU  48           HG       LEU  48  14.477  -6.395   9.535
  414   HD11  LEU  48          1HD1      LEU  48  13.733  -6.564  11.925
  415   HD12  LEU  48          2HD1      LEU  48  12.596  -5.591  10.962
  416   HD13  LEU  48          3HD1      LEU  48  12.195  -7.274  11.380
  417   HD21  LEU  48          1HD2      LEU  48  15.005  -8.420  10.848
  418   HD22  LEU  48          2HD2      LEU  48  13.493  -9.165  10.275
  419   HD23  LEU  48          3HD2      LEU  48  14.782  -8.763   9.116
  420    H    VAL  49           H        VAL  49  11.943  -5.555   6.204
  421    HA   VAL  49           HA       VAL  49  10.288  -7.403   4.631
  422    HB   VAL  49           HB       VAL  49   8.421  -5.729   4.928
  423   HG11  VAL  49          1HG1      VAL  49   7.844  -6.398   7.237
  424   HG12  VAL  49          2HG1      VAL  49   8.513  -7.768   6.320
  425   HG13  VAL  49          3HG1      VAL  49   9.526  -6.913   7.508
  426   HG21  VAL  49          1HG2      VAL  49   8.565  -4.093   6.737
  427   HG22  VAL  49          2HG2      VAL  49  10.273  -4.525   6.990
  428   HG23  VAL  49          3HG2      VAL  49   9.760  -3.780   5.457
  429    H    LYS  50           H        LYS  50   9.671  -6.655   2.537
  430    HA   LYS  50           HA       LYS  50  11.387  -4.479   1.597
  431    HB2  LYS  50          1HB       LYS  50  11.649  -6.650   0.501
  432    HB3  LYS  50          2HB       LYS  50   9.905  -6.693   0.148
  433    HG2  LYS  50          1HG       LYS  50  10.154  -4.727  -1.317
  434    HG3  LYS  50          2HG       LYS  50  11.899  -4.692  -0.969
  435    HD2  LYS  50          1HD       LYS  50  12.142  -6.938  -1.949
  436    HD3  LYS  50          2HD       LYS  50  10.396  -6.973  -2.297
  437    HE2  LYS  50          1HE       LYS  50  10.660  -4.989  -3.744
  438    HE3  LYS  50          2HE       LYS  50  12.409  -5.000  -3.421
  439    HZ1  LYS  50          1HZ       LYS  50  11.881  -6.073  -5.503
  440    HZ2  LYS  50          2HZ       LYS  50  12.518  -7.170  -4.448
  441    HZ3  LYS  50          3HZ       LYS  50  10.896  -7.158  -4.747
  442    H    TYR  51           H        TYR  51  10.533  -2.744   0.365
  443    HA   TYR  51           HA       TYR  51   7.619  -2.466   0.675
  444    HB2  TYR  51          1HB       TYR  51   9.839  -0.425   0.776
  445    HB3  TYR  51          2HB       TYR  51   8.105  -0.026   0.708
  446    HD1  TYR  51          1HD       TYR  51  10.827  -1.328   2.809
  447    HD2  TYR  51          2HD       TYR  51   6.659  -0.443   2.638
  448    HE1  TYR  51          1HE       TYR  51  10.691  -1.526   5.275
  449    HE2  TYR  51          2HE       TYR  51   6.506  -0.637   5.097
  450    HH   TYR  51           HH       TYR  51   9.355  -1.414   7.108
  451    H    VAL  52           H        VAL  52   6.481  -2.378  -1.200
  452    HA   VAL  52           HA       VAL  52   7.830  -1.098  -3.473
  453    HB   VAL  52           HB       VAL  52   5.801  -3.383  -3.549
  454   HG11  VAL  52          1HG1      VAL  52   6.175  -3.326  -5.993
  455   HG12  VAL  52          2HG1      VAL  52   5.513  -1.781  -5.409
  456   HG13  VAL  52          3HG1      VAL  52   7.245  -1.917  -5.796
  457   HG21  VAL  52          1HG2      VAL  52   7.611  -4.699  -4.530
  458   HG22  VAL  52          2HG2      VAL  52   8.733  -3.339  -4.281
  459   HG23  VAL  52          3HG2      VAL  52   7.998  -4.156  -2.880
  460    H    CYS  53           H        CYS  53   6.776   0.651  -4.307
  461    HA   CYS  53           HA       CYS  53   4.036   1.051  -3.345
  462    HB2  CYS  53          1HB       CYS  53   5.953   3.268  -4.020
  463    HB3  CYS  53          2HB       CYS  53   4.408   3.374  -3.171
  464    HG   CYS  53           HG       CYS  53   6.372   3.938  -1.512
  465    H    CYS  54           H        CYS  54   2.688   2.403  -4.908
  466    HA   CYS  54           HA       CYS  54   3.769   2.816  -7.517
  467    HB2  CYS  54          1HB       CYS  54   1.858   1.501  -8.593
  468    HB3  CYS  54          2HB       CYS  54   3.288   0.623  -8.046
  469    HG   CYS  54           HG       CYS  54   1.142  -0.851  -7.656
  470    H    ASN  55           H        ASN  55   2.090   4.087  -8.863
  471    HA   ASN  55           HA       ASN  55   1.069   5.837  -6.782
  472    HB2  ASN  55          1HB       ASN  55   1.811   7.768  -8.262
  473    HB3  ASN  55          2HB       ASN  55   2.890   6.396  -7.904
  474   HD21  ASN  55          1HD2      ASN  55   3.109   7.448 -11.496
  475   HD22  ASN  55          2HD2      ASN  55   3.185   8.306  -9.993
  476    H    THR  56           H        THR  56  -0.548   3.656  -7.938
  477    HA   THR  56           HA       THR  56  -2.713   5.353  -8.938
  478    HB   THR  56           HB       THR  56  -3.396   3.431 -10.449
  479    HG1  THR  56          1HG       THR  56  -0.725   2.560  -9.901
  480   HG21  THR  56          1HG2      THR  56  -1.792   3.967 -12.249
  481   HG22  THR  56          2HG2      THR  56  -2.280   5.435 -11.368
  482   HG23  THR  56          3HG2      THR  56  -0.693   4.695 -11.053
  483    H    ASP  57           H        ASP  57  -4.855   3.960  -8.905
  484    HA   ASP  57           HA       ASP  57  -5.036   3.473  -6.122
  485    HB2  ASP  57          1HB       ASP  57  -7.135   3.546  -8.354
  486    HB3  ASP  57          2HB       ASP  57  -7.373   3.031  -6.666
  487    HD2  ASP  57           HD       ASP  57  -7.315   6.833  -7.421
  488    H    ARG  58           H        ARG  58  -5.487   1.441  -5.095
  489    HA   ARG  58           HA       ARG  58  -5.478  -0.709  -4.829
  490    HB2  ARG  58          1HB       ARG  58  -7.094  -0.670  -7.419
  491    HB3  ARG  58          2HB       ARG  58  -7.024  -2.048  -6.307
  492    HG2  ARG  58          1HG       ARG  58  -8.128  -0.819  -4.575
  493    HG3  ARG  58          2HG       ARG  58  -7.903   0.728  -5.413
  494    HD2  ARG  58          1HD       ARG  58  -9.293  -0.647  -7.312
  495    HD3  ARG  58          2HD       ARG  58  -9.940  -1.421  -5.857
  496    HE   ARG  58           HE       ARG  58  -9.923   1.420  -5.486
  497   HH11  ARG  58          1HH1      ARG  58 -13.202   1.973  -6.510
  498   HH12  ARG  58          2HH1      ARG  58 -11.819   2.620  -5.654
  499   HH21  ARG  58          1HH2      ARG  58 -13.091  -0.134  -7.481
  500   HH22  ARG  58          2HH2      ARG  58 -11.632  -1.058  -7.354
  501    H    CYS  59           H        CYS  59  -3.182   0.364  -6.284
  502    HA   CYS  59           HA       CYS  59  -2.749  -1.302  -8.571
  503    HB2  CYS  59          1HB       CYS  59  -0.649  -0.142  -8.786
  504    HB3  CYS  59          2HB       CYS  59  -1.970   1.003  -8.549
  505    HG   CYS  59           HG       CYS  59   0.215   1.913  -7.394
  506    H    ASN  60           H        ASN  60  -2.034  -1.244  -5.100
  507    HA   ASN  60           HA       ASN  60  -0.031  -3.274  -5.358
  508    HB2  ASN  60          1HB       ASN  60  -0.094  -3.195  -2.818
  509    HB3  ASN  60          2HB       ASN  60   0.262  -1.634  -3.569
  510   HD21  ASN  60          1HD2      ASN  60  -0.436  -0.951  -1.382
  511   HD22  ASN  60          2HD2      ASN  60  -2.114  -0.620  -1.110
  Start of MODEL    7
    1    H1   MET   0          1H        MET   0  -9.834  10.361   0.631
    2    H2   MET   0          2H        MET   0 -10.633  11.047  -0.438
    3    H    MET   0           H        MET   0 -10.539   9.528  -0.425
    4    H3   MET   0          3H        MET   0 -10.552   9.550  -0.405
    5    HA   MET   0           HA       MET   0  -8.884  11.259  -1.843
    6    HB2  MET   0          1HB       MET   0  -7.447   9.655   0.286
    7    HB3  MET   0          2HB       MET   0  -6.650  10.530  -1.044
    8    HG2  MET   0          1HG       MET   0  -8.370  11.817   1.098
    9    HG3  MET   0          2HG       MET   0  -6.593  11.737   1.143
   10    HE1  MET   0          1HE       MET   0  -5.509  14.021  -1.803
   11    HE2  MET   0          2HE       MET   0  -4.995  13.132  -0.348
   12    HE3  MET   0          3HE       MET   0  -5.635  12.246  -1.754
   13    H    LEU   1           H        LEU   1  -6.618   9.299  -2.199
   14    HA   LEU   1           HA       LEU   1  -7.908   7.633  -4.095
   15    HB2  LEU   1          1HB       LEU   1  -5.220   7.680  -2.869
   16    HB3  LEU   1          2HB       LEU   1  -5.518   6.670  -4.302
   17    HG   LEU   1           HG       LEU   1  -5.554   9.706  -4.126
   18   HD11  LEU   1          1HD1      LEU   1  -3.729   9.523  -5.839
   19   HD12  LEU   1          2HD1      LEU   1  -3.298   8.665  -4.341
   20   HD13  LEU   1          3HD1      LEU   1  -3.857   7.749  -5.762
   21   HD21  LEU   1          1HD2      LEU   1  -6.120   9.693  -6.531
   22   HD22  LEU   1          2HD2      LEU   1  -6.298   7.922  -6.461
   23   HD23  LEU   1          3HD2      LEU   1  -7.392   8.965  -5.521
   24    H    LYS   2           H        LYS   2  -6.911   5.136  -4.001
   25    HA   LYS   2           HA       LYS   2  -7.755   4.125  -1.384
   26    HB2  LYS   2          1HB       LYS   2  -8.669   3.001  -4.041
   27    HB3  LYS   2          2HB       LYS   2  -9.209   2.530  -2.412
   28    HG2  LYS   2          1HG       LYS   2 -10.277   4.733  -2.131
   29    HG3  LYS   2          2HG       LYS   2  -9.746   5.195  -3.766
   30    HD2  LYS   2          1HD       LYS   2 -11.058   3.315  -4.703
   31    HD3  LYS   2          2HD       LYS   2 -11.621   2.910  -3.064
   32    HE2  LYS   2          1HE       LYS   2 -13.350   4.186  -4.106
   33    HE3  LYS   2          2HE       LYS   2 -12.564   5.233  -2.901
   34    HZ1  LYS   2          1HZ       LYS   2 -12.932   6.386  -4.976
   35    HZ2  LYS   2          2HZ       LYS   2 -11.313   6.241  -4.687
   36    HZ3  LYS   2          3HZ       LYS   2 -12.043   5.270  -5.804
   37    H    CYS   3           H        CYS   3  -6.638   2.311  -0.686
   38    HA   CYS   3           HA       CYS   3  -4.880   1.090  -2.688
   39    HB2  CYS   3          1HB       CYS   3  -4.336   1.514   0.253
   40    HB3  CYS   3          2HB       CYS   3  -3.322   0.562  -0.834
   41    HG   CYS   3           HG       CYS   3  -2.131   2.843  -0.280
   42    H    ASN   4           H        ASN   4  -4.451  -1.287  -2.195
   43    HA   ASN   4           HA       ASN   4  -6.975  -2.444  -1.548
   44    HB2  ASN   4          1HB       ASN   4  -4.446  -3.860  -2.665
   45    HB3  ASN   4          2HB       ASN   4  -6.020  -4.412  -2.043
   46   HD21  ASN   4          1HD2      ASN   4  -5.863  -3.725  -5.814
   47   HD22  ASN   4          2HD2      ASN   4  -4.670  -4.392  -4.750
   48    H    LYS   5           H        LYS   5  -7.088  -4.379  -0.008
   49    HA   LYS   5           HA       LYS   5  -4.945  -4.390   1.981
   50    HB2  LYS   5          1HB       LYS   5  -7.924  -4.193   2.529
   51    HB3  LYS   5          2HB       LYS   5  -6.679  -4.518   3.758
   52    HG2  LYS   5          1HG       LYS   5  -6.722  -2.007   2.060
   53    HG3  LYS   5          2HG       LYS   5  -7.534  -2.125   3.639
   54    HD2  LYS   5          1HD       LYS   5  -5.419  -2.636   4.732
   55    HD3  LYS   5          2HD       LYS   5  -4.582  -2.648   3.162
   56    HE2  LYS   5          1HE       LYS   5  -4.819  -0.329   2.880
   57    HE3  LYS   5          2HE       LYS   5  -6.099  -0.220   4.110
   58    HZ1  LYS   5          1HZ       LYS   5  -4.008   0.630   4.925
   59    HZ2  LYS   5          2HZ       LYS   5  -4.445  -0.711   5.781
   60    HZ3  LYS   5          3HZ       LYS   5  -3.257  -0.811   4.640
   61    H    LEU   6           H        LEU   6  -8.196  -5.929   2.032
   62    HA   LEU   6           HA       LEU   6  -6.850  -8.503   2.094
   63    HB2  LEU   6          1HB       LEU   6  -8.418  -7.978   3.716
   64    HB3  LEU   6          2HB       LEU   6  -9.763  -7.647   2.599
   65    HG   LEU   6           HG       LEU   6  -9.532 -10.065   1.823
   66   HD11  LEU   6          1HD1      LEU   6  -8.458 -11.631   3.464
   67   HD12  LEU   6          2HD1      LEU   6  -7.275 -10.481   2.798
   68   HD13  LEU   6          3HD1      LEU   6  -7.936 -10.232   4.432
   69   HD21  LEU   6          1HD2      LEU   6 -10.846 -10.951   3.719
   70   HD22  LEU   6          2HD2      LEU   6 -10.370  -9.534   4.687
   71   HD23  LEU   6          3HD2      LEU   6 -11.364  -9.321   3.226
   72    H    VAL   7           H        VAL   7  -6.914 -10.004   0.462
   73    HA   VAL   7           HA       VAL   7  -7.663  -9.212  -2.108
   74    HB   VAL   7           HB       VAL   7  -7.395 -11.637  -2.673
   75   HG11  VAL   7          1HG1      VAL   7  -5.034 -11.847  -1.972
   76   HG12  VAL   7          2HG1      VAL   7  -5.398 -10.190  -2.507
   77   HG13  VAL   7          3HG1      VAL   7  -5.276 -10.559  -0.771
   78   HG21  VAL   7          1HG2      VAL   7  -6.785 -13.236  -0.928
   79   HG22  VAL   7          2HG2      VAL   7  -7.090 -11.996   0.312
   80   HG23  VAL   7          3HG2      VAL   7  -8.428 -12.592  -0.700
   81    HA   PRO   8           HA       PRO   8  -8.188 -10.355  -3.724
   82    HB2  PRO   8          1HB       PRO   8  -9.667 -10.129  -5.964
   83    HB3  PRO   8          2HB       PRO   8  -9.581 -11.691  -5.139
   84    HG2  PRO   8          1HG       PRO   8 -11.725  -9.556  -4.966
   85    HG3  PRO   8          2HG       PRO   8 -11.907 -11.312  -5.081
   86    HD2  PRO   8          1HD       PRO   8 -12.052  -9.920  -2.672
   87    HD3  PRO   8          2HD       PRO   8 -11.579 -11.620  -2.774
   88    H    ILE   9           H        ILE   9 -10.837  -8.084  -3.417
   89    HA   ILE   9           HA       ILE   9  -9.141  -6.152  -4.842
   90    HB   ILE   9           HB       ILE   9 -12.188  -6.411  -4.797
   91   HG12  ILE   9          1HG1      ILE   9 -11.181  -8.114  -6.131
   92   HG13  ILE   9          2HG1      ILE   9 -12.007  -6.910  -7.149
   93   HG21  ILE   9          1HG2      ILE   9 -12.147  -4.567  -6.444
   94   HG22  ILE   9          2HG2      ILE   9 -11.438  -4.057  -4.894
   95   HG23  ILE   9          3HG2      ILE   9 -10.380  -4.450  -6.269
   96   HD11  ILE   9          1HD1      ILE   9  -9.864  -7.602  -8.149
   97   HD12  ILE   9          2HD1      ILE   9  -9.835  -5.881  -7.693
   98   HD13  ILE   9          3HD1      ILE   9  -9.010  -7.086  -6.677
   99    H    ALA  10           H        ALA  10 -10.846  -6.990  -1.934
  100    HA   ALA  10           HA       ALA  10 -12.047  -4.740  -1.109
  101    HB1  ALA  10          1HB       ALA  10 -11.161  -7.153   0.028
  102    HB2  ALA  10          2HB       ALA  10 -10.464  -5.882   1.061
  103    HB3  ALA  10          3HB       ALA  10 -12.222  -5.943   0.785
  104    H    TYR  11           H        TYR  11 -11.506  -2.707  -0.328
  105    HA   TYR  11           HA       TYR  11  -8.653  -2.081  -0.178
  106    HB2  TYR  11          1HB       TYR  11  -9.184  -0.142  -1.748
  107    HB3  TYR  11          2HB       TYR  11  -9.395  -1.711  -2.534
  108    HD1  TYR  11          1HD       TYR  11 -11.098   1.229  -1.153
  109    HD2  TYR  11          2HD       TYR  11 -11.586  -2.487  -3.170
  110    HE1  TYR  11          1HE       TYR  11 -13.490   1.885  -1.770
  111    HE2  TYR  11          2HE       TYR  11 -13.974  -1.850  -3.791
  112    HH   TYR  11           HH       TYR  11 -15.495  -0.298  -3.742
  113    H    LYS  12           H        LYS  12  -8.266   0.137   0.719
  114    HA   LYS  12           HA       LYS  12 -10.583   1.112   2.229
  115    HB2  LYS  12          1HB       LYS  12  -7.752   0.578   3.139
  116    HB3  LYS  12          2HB       LYS  12  -8.803   1.742   3.978
  117    HG2  LYS  12          1HG       LYS  12 -10.451  -0.088   4.362
  118    HG3  LYS  12          2HG       LYS  12  -9.303  -1.232   3.626
  119    HD2  LYS  12          1HD       LYS  12  -7.651  -0.726   5.358
  120    HD3  LYS  12          2HD       LYS  12  -8.750   0.476   6.077
  121    HE2  LYS  12          1HE       LYS  12 -10.402  -1.321   6.493
  122    HE3  LYS  12          2HE       LYS  12  -9.248  -2.508   5.841
  123    HZ1  LYS  12          1HZ       LYS  12  -9.176  -2.421   8.240
  124    HZ2  LYS  12          2HZ       LYS  12  -7.737  -1.913   7.610
  125    HZ3  LYS  12          3HZ       LYS  12  -8.807  -0.813   8.215
  126    H    THR  13           H        THR  13 -10.379   3.435   2.853
  127    HA   THR  13           HA       THR  13  -9.328   4.861   0.567
  128    HB   THR  13           HB       THR  13 -10.853   5.809   3.042
  129    HG1  THR  13          1HG       THR  13 -12.616   5.869   1.523
  130   HG21  THR  13          1HG2      THR  13 -11.278   7.850   1.718
  131   HG22  THR  13          2HG2      THR  13  -9.534   7.607   1.977
  132   HG23  THR  13          3HG2      THR  13 -10.264   7.210   0.403
  133    H    CYS  14           H        CYS  14  -7.518   6.056   0.452
  134    HA   CYS  14           HA       CYS  14  -5.639   5.731   2.519
  135    HB2  CYS  14          1HB       CYS  14  -5.638   7.415   0.017
  136    HB3  CYS  14          2HB       CYS  14  -4.259   7.306   1.115
  137    HG   CYS  14           HG       CYS  14  -3.785   5.884  -1.049
  138    HA   PRO  15           HA       PRO  15  -6.469   9.402   4.788
  139    HB2  PRO  15          1HB       PRO  15  -4.117   9.903   6.033
  140    HB3  PRO  15          2HB       PRO  15  -5.091   8.510   6.521
  141    HG2  PRO  15          1HG       PRO  15  -2.746   8.613   4.591
  142    HG3  PRO  15          2HG       PRO  15  -3.055   7.464   5.899
  143    HD2  PRO  15          1HD       PRO  15  -3.662   6.871   3.284
  144    HD3  PRO  15          2HD       PRO  15  -4.621   6.228   4.623
  145    H    GLU  16           H        GLU  16  -6.200  11.702   4.887
  146    HA   GLU  16           HA       GLU  16  -5.648  12.735   2.405
  147    HB2  GLU  16          1HB       GLU  16  -7.016  13.830   4.111
  148    HB3  GLU  16          2HB       GLU  16  -5.578  14.058   5.135
  149    HG2  GLU  16          1HG       GLU  16  -4.629  15.633   3.379
  150    HG3  GLU  16          2HG       GLU  16  -6.094  15.253   2.445
  151    HE2  GLU  16           HE       GLU  16  -6.691  18.279   4.322
  152    H    GLY  17           H        GLY  17  -3.820  13.573   1.394
  153    HA2  GLY  17          1HA       GLY  17  -1.720  14.602   1.418
  154    HA3  GLY  17          2HA       GLY  17  -1.405  13.961   3.018
  155    H    LYS  18           H        LYS  18  -2.594  11.241   2.072
  156    HA   LYS  18           HA       LYS  18  -0.121  10.294   0.871
  157    HB2  LYS  18          1HB       LYS  18  -2.558   8.925   2.038
  158    HB3  LYS  18          2HB       LYS  18  -1.204   8.054   1.279
  159    HG2  LYS  18          1HG       LYS  18  -1.084   8.083   3.769
  160    HG3  LYS  18          2HG       LYS  18   0.326   8.831   2.982
  161    HD2  LYS  18          1HD       LYS  18  -1.717  10.820   3.413
  162    HD3  LYS  18          2HD       LYS  18  -1.391   9.962   4.937
  163    HE2  LYS  18          1HE       LYS  18   1.103  10.321   4.358
  164    HE3  LYS  18          2HE       LYS  18   0.511  11.531   3.197
  165    HZ1  LYS  18          1HZ       LYS  18   1.055  12.523   5.315
  166    HZ2  LYS  18          2HZ       LYS  18  -0.563  12.663   5.024
  167    HZ3  LYS  18          3HZ       LYS  18  -0.013  11.541   6.100
  168    H    ASN  19           H        ASN  19  -0.258   8.717  -0.982
  169    HA   ASN  19           HA       ASN  19  -2.427   9.373  -2.752
  170    HB2  ASN  19          1HB       ASN  19  -0.766  11.396  -3.045
  171    HB3  ASN  19          2HB       ASN  19   0.311   9.995  -3.257
  172   HD21  ASN  19          1HD2      ASN  19  -1.858  11.483  -6.322
  173   HD22  ASN  19          2HD2      ASN  19  -1.923  12.135  -4.719
  174    H    LEU  20           H        LEU  20   0.678   7.786  -1.949
  175    HA   LEU  20           HA       LEU  20   0.495   6.048  -4.267
  176    HB2  LEU  20          1HB       LEU  20   2.376   6.089  -1.990
  177    HB3  LEU  20          2HB       LEU  20   2.760   5.285  -3.530
  178    HG   LEU  20           HG       LEU  20   2.565   8.272  -2.990
  179   HD11  LEU  20          1HD1      LEU  20   4.959   8.255  -3.740
  180   HD12  LEU  20          2HD1      LEU  20   4.716   7.197  -2.331
  181   HD13  LEU  20          3HD1      LEU  20   4.862   6.493  -3.959
  182   HD21  LEU  20          1HD2      LEU  20   3.107   8.590  -5.379
  183   HD22  LEU  20          2HD2      LEU  20   2.968   6.832  -5.626
  184   HD23  LEU  20          3HD2      LEU  20   1.544   7.777  -5.131
  185    H    CYS  21           H        CYS  21   0.355   3.733  -4.106
  186    HA   CYS  21           HA       CYS  21  -0.607   2.835  -1.488
  187    HB2  CYS  21          1HB       CYS  21  -1.202   1.731  -4.234
  188    HB3  CYS  21          2HB       CYS  21  -1.728   1.002  -2.715
  189    HG   CYS  21           HG       CYS  21  -3.780   2.136  -3.911
  190    H    TYR  22           H        TYR  22   0.642   1.281  -0.454
  191    HA   TYR  22           HA       TYR  22   2.867   0.174  -2.033
  192    HB2  TYR  22          1HB       TYR  22   4.297   0.434  -0.192
  193    HB3  TYR  22          2HB       TYR  22   3.467   1.991  -0.434
  194    HD1  TYR  22          1HD       TYR  22   3.743  -0.975   1.754
  195    HD2  TYR  22          2HD       TYR  22   1.939   2.854   1.231
  196    HE1  TYR  22          1HE       TYR  22   3.000  -1.011   4.117
  197    HE2  TYR  22          2HE       TYR  22   1.191   2.835   3.587
  198    HH   TYR  22           HH       TYR  22   1.154   1.683   5.552
  199    H    LYS  23           H        LYS  23   3.711  -1.923  -1.263
  200    HA   LYS  23           HA       LYS  23   1.948  -3.271   0.643
  201    HB2  LYS  23          1HB       LYS  23   2.176  -5.339  -0.674
  202    HB3  LYS  23          2HB       LYS  23   1.301  -4.063  -1.554
  203    HG2  LYS  23          1HG       LYS  23   3.326  -3.560  -2.853
  204    HG3  LYS  23          2HG       LYS  23   4.214  -4.822  -1.966
  205    HD2  LYS  23          1HD       LYS  23   3.320  -5.464  -4.270
  206    HD3  LYS  23          2HD       LYS  23   2.924  -6.558  -2.925
  207    HE2  LYS  23          1HE       LYS  23   0.716  -5.526  -2.712
  208    HE3  LYS  23          2HE       LYS  23   1.109  -4.390  -4.023
  209    HZ1  LYS  23          1HZ       LYS  23  -0.203  -6.241  -4.813
  210    HZ2  LYS  23          2HZ       LYS  23   1.293  -6.270  -5.508
  211    HZ3  LYS  23          3HZ       LYS  23   0.929  -7.323  -4.292
  212    H    MET  24           H        MET  24   3.010  -4.863   1.957
  213    HA   MET  24           HA       MET  24   5.902  -4.475   1.912
  214    HB2  MET  24          1HB       MET  24   3.982  -5.061   4.176
  215    HB3  MET  24          2HB       MET  24   5.754  -5.058   4.348
  216    HG2  MET  24          1HG       MET  24   5.741  -2.668   3.577
  217    HG3  MET  24          2HG       MET  24   3.963  -2.713   3.654
  218    HE1  MET  24          1HE       MET  24   3.176  -2.969   7.415
  219    HE2  MET  24          2HE       MET  24   2.566  -2.568   5.790
  220    HE3  MET  24          3HE       MET  24   3.126  -4.220   6.150
  221    H    PHE  25           H        PHE  25   7.261  -6.272   1.870
  222    HA   PHE  25           HA       PHE  25   5.920  -8.876   2.063
  223    HB2  PHE  25          1HB       PHE  25   8.538  -7.935   0.755
  224    HB3  PHE  25          2HB       PHE  25   7.971  -9.609   0.726
  225    HD1  PHE  25          1HD       PHE  25   6.367 -10.307  -0.852
  226    HD2  PHE  25          2HD       PHE  25   7.258  -6.184  -0.463
  227    HE1  PHE  25          1HE       PHE  25   5.089  -9.830  -2.974
  228    HE2  PHE  25          2HE       PHE  25   5.990  -5.703  -2.576
  229    HZ   PHE  25           HZ       PHE  25   4.921  -7.531  -3.806
  230    H    MET  26           H        MET  26   7.374 -10.673   2.982
  231    HA   MET  26           HA       MET  26   9.413  -9.532   4.735
  232    HB2  MET  26          1HB       MET  26   7.841 -12.110   4.928
  233    HB3  MET  26          2HB       MET  26   9.201 -11.685   5.994
  234    HG2  MET  26          1HG       MET  26   7.958  -9.730   6.805
  235    HG3  MET  26          2HG       MET  26   6.598 -10.149   5.735
  236    HE1  MET  26          1HE       MET  26   5.199 -10.958   9.339
  237    HE2  MET  26          2HE       MET  26   6.308  -9.637   8.897
  238    HE3  MET  26          3HE       MET  26   4.940 -10.044   7.833
  239    H    MET  27           H        MET  27  11.523 -10.489   4.736
  240    HA   MET  27           HA       MET  27  12.430 -11.019   2.250
  241    HB2  MET  27          1HB       MET  27  13.490 -11.664   4.994
  242    HB3  MET  27          2HB       MET  27  14.428 -12.052   3.532
  243    HG2  MET  27          1HG       MET  27  13.479  -9.295   4.375
  244    HG3  MET  27          2HG       MET  27  15.139  -9.919   4.524
  245    HE1  MET  27          1HE       MET  27  16.333 -10.186   0.837
  246    HE2  MET  27          2HE       MET  27  16.801 -10.235   2.555
  247    HE3  MET  27          3HE       MET  27  15.697 -11.468   1.896
  248    H    SER  28           H        SER  28  11.126 -13.309   4.654
  249    HA   SER  28           HA       SER  28  11.828 -15.646   3.364
  250    HB2  SER  28          1HB       SER  28  10.842 -15.581   5.583
  251    HB3  SER  28          2HB       SER  28   9.333 -14.908   4.924
  252    HG   SER  28           HG       SER  28   9.213 -17.165   5.293
  253    H    ASP  29           H        ASP  29   8.508 -14.157   3.291
  254    HA   ASP  29           HA       ASP  29   8.098 -15.514   0.794
  255    HB2  ASP  29          1HB       ASP  29   6.359 -15.591   2.677
  256    HB3  ASP  29          2HB       ASP  29   6.298 -13.831   2.412
  257    HD2  ASP  29           HD       ASP  29   3.624 -15.414   0.513
  258    H    LEU  30           H        LEU  30   9.503 -14.117  -0.560
  259    HA   LEU  30           HA       LEU  30   8.850 -11.337  -0.792
  260    HB2  LEU  30          1HB       LEU  30  10.598 -13.334  -1.944
  261    HB3  LEU  30          2HB       LEU  30  10.331 -11.973  -3.058
  262    HG   LEU  30           HG       LEU  30  11.739 -10.633  -1.922
  263   HD11  LEU  30          1HD1      LEU  30  11.679 -10.387   0.574
  264   HD12  LEU  30          2HD1      LEU  30  10.043 -10.322  -0.121
  265   HD13  LEU  30          3HD1      LEU  30  10.614 -11.808   0.673
  266   HD21  LEU  30          1HD2      LEU  30  13.448 -11.754  -0.534
  267   HD22  LEU  30          2HD2      LEU  30  12.415 -13.202  -0.463
  268   HD23  LEU  30          3HD2      LEU  30  13.073 -12.655  -2.023
  269    H    THR  31           H        THR  31   7.532 -14.329  -1.932
  270    HA   THR  31           HA       THR  31   6.813 -13.438  -4.542
  271    HB   THR  31           HB       THR  31   5.764 -15.745  -2.827
  272    HG1  THR  31          1HG       THR  31   7.234 -16.959  -4.159
  273   HG21  THR  31          1HG2      THR  31   4.995 -16.695  -4.973
  274   HG22  THR  31          2HG2      THR  31   4.214 -15.129  -4.650
  275   HG23  THR  31          3HG2      THR  31   5.550 -15.233  -5.820
  276    H    ILE  32           H        ILE  32   5.137 -13.616  -1.364
  277    HA   ILE  32           HA       ILE  32   2.933 -12.145  -2.628
  278    HB   ILE  32           HB       ILE  32   2.802 -14.427  -0.601
  279   HG12  ILE  32          1HG1      ILE  32   3.015 -15.104  -2.908
  280   HG13  ILE  32          2HG1      ILE  32   1.438 -15.539  -2.206
  281   HG21  ILE  32          1HG2      ILE  32   0.364 -14.021  -0.551
  282   HG22  ILE  32          2HG2      ILE  32   1.260 -12.608   0.053
  283   HG23  ILE  32          3HG2      ILE  32   0.580 -12.594  -1.591
  284   HD11  ILE  32          1HD1      ILE  32   1.190 -14.728  -4.520
  285   HD12  ILE  32          2HD1      ILE  32   0.397 -13.630  -3.366
  286   HD13  ILE  32          3HD1      ILE  32   1.973 -13.197  -4.068
  287    HA   PRO  33           HA       PRO  33   3.887  -9.383   0.598
  288    HB2  PRO  33          1HB       PRO  33   2.008  -7.471   0.125
  289    HB3  PRO  33          2HB       PRO  33   3.425  -7.613  -0.926
  290    HG2  PRO  33          1HG       PRO  33   0.640  -8.763  -1.313
  291    HG3  PRO  33          2HG       PRO  33   1.670  -7.927  -2.484
  292    HD2  PRO  33          1HD       PRO  33   1.501 -10.665  -2.425
  293    HD3  PRO  33          2HD       PRO  33   3.001  -9.849  -2.885
  294    H    VAL  34           H        VAL  34   2.924  -8.373   2.576
  295    HA   VAL  34           HA       VAL  34   1.107 -10.472   3.537
  296    HB   VAL  34           HB       VAL  34   2.220 -10.215   5.729
  297   HG11  VAL  34          1HG1      VAL  34   4.448 -11.110   5.138
  298   HG12  VAL  34          2HG1      VAL  34   3.177 -11.836   4.127
  299   HG13  VAL  34          3HG1      VAL  34   4.225 -10.560   3.462
  300   HG21  VAL  34          1HG2      VAL  34   4.202  -8.808   5.991
  301   HG22  VAL  34          2HG2      VAL  34   3.968  -8.176   4.344
  302   HG23  VAL  34          3HG2      VAL  34   2.751  -7.855   5.602
  303    H    LYS  35           H        LYS  35   1.878  -7.015   3.349
  304    HA   LYS  35           HA       LYS  35  -0.789  -6.449   4.321
  305    HB2  LYS  35          1HB       LYS  35   1.771  -5.533   5.626
  306    HB3  LYS  35          2HB       LYS  35   0.297  -4.538   5.699
  307    HG2  LYS  35          1HG       LYS  35  -0.841  -6.666   6.635
  308    HG3  LYS  35          2HG       LYS  35   0.815  -7.256   6.913
  309    HD2  LYS  35          1HD       LYS  35   0.224  -6.246   8.951
  310    HD3  LYS  35          2HD       LYS  35   1.212  -5.020   8.124
  311    HE2  LYS  35          1HE       LYS  35  -0.737  -3.798   7.443
  312    HE3  LYS  35          2HE       LYS  35  -1.814  -5.099   8.004
  313    HZ1  LYS  35          1HZ       LYS  35  -1.730  -3.278   9.568
  314    HZ2  LYS  35          2HZ       LYS  35  -1.095  -4.639  10.249
  315    HZ3  LYS  35          3HZ       LYS  35  -0.097  -3.433   9.730
  316    H    ARG  36           H        ARG  36  -1.593  -4.418   3.559
  317    HA   ARG  36           HA       ARG  36   0.281  -2.932   1.931
  318    HB2  ARG  36          1HB       ARG  36  -2.517  -3.771   1.039
  319    HB3  ARG  36          2HB       ARG  36  -1.442  -2.701   0.124
  320    HG2  ARG  36          1HG       ARG  36  -0.955  -4.712  -0.899
  321    HG3  ARG  36          2HG       ARG  36   0.246  -4.770   0.401
  322    HD2  ARG  36          1HD       ARG  36  -0.873  -6.910   0.347
  323    HD3  ARG  36          2HD       ARG  36  -1.468  -6.061   1.782
  324    HE   ARG  36           HE       ARG  36  -3.595  -5.978   0.803
  325   HH11  ARG  36          1HH1      ARG  36  -4.660  -6.884  -2.384
  326   HH12  ARG  36          2HH1      ARG  36  -5.145  -6.404  -0.772
  327   HH21  ARG  36          1HH2      ARG  36  -2.408  -7.088  -2.910
  328   HH22  ARG  36          2HH2      ARG  36  -1.213  -6.761  -1.700
  329    H    GLY  37           H        GLY  37  -0.582  -0.668   1.422
  330    HA2  GLY  37          1HA       GLY  37  -2.802   0.369   2.853
  331    HA3  GLY  37          2HA       GLY  37  -1.328   0.602   3.772
  332    H    CYS  38           H        CYS  38  -2.059   2.960   3.303
  333    HA   CYS  38           HA       CYS  38  -1.162   3.754   0.636
  334    HB2  CYS  38          1HB       CYS  38  -2.856   5.107   2.866
  335    HB3  CYS  38          2HB       CYS  38  -2.689   5.737   1.210
  336    HG   CYS  38           HG       CYS  38  -5.090   4.889   1.599
  337    H    ILE  39           H        ILE  39   0.339   5.590   0.500
  338    HA   ILE  39           HA       ILE  39   1.083   6.926   2.909
  339    HB   ILE  39           HB       ILE  39   2.553   4.827   2.918
  340   HG12  ILE  39          1HG1      ILE  39   4.202   7.291   2.556
  341   HG13  ILE  39          2HG1      ILE  39   3.047   7.137   3.900
  342   HG21  ILE  39          1HG2      ILE  39   4.430   4.790   1.312
  343   HG22  ILE  39          2HG2      ILE  39   2.868   4.659   0.472
  344   HG23  ILE  39          3HG2      ILE  39   3.746   6.205   0.479
  345   HD11  ILE  39          1HD1      ILE  39   5.318   6.490   4.601
  346   HD12  ILE  39          2HD1      ILE  39   4.206   5.102   4.664
  347   HD13  ILE  39          3HD1      ILE  39   5.362   5.257   3.321
  348    H    ASP  40           H        ASP  40   2.649   8.740   2.407
  349    HA   ASP  40           HA       ASP  40   1.951   9.757  -0.183
  350    HB2  ASP  40          1HB       ASP  40   2.964  11.923   0.729
  351    HB3  ASP  40          2HB       ASP  40   1.619  11.113   1.570
  352    HD2  ASP  40           HD       ASP  40   4.329  12.072   3.899
  353    H    VAL  41           H        VAL  41   4.871   8.992   1.837
  354    HA   VAL  41           HA       VAL  41   6.497   9.191  -0.603
  355    HB   VAL  41           HB       VAL  41   7.309   9.534   2.324
  356   HG11  VAL  41          1HG1      VAL  41   9.520  10.150   1.405
  357   HG12  VAL  41          2HG1      VAL  41   9.085   8.481   0.964
  358   HG13  VAL  41          3HG1      VAL  41   8.939   9.787  -0.237
  359   HG21  VAL  41          1HG2      VAL  41   7.766  11.857   1.716
  360   HG22  VAL  41          2HG2      VAL  41   7.122  11.554   0.085
  361   HG23  VAL  41          3HG2      VAL  41   6.051  11.435   1.501
  362    H    CYS  42           H        CYS  42   7.539   7.367  -1.297
  363    HA   CYS  42           HA       CYS  42   6.616   4.959  -0.165
  364    HB2  CYS  42          1HB       CYS  42   6.982   5.289  -2.565
  365    HB3  CYS  42          2HB       CYS  42   8.722   5.417  -2.290
  366    HG   CYS  42           HG       CYS  42   8.168   3.107  -3.425
  367    HA   PRO  43           HA       PRO  43   9.891   4.644   2.742
  368    HB2  PRO  43          1HB       PRO  43   9.216   2.261   3.899
  369    HB3  PRO  43          2HB       PRO  43   8.336   3.743   4.295
  370    HG2  PRO  43          1HG       PRO  43   7.636   1.590   2.275
  371    HG3  PRO  43          2HG       PRO  43   6.584   2.410   3.437
  372    HD2  PRO  43          1HD       PRO  43   6.660   3.168   0.804
  373    HD3  PRO  43          2HD       PRO  43   6.383   4.352   2.088
  374    H    LYS  44           H        LYS  44  11.973   3.930   2.802
  375    HA   LYS  44           HA       LYS  44  12.735   2.428   0.520
  376    HB2  LYS  44          1HB       LYS  44  14.204   3.279   3.032
  377    HB3  LYS  44          2HB       LYS  44  14.980   2.483   1.643
  378    HG2  LYS  44          1HG       LYS  44  14.359   4.376   0.203
  379    HG3  LYS  44          2HG       LYS  44  13.565   5.170   1.584
  380    HD2  LYS  44          1HD       LYS  44  15.702   5.301   2.767
  381    HD3  LYS  44          2HD       LYS  44  16.512   4.444   1.434
  382    HE2  LYS  44          1HE       LYS  44  15.937   6.278  -0.096
  383    HE3  LYS  44          2HE       LYS  44  15.120   7.134   1.231
  384    HZ1  LYS  44          1HZ       LYS  44  17.346   7.962   0.875
  385    HZ2  LYS  44          2HZ       LYS  44  17.234   7.260   2.365
  386    HZ3  LYS  44          3HZ       LYS  44  17.992   6.466   1.133
  387    H    ASN  45           H        ASN  45  14.088   0.390   0.672
  388    HA   ASN  45           HA       ASN  45  12.421  -1.492   1.916
  389    HB2  ASN  45          1HB       ASN  45  15.045  -2.056   0.352
  390    HB3  ASN  45          2HB       ASN  45  13.847  -3.046   1.220
  391   HD21  ASN  45          1HD2      ASN  45  13.175  -2.511  -2.518
  392   HD22  ASN  45          2HD2      ASN  45  14.672  -2.726  -1.671
  393    H    SER  46           H        SER  46  12.926  -2.895   3.726
  394    HA   SER  46           HA       SER  46  15.267  -2.035   5.232
  395    HB2  SER  46          1HB       SER  46  14.095  -2.837   7.214
  396    HB3  SER  46          2HB       SER  46  13.066  -1.701   6.311
  397    HG   SER  46           HG       SER  46  11.985  -3.516   5.441
  398    H    LEU  47           H        LEU  47  15.904  -4.051   6.860
  399    HA   LEU  47           HA       LEU  47  16.897  -5.990   5.011
  400    HB2  LEU  47          1HB       LEU  47  16.983  -5.627   7.940
  401    HB3  LEU  47          2HB       LEU  47  17.965  -6.910   7.198
  402    HG   LEU  47           HG       LEU  47  18.259  -3.914   6.754
  403   HD11  LEU  47          1HD1      LEU  47  20.478  -4.235   7.880
  404   HD12  LEU  47          2HD1      LEU  47  19.136  -4.696   8.952
  405   HD13  LEU  47          3HD1      LEU  47  20.087  -5.952   8.125
  406   HD21  LEU  47          1HD2      LEU  47  20.246  -4.505   5.410
  407   HD22  LEU  47          2HD2      LEU  47  19.844  -6.228   5.606
  408   HD23  LEU  47          3HD2      LEU  47  18.736  -5.151   4.723
  409    H    LEU  48           H        LEU  48  14.137  -5.678   7.142
  410    HA   LEU  48           HA       LEU  48  13.884  -8.578   7.349
  411    HB2  LEU  48          1HB       LEU  48  12.503  -6.257   8.545
  412    HB3  LEU  48          2HB       LEU  48  12.015  -7.902   9.010
  413    HG   LEU  48           HG       LEU  48  14.701  -6.572   9.536
  414   HD11  LEU  48          1HD1      LEU  48  14.042  -6.833  11.943
  415   HD12  LEU  48          2HD1      LEU  48  12.868  -5.833  11.057
  416   HD13  LEU  48          3HD1      LEU  48  12.490  -7.532  11.426
  417   HD21  LEU  48          1HD2      LEU  48  15.285  -8.641  10.754
  418   HD22  LEU  48          2HD2      LEU  48  13.757  -9.372  10.207
  419   HD23  LEU  48          3HD2      LEU  48  15.002  -8.922   9.019
  420    H    VAL  49           H        VAL  49  12.093  -5.621   6.280
  421    HA   VAL  49           HA       VAL  49  10.353  -7.420   4.741
  422    HB   VAL  49           HB       VAL  49   8.530  -5.714   5.121
  423   HG11  VAL  49          1HG1      VAL  49   8.014  -6.412   7.437
  424   HG12  VAL  49          2HG1      VAL  49   8.625  -7.779   6.477
  425   HG13  VAL  49          3HG1      VAL  49   9.692  -6.963   7.645
  426   HG21  VAL  49          1HG2      VAL  49   8.765  -4.112   6.951
  427   HG22  VAL  49          2HG2      VAL  49  10.470  -4.582   7.142
  428   HG23  VAL  49          3HG2      VAL  49   9.924  -3.802   5.638
  429    H    LYS  50           H        LYS  50   9.685  -6.644   2.676
  430    HA   LYS  50           HA       LYS  50  11.392  -4.463   1.719
  431    HB2  LYS  50          1HB       LYS  50  11.685  -6.629   0.623
  432    HB3  LYS  50          2HB       LYS  50   9.940  -6.707   0.283
  433    HG2  LYS  50          1HG       LYS  50  10.149  -4.726  -1.180
  434    HG3  LYS  50          2HG       LYS  50  11.899  -4.685  -0.859
  435    HD2  LYS  50          1HD       LYS  50  12.140  -6.923  -1.848
  436    HD3  LYS  50          2HD       LYS  50  10.389  -6.979  -2.157
  437    HE2  LYS  50          1HE       LYS  50  10.611  -4.971  -3.598
  438    HE3  LYS  50          2HE       LYS  50  12.370  -5.009  -3.338
  439    HZ1  LYS  50          1HZ       LYS  50  11.753  -6.068  -5.403
  440    HZ2  LYS  50          2HZ       LYS  50  12.410  -7.177  -4.373
  441    HZ3  LYS  50          3HZ       LYS  50  10.778  -7.141  -4.613
  442    H    TYR  51           H        TYR  51  10.505  -2.750   0.477
  443    HA   TYR  51           HA       TYR  51   7.592  -2.508   0.817
  444    HB2  TYR  51          1HB       TYR  51   9.778  -0.430   0.891
  445    HB3  TYR  51          2HB       TYR  51   8.035  -0.068   0.865
  446    HD1  TYR  51          1HD       TYR  51  10.820  -1.367   2.894
  447    HD2  TYR  51          2HD       TYR  51   6.650  -0.480   2.830
  448    HE1  TYR  51          1HE       TYR  51  10.745  -1.581   5.360
  449    HE2  TYR  51          2HE       TYR  51   6.557  -0.690   5.291
  450    HH   TYR  51           HH       TYR  51   9.454  -1.482   7.226
  451    H    VAL  52           H        VAL  52   6.434  -2.425  -1.046
  452    HA   VAL  52           HA       VAL  52   7.762  -1.170  -3.345
  453    HB   VAL  52           HB       VAL  52   5.734  -3.457  -3.378
  454   HG11  VAL  52          1HG1      VAL  52   6.123  -3.451  -5.819
  455   HG12  VAL  52          2HG1      VAL  52   5.463  -1.891  -5.273
  456   HG13  VAL  52          3HG1      VAL  52   7.197  -2.043  -5.645
  457   HG21  VAL  52          1HG2      VAL  52   7.544  -4.800  -4.321
  458   HG22  VAL  52          2HG2      VAL  52   8.670  -3.440  -4.093
  459   HG23  VAL  52          3HG2      VAL  52   7.922  -4.226  -2.681
  460    H    CYS  53           H        CYS  53   6.700   0.564  -4.198
  461    HA   CYS  53           HA       CYS  53   3.954   0.959  -3.243
  462    HB2  CYS  53          1HB       CYS  53   5.864   3.188  -3.910
  463    HB3  CYS  53          2HB       CYS  53   4.315   3.284  -3.066
  464    HG   CYS  53           HG       CYS  53   6.270   3.860  -1.400
  465    H    CYS  54           H        CYS  54   2.609   2.293  -4.820
  466    HA   CYS  54           HA       CYS  54   3.739   2.711  -7.415
  467    HB2  CYS  54          1HB       CYS  54   1.770   1.477  -8.501
  468    HB3  CYS  54          2HB       CYS  54   3.176   0.549  -7.969
  469    HG   CYS  54           HG       CYS  54   0.983  -0.856  -7.578
  470    H    ASN  55           H        ASN  55   2.132   4.061  -8.765
  471    HA   ASN  55           HA       ASN  55   1.176   5.839  -6.679
  472    HB2  ASN  55          1HB       ASN  55   2.019   7.744  -8.136
  473    HB3  ASN  55          2HB       ASN  55   3.029   6.319  -7.789
  474   HD21  ASN  55          1HD2      ASN  55   3.314   7.391 -11.369
  475   HD22  ASN  55          2HD2      ASN  55   3.427   8.229  -9.856
  476    H    THR  56           H        THR  56  -0.493   3.714  -7.938
  477    HA   THR  56           HA       THR  56  -2.589   5.515  -8.919
  478    HB   THR  56           HB       THR  56  -3.345   3.716 -10.480
  479    HG1  THR  56          1HG       THR  56  -1.837   1.991 -10.889
  480   HG21  THR  56          1HG2      THR  56  -1.579   3.991 -12.184
  481   HG22  THR  56          2HG2      THR  56  -1.905   5.527 -11.345
  482   HG23  THR  56          3HG2      THR  56  -0.460   4.575 -10.931
  483    H    ASP  57           H        ASP  57  -4.783   4.187  -8.922
  484    HA   ASP  57           HA       ASP  57  -5.082   3.704  -6.164
  485    HB2  ASP  57          1HB       ASP  57  -7.074   3.652  -8.494
  486    HB3  ASP  57          2HB       ASP  57  -7.375   3.183  -6.802
  487    HD2  ASP  57           HD       ASP  57  -7.336   6.970  -7.684
  488    H    ARG  58           H        ARG  58  -5.325   1.676  -5.104
  489    HA   ARG  58           HA       ARG  58  -5.458  -0.461  -4.791
  490    HB2  ARG  58          1HB       ARG  58  -7.176  -0.407  -7.240
  491    HB3  ARG  58          2HB       ARG  58  -7.043  -1.765  -6.097
  492    HG2  ARG  58          1HG       ARG  58  -8.225  -0.682  -4.448
  493    HG3  ARG  58          2HG       ARG  58  -7.767   0.936  -5.032
  494    HD2  ARG  58          1HD       ARG  58  -9.621  -0.848  -6.553
  495    HD3  ARG  58          2HD       ARG  58 -10.178   0.225  -5.248
  496    HE   ARG  58           HE       ARG  58  -8.866   1.947  -7.097
  497   HH11  ARG  58          1HH1      ARG  58 -11.487  -0.343  -7.324
  498   HH12  ARG  58          2HH1      ARG  58 -12.223   0.616  -8.593
  499   HH21  ARG  58          1HH2      ARG  58  -9.691   3.051  -8.556
  500   HH22  ARG  58          2HH2      ARG  58 -11.200   2.550  -9.298
  501    H    CYS  59           H        CYS  59  -3.136   0.460  -6.316
  502    HA   CYS  59           HA       CYS  59  -2.860  -1.309  -8.562
  503    HB2  CYS  59          1HB       CYS  59  -0.718   0.103  -8.715
  504    HB3  CYS  59          2HB       CYS  59  -2.089   1.167  -8.320
  505    HG   CYS  59           HG       CYS  59   0.041   1.977  -7.117
  506    H    ASN  60           H        ASN  60  -2.104  -1.164  -5.129
  507    HA   ASN  60           HA       ASN  60  -0.161  -3.274  -5.372
  508    HB2  ASN  60          1HB       ASN  60  -0.024  -3.063  -2.880
  509    HB3  ASN  60          2HB       ASN  60   0.223  -1.503  -3.681
  510   HD21  ASN  60          1HD2      ASN  60  -0.330  -0.985  -1.334
  511   HD22  ASN  60          2HD2      ASN  60  -1.989  -0.636  -0.977
  Start of MODEL    8
    1    H1   MET   0          1H        MET   0 -11.104  10.524  -0.756
    2    H2   MET   0          2H        MET   0 -11.287  11.181  -2.091
    3    H    MET   0           H        MET   0 -11.397   9.668  -1.976
    4    H3   MET   0          3H        MET   0 -11.414   9.693  -1.965
    5    HA   MET   0           HA       MET   0  -9.099  11.101  -2.619
    6    HB2  MET   0          1HB       MET   0  -8.996   9.658   0.034
    7    HB3  MET   0          2HB       MET   0  -7.540  10.101  -0.887
    8    HG2  MET   0          1HG       MET   0  -8.032  12.443  -0.671
    9    HG3  MET   0          2HG       MET   0  -9.624  12.093   0.042
   10    HE1  MET   0          1HE       MET   0  -8.894  11.057   3.646
   11    HE2  MET   0          2HE       MET   0 -10.073  11.749   2.504
   12    HE3  MET   0          3HE       MET   0  -9.437  10.107   2.242
   13    H    LEU   1           H        LEU   1  -7.037   9.202  -2.398
   14    HA   LEU   1           HA       LEU   1  -7.920   7.461  -4.464
   15    HB2  LEU   1          1HB       LEU   1  -5.458   7.661  -2.840
   16    HB3  LEU   1          2HB       LEU   1  -5.476   6.649  -4.303
   17    HG   LEU   1           HG       LEU   1  -5.855   9.668  -4.223
   18   HD11  LEU   1          1HD1      LEU   1  -3.613   9.737  -5.346
   19   HD12  LEU   1          2HD1      LEU   1  -3.508   8.980  -3.740
   20   HD13  LEU   1          3HD1      LEU   1  -3.503   7.967  -5.203
   21   HD21  LEU   1          1HD2      LEU   1  -5.708   9.528  -6.684
   22   HD22  LEU   1          2HD2      LEU   1  -5.645   7.753  -6.563
   23   HD23  LEU   1          3HD2      LEU   1  -7.098   8.630  -6.027
   24    H    LYS   2           H        LYS   2  -6.934   5.026  -4.244
   25    HA   LYS   2           HA       LYS   2  -7.889   4.001  -1.667
   26    HB2  LYS   2          1HB       LYS   2  -8.442   2.702  -4.341
   27    HB3  LYS   2          2HB       LYS   2  -9.119   2.278  -2.751
   28    HG2  LYS   2          1HG       LYS   2  -9.661   4.918  -4.141
   29    HG3  LYS   2          2HG       LYS   2 -10.691   3.481  -4.347
   30    HD2  LYS   2          1HD       LYS   2 -11.168   3.425  -1.965
   31    HD3  LYS   2          2HD       LYS   2 -10.039   4.770  -1.676
   32    HE2  LYS   2          1HE       LYS   2 -12.362   5.551  -1.684
   33    HE3  LYS   2          2HE       LYS   2 -11.432   6.258  -3.026
   34    HZ1  LYS   2          1HZ       LYS   2 -13.599   5.510  -3.742
   35    HZ2  LYS   2          2HZ       LYS   2 -12.421   4.625  -4.485
   36    HZ3  LYS   2          3HZ       LYS   2 -13.284   3.971  -3.240
   37    H    CYS   3           H        CYS   3  -6.692   2.297  -0.824
   38    HA   CYS   3           HA       CYS   3  -4.745   1.112  -2.661
   39    HB2  CYS   3          1HB       CYS   3  -4.346   1.763   0.260
   40    HB3  CYS   3          2HB       CYS   3  -3.238   0.793  -0.714
   41    HG   CYS   3           HG       CYS   3  -2.194   3.173  -0.288
   42    H    ASN   4           H        ASN   4  -4.252  -1.204  -2.101
   43    HA   ASN   4           HA       ASN   4  -6.726  -2.455  -1.508
   44    HB2  ASN   4          1HB       ASN   4  -4.076  -3.850  -2.327
   45    HB3  ASN   4          2HB       ASN   4  -5.719  -4.379  -1.889
   46   HD21  ASN   4          1HD2      ASN   4  -4.987  -3.595  -5.631
   47   HD22  ASN   4          2HD2      ASN   4  -3.872  -4.124  -4.416
   48    H    LYS   5           H        LYS   5  -6.930  -4.229   0.162
   49    HA   LYS   5           HA       LYS   5  -4.955  -4.068   2.302
   50    HB2  LYS   5          1HB       LYS   5  -7.941  -3.604   2.556
   51    HB3  LYS   5          2HB       LYS   5  -6.868  -3.957   3.932
   52    HG2  LYS   5          1HG       LYS   5  -6.633  -1.553   2.087
   53    HG3  LYS   5          2HG       LYS   5  -7.373  -1.536   3.706
   54    HD2  LYS   5          1HD       LYS   5  -4.480  -2.109   2.996
   55    HD3  LYS   5          2HD       LYS   5  -5.115  -0.721   3.909
   56    HE2  LYS   5          1HE       LYS   5  -6.023  -2.482   5.561
   57    HE3  LYS   5          2HE       LYS   5  -4.914  -3.613   4.752
   58    HZ1  LYS   5          1HZ       LYS   5  -3.903  -2.604   6.683
   59    HZ2  LYS   5          2HZ       LYS   5  -3.103  -2.138   5.316
   60    HZ3  LYS   5          3HZ       LYS   5  -4.132  -1.090   6.067
   61    H    LEU   6           H        LEU   6  -8.285  -5.446   2.215
   62    HA   LEU   6           HA       LEU   6  -7.107  -8.034   2.789
   63    HB2  LEU   6          1HB       LEU   6  -8.832  -7.253   4.101
   64    HB3  LEU   6          2HB       LEU   6  -9.998  -6.982   2.785
   65    HG   LEU   6           HG       LEU   6  -9.855  -9.484   2.323
   66   HD11  LEU   6          1HD1      LEU   6  -9.107 -10.903   4.254
   67   HD12  LEU   6          2HD1      LEU   6  -7.770  -9.913   3.622
   68   HD13  LEU   6          3HD1      LEU   6  -8.604  -9.432   5.119
   69   HD21  LEU   6          1HD2      LEU   6 -11.451 -10.057   4.120
   70   HD22  LEU   6          2HD2      LEU   6 -10.994  -8.565   4.978
   71   HD23  LEU   6          3HD2      LEU   6 -11.783  -8.470   3.386
   72    H    VAL   7           H        VAL   7  -7.015  -9.736   1.378
   73    HA   VAL   7           HA       VAL   7  -7.398  -9.259  -1.356
   74    HB   VAL   7           HB       VAL   7  -7.067 -11.729  -1.584
   75   HG11  VAL   7          1HG1      VAL   7  -4.824 -11.832  -0.549
   76   HG12  VAL   7          2HG1      VAL   7  -5.101 -10.253  -1.320
   77   HG13  VAL   7          3HG1      VAL   7  -5.218 -10.412   0.448
   78   HG21  VAL   7          1HG2      VAL   7  -6.710 -13.103   0.404
   79   HG22  VAL   7          2HG2      VAL   7  -7.172 -11.729   1.436
   80   HG23  VAL   7          3HG2      VAL   7  -8.364 -12.452   0.329
   81    HA   PRO   8           HA       PRO   8  -7.723 -10.569  -2.882
   82    HB2  PRO   8          1HB       PRO   8  -8.909 -10.600  -5.301
   83    HB3  PRO   8          2HB       PRO   8  -8.933 -12.063  -4.305
   84    HG2  PRO   8          1HG       PRO   8 -11.073  -9.940  -4.636
   85    HG3  PRO   8          2HG       PRO   8 -11.247 -11.700  -4.584
   86    HD2  PRO   8          1HD       PRO   8 -11.688 -10.059  -2.376
   87    HD3  PRO   8          2HD       PRO   8 -11.215 -11.757  -2.234
   88    H    ILE   9           H        ILE   9 -10.386  -8.312  -3.156
   89    HA   ILE   9           HA       ILE   9  -8.512  -6.497  -4.509
   90    HB   ILE   9           HB       ILE   9 -11.542  -6.755  -4.828
   91   HG12  ILE   9          1HG1      ILE   9 -10.400  -8.575  -5.865
   92   HG13  ILE   9          2HG1      ILE   9 -11.072  -7.466  -7.084
   93   HG21  ILE   9          1HG2      ILE   9 -11.270  -5.069  -6.615
   94   HG22  ILE   9          2HG2      ILE   9 -10.756  -4.421  -5.042
   95   HG23  ILE   9          3HG2      ILE   9  -9.538  -4.939  -6.231
   96   HD11  ILE   9          1HD1      ILE   9  -8.829  -8.251  -7.736
   97   HD12  ILE   9          2HD1      ILE   9  -8.833  -6.497  -7.437
   98   HD13  ILE   9          3HD1      ILE   9  -8.162  -7.607  -6.219
   99    H    ALA  10           H        ALA  10 -10.583  -7.094  -1.783
  100    HA   ALA  10           HA       ALA  10 -11.864  -4.782  -1.321
  101    HB1  ALA  10          1HB       ALA  10 -11.548  -7.045   0.049
  102    HB2  ALA  10          2HB       ALA  10 -10.411  -6.045   0.986
  103    HB3  ALA  10          3HB       ALA  10 -12.118  -5.558   0.842
  104    H    TYR  11           H        TYR  11 -11.417  -2.697  -0.598
  105    HA   TYR  11           HA       TYR  11  -8.586  -2.061  -0.200
  106    HB2  TYR  11          1HB       TYR  11  -8.803  -0.194  -1.773
  107    HB3  TYR  11          2HB       TYR  11  -8.921  -1.797  -2.541
  108    HD1  TYR  11          1HD       TYR  11 -10.728   1.294  -1.706
  109    HD2  TYR  11          2HD       TYR  11 -11.043  -2.567  -3.487
  110    HE1  TYR  11          1HE       TYR  11 -12.882   1.954  -2.736
  111    HE2  TYR  11          2HE       TYR  11 -13.194  -1.926  -4.523
  112    HH   TYR  11           HH       TYR  11 -14.751  -0.285  -4.791
  113    H    LYS  12           H        LYS  12  -8.273   0.200   0.625
  114    HA   LYS  12           HA       LYS  12 -10.689   1.170   1.978
  115    HB2  LYS  12          1HB       LYS  12  -7.880   0.762   3.016
  116    HB3  LYS  12          2HB       LYS  12  -9.001   1.919   3.774
  117    HG2  LYS  12          1HG       LYS  12 -10.611   0.024   4.119
  118    HG3  LYS  12          2HG       LYS  12  -9.352  -1.087   3.529
  119    HD2  LYS  12          1HD       LYS  12  -7.861  -0.401   5.343
  120    HD3  LYS  12          2HD       LYS  12  -9.072   0.771   5.916
  121    HE2  LYS  12          1HE       LYS  12 -10.656  -1.109   6.290
  122    HE3  LYS  12          2HE       LYS  12  -9.371  -2.247   5.821
  123    HZ1  LYS  12          1HZ       LYS  12  -9.524  -2.012   8.206
  124    HZ2  LYS  12          2HZ       LYS  12  -8.071  -1.441   7.674
  125    HZ3  LYS  12          3HZ       LYS  12  -9.261  -0.386   8.108
  126    H    THR  13           H        THR  13 -10.598   3.515   2.519
  127    HA   THR  13           HA       THR  13  -9.444   4.928   0.278
  128    HB   THR  13           HB       THR  13 -11.074   5.898   2.678
  129    HG1  THR  13          1HG       THR  13 -12.782   5.906   1.098
  130   HG21  THR  13          1HG2      THR  13 -11.474   7.906   1.295
  131   HG22  THR  13          2HG2      THR  13  -9.737   7.688   1.620
  132   HG23  THR  13          3HG2      THR  13 -10.408   7.249   0.032
  133    H    CYS  14           H        CYS  14  -7.665   6.187   0.236
  134    HA   CYS  14           HA       CYS  14  -5.843   5.828   2.350
  135    HB2  CYS  14          1HB       CYS  14  -5.789   7.543  -0.127
  136    HB3  CYS  14          2HB       CYS  14  -4.444   7.458   1.011
  137    HG   CYS  14           HG       CYS  14  -3.872   6.057  -1.144
  138    HA   PRO  15           HA       PRO  15  -6.847   9.417   4.653
  139    HB2  PRO  15          1HB       PRO  15  -4.694   9.736   6.249
  140    HB3  PRO  15          2HB       PRO  15  -5.753   8.338   6.484
  141    HG2  PRO  15          1HG       PRO  15  -3.146   8.518   4.937
  142    HG3  PRO  15          2HG       PRO  15  -3.680   7.272   6.073
  143    HD2  PRO  15          1HD       PRO  15  -3.899   6.969   3.331
  144    HD3  PRO  15          2HD       PRO  15  -5.015   6.188   4.458
  145    H    GLU  16           H        GLU  16  -6.466  11.696   4.975
  146    HA   GLU  16           HA       GLU  16  -5.719  12.806   2.584
  147    HB2  GLU  16          1HB       GLU  16  -7.175  13.868   4.231
  148    HB3  GLU  16          2HB       GLU  16  -5.808  14.024   5.360
  149    HG2  GLU  16          1HG       GLU  16  -4.705  15.641   3.739
  150    HG3  GLU  16          2HG       GLU  16  -6.105  15.330   2.688
  151    HE2  GLU  16           HE       GLU  16  -6.777  18.297   4.631
  152    H    GLY  17           H        GLY  17  -3.801  13.595   1.720
  153    HA2  GLY  17          1HA       GLY  17  -1.705  14.598   1.888
  154    HA3  GLY  17          2HA       GLY  17  -1.526  13.991   3.524
  155    H    LYS  18           H        LYS  18  -2.747  11.306   2.229
  156    HA   LYS  18           HA       LYS  18  -0.141  10.360   1.287
  157    HB2  LYS  18          1HB       LYS  18  -2.574   8.783   2.160
  158    HB3  LYS  18          2HB       LYS  18  -0.948   8.146   1.823
  159    HG2  LYS  18          1HG       LYS  18  -1.756   9.958   4.124
  160    HG3  LYS  18          2HG       LYS  18  -1.319   8.236   4.229
  161    HD2  LYS  18          1HD       LYS  18   0.942   8.814   3.325
  162    HD3  LYS  18          2HD       LYS  18   0.487  10.532   3.404
  163    HE2  LYS  18          1HE       LYS  18  -0.009  10.147   5.870
  164    HE3  LYS  18          2HE       LYS  18   0.793   8.571   5.689
  165    HZ1  LYS  18          1HZ       LYS  18   2.310  10.255   6.484
  166    HZ2  LYS  18          2HZ       LYS  18   2.776   9.733   4.990
  167    HZ3  LYS  18          3HZ       LYS  18   2.032  11.195   5.157
  168    H    ASN  19           H        ASN  19  -0.069   8.961  -0.625
  169    HA   ASN  19           HA       ASN  19  -2.260   9.617  -2.420
  170    HB2  ASN  19          1HB       ASN  19  -0.329  11.405  -2.737
  171    HB3  ASN  19          2HB       ASN  19   0.535   9.862  -2.942
  172   HD21  ASN  19          1HD2      ASN  19  -1.505  11.576  -5.990
  173   HD22  ASN  19          2HD2      ASN  19  -1.475  12.245  -4.392
  174    H    LEU  20           H        LEU  20   0.869   7.854  -1.833
  175    HA   LEU  20           HA       LEU  20   0.403   6.242  -4.189
  176    HB2  LEU  20          1HB       LEU  20   2.522   6.189  -2.129
  177    HB3  LEU  20          2HB       LEU  20   2.738   5.428  -3.721
  178    HG   LEU  20           HG       LEU  20   2.530   8.407  -3.137
  179   HD11  LEU  20          1HD1      LEU  20   4.892   8.458  -3.984
  180   HD12  LEU  20          2HD1      LEU  20   4.738   7.405  -2.558
  181   HD13  LEU  20          3HD1      LEU  20   4.841   6.691  -4.186
  182   HD21  LEU  20          1HD2      LEU  20   2.965   8.721  -5.549
  183   HD22  LEU  20          2HD2      LEU  20   2.871   6.957  -5.777
  184   HD23  LEU  20          3HD2      LEU  20   1.439   7.862  -5.233
  185    H    CYS  21           H        CYS  21   0.485   3.872  -4.134
  186    HA   CYS  21           HA       CYS  21  -0.539   2.866  -1.581
  187    HB2  CYS  21          1HB       CYS  21  -1.050   1.952  -4.409
  188    HB3  CYS  21          2HB       CYS  21  -1.514   1.016  -2.984
  189    HG   CYS  21           HG       CYS  21  -3.645   2.148  -4.036
  190    H    TYR  22           H        TYR  22   0.729   1.347  -0.534
  191    HA   TYR  22           HA       TYR  22   2.980   0.254  -2.086
  192    HB2  TYR  22          1HB       TYR  22   4.382   0.509  -0.226
  193    HB3  TYR  22          2HB       TYR  22   3.542   2.062  -0.456
  194    HD1  TYR  22          1HD       TYR  22   3.884  -0.896   1.715
  195    HD2  TYR  22          2HD       TYR  22   1.919   2.850   1.181
  196    HE1  TYR  22          1HE       TYR  22   3.113  -0.973   4.069
  197    HE2  TYR  22          2HE       TYR  22   1.141   2.790   3.526
  198    HH   TYR  22           HH       TYR  22   1.130   1.631   5.487
  199    H    LYS  23           H        LYS  23   3.808  -1.850  -1.327
  200    HA   LYS  23           HA       LYS  23   1.972  -3.244   0.477
  201    HB2  LYS  23          1HB       LYS  23   2.250  -5.270  -0.875
  202    HB3  LYS  23          2HB       LYS  23   1.440  -3.967  -1.778
  203    HG2  LYS  23          1HG       LYS  23   3.538  -3.461  -2.949
  204    HG3  LYS  23          2HG       LYS  23   4.366  -4.745  -2.034
  205    HD2  LYS  23          1HD       LYS  23   3.621  -5.358  -4.387
  206    HD3  LYS  23          2HD       LYS  23   3.096  -6.454  -3.087
  207    HE2  LYS  23          1HE       LYS  23   0.901  -5.398  -3.041
  208    HE3  LYS  23          2HE       LYS  23   1.417  -4.221  -4.270
  209    HZ1  LYS  23          1HZ       LYS  23   0.144  -6.013  -5.235
  210    HZ2  LYS  23          2HZ       LYS  23   1.691  -6.045  -5.809
  211    HZ3  LYS  23          3HZ       LYS  23   1.211  -7.136  -4.668
  212    H    MET  24           H        MET  24   2.980  -4.913   1.761
  213    HA   MET  24           HA       MET  24   5.869  -4.506   1.879
  214    HB2  MET  24          1HB       MET  24   3.833  -5.065   4.044
  215    HB3  MET  24          2HB       MET  24   5.593  -5.112   4.306
  216    HG2  MET  24          1HG       MET  24   5.719  -2.730   3.610
  217    HG3  MET  24          2HG       MET  24   3.944  -2.705   3.477
  218    HE1  MET  24          1HE       MET  24   2.712  -2.953   7.120
  219    HE2  MET  24          2HE       MET  24   2.308  -2.527   5.438
  220    HE3  MET  24          3HE       MET  24   2.768  -4.198   5.847
  221    H    PHE  25           H        PHE  25   7.202  -6.306   1.801
  222    HA   PHE  25           HA       PHE  25   5.851  -8.904   1.957
  223    HB2  PHE  25          1HB       PHE  25   8.514  -7.967   0.745
  224    HB3  PHE  25          2HB       PHE  25   7.936  -9.635   0.676
  225    HD1  PHE  25          1HD       PHE  25   6.364 -10.298  -0.954
  226    HD2  PHE  25          2HD       PHE  25   7.306  -6.192  -0.503
  227    HE1  PHE  25          1HE       PHE  25   5.163  -9.786  -3.110
  228    HE2  PHE  25          2HE       PHE  25   6.110  -5.674  -2.649
  229    HZ   PHE  25           HZ       PHE  25   5.054  -7.477  -3.928
  230    H    MET  26           H        MET  26   7.250 -10.715   2.928
  231    HA   MET  26           HA       MET  26   9.275  -9.599   4.710
  232    HB2  MET  26          1HB       MET  26   7.720 -12.193   4.827
  233    HB3  MET  26          2HB       MET  26   9.063 -11.781   5.919
  234    HG2  MET  26          1HG       MET  26   7.794  -9.855   6.758
  235    HG3  MET  26          2HG       MET  26   6.452 -10.259   5.660
  236    HE1  MET  26          1HE       MET  26   5.032 -11.153   9.242
  237    HE2  MET  26          2HE       MET  26   6.148  -9.823   8.844
  238    HE3  MET  26          3HE       MET  26   4.783 -10.196   7.762
  239    H    MET  27           H        MET  27  11.389 -10.564   4.732
  240    HA   MET  27           HA       MET  27  12.350 -11.013   2.255
  241    HB2  MET  27          1HB       MET  27  13.337 -11.750   5.000
  242    HB3  MET  27          2HB       MET  27  14.307 -12.114   3.552
  243    HG2  MET  27          1HG       MET  27  13.392  -9.375   4.486
  244    HG3  MET  27          2HG       MET  27  15.046 -10.025   4.575
  245    HE1  MET  27          1HE       MET  27  16.162 -10.150   0.855
  246    HE2  MET  27          2HE       MET  27  16.663 -10.277   2.559
  247    HE3  MET  27          3HE       MET  27  15.530 -11.467   1.872
  248    H    SER  28           H        SER  28  10.979 -13.384   4.540
  249    HA   SER  28           HA       SER  28  11.708 -15.670   3.165
  250    HB2  SER  28          1HB       SER  28  10.709 -15.699   5.379
  251    HB3  SER  28          2HB       SER  28   9.203 -15.004   4.740
  252    HG   SER  28           HG       SER  28   9.085 -17.274   5.014
  253    H    ASP  29           H        ASP  29   8.380 -14.199   3.140
  254    HA   ASP  29           HA       ASP  29   7.963 -15.473   0.610
  255    HB2  ASP  29          1HB       ASP  29   6.210 -15.523   2.483
  256    HB3  ASP  29          2HB       ASP  29   6.196 -13.760   2.232
  257    HD2  ASP  29           HD       ASP  29   3.488 -15.219   0.304
  258    H    LEU  30           H        LEU  30   9.459 -14.072  -0.672
  259    HA   LEU  30           HA       LEU  30   8.837 -11.286  -0.903
  260    HB2  LEU  30          1HB       LEU  30  10.607 -13.288  -1.995
  261    HB3  LEU  30          2HB       LEU  30  10.375 -11.940  -3.133
  262    HG   LEU  30           HG       LEU  30  11.704 -10.554  -1.945
  263   HD11  LEU  30          1HD1      LEU  30  11.642 -10.384   0.557
  264   HD12  LEU  30          2HD1      LEU  30  10.004 -10.343  -0.135
  265   HD13  LEU  30          3HD1      LEU  30  10.618 -11.837   0.616
  266   HD21  LEU  30          1HD2      LEU  30  13.447 -11.668  -0.593
  267   HD22  LEU  30          2HD2      LEU  30  12.455 -13.146  -0.564
  268   HD23  LEU  30          3HD2      LEU  30  13.095 -12.534  -2.108
  269    H    THR  31           H        THR  31   7.518 -14.253  -2.098
  270    HA   THR  31           HA       THR  31   6.876 -13.337  -4.721
  271    HB   THR  31           HB       THR  31   5.755 -15.645  -3.053
  272    HG1  THR  31          1HG       THR  31   7.255 -16.866  -4.346
  273   HG21  THR  31          1HG2      THR  31   5.047 -16.573  -5.229
  274   HG22  THR  31          2HG2      THR  31   4.271 -15.001  -4.921
  275   HG23  THR  31          3HG2      THR  31   5.644 -15.111  -6.048
  276    H    ILE  32           H        ILE  32   5.102 -13.561  -1.594
  277    HA   ILE  32           HA       ILE  32   2.972 -12.004  -2.886
  278    HB   ILE  32           HB       ILE  32   2.722 -14.341  -0.937
  279   HG12  ILE  32          1HG1      ILE  32   2.995 -14.950  -3.257
  280   HG13  ILE  32          2HG1      ILE  32   1.391 -15.374  -2.617
  281   HG21  ILE  32          1HG2      ILE  32   0.295 -13.878  -0.952
  282   HG22  ILE  32          2HG2      ILE  32   1.203 -12.507  -0.276
  283   HG23  ILE  32          3HG2      ILE  32   0.577 -12.426  -1.940
  284   HD11  ILE  32          1HD1      ILE  32   1.228 -14.487  -4.910
  285   HD12  ILE  32          2HD1      ILE  32   0.422 -13.410  -3.745
  286   HD13  ILE  32          3HD1      ILE  32   2.026 -12.987  -4.387
  287    HA   PRO  33           HA       PRO  33   3.864  -9.362   0.459
  288    HB2  PRO  33          1HB       PRO  33   2.047  -7.396  -0.020
  289    HB3  PRO  33          2HB       PRO  33   3.495  -7.540  -1.027
  290    HG2  PRO  33          1HG       PRO  33   0.700  -8.612  -1.541
  291    HG3  PRO  33          2HG       PRO  33   1.786  -7.764  -2.651
  292    HD2  PRO  33          1HD       PRO  33   1.555 -10.499  -2.681
  293    HD3  PRO  33          2HD       PRO  33   3.084  -9.703  -3.074
  294    H    VAL  34           H        VAL  34   2.839  -8.393   2.431
  295    HA   VAL  34           HA       VAL  34   0.973 -10.505   3.260
  296    HB   VAL  34           HB       VAL  34   2.004 -10.319   5.497
  297   HG11  VAL  34          1HG1      VAL  34   4.239 -11.229   4.961
  298   HG12  VAL  34          2HG1      VAL  34   2.995 -11.911   3.887
  299   HG13  VAL  34          3HG1      VAL  34   4.082 -10.633   3.292
  300   HG21  VAL  34          1HG2      VAL  34   3.992  -8.947   5.866
  301   HG22  VAL  34          2HG2      VAL  34   3.826  -8.270   4.229
  302   HG23  VAL  34          3HG2      VAL  34   2.569  -7.964   5.452
  303    H    LYS  35           H        LYS  35   1.825  -7.044   3.308
  304    HA   LYS  35           HA       LYS  35  -0.902  -6.472   4.078
  305    HB2  LYS  35          1HB       LYS  35   1.535  -5.736   5.692
  306    HB3  LYS  35          2HB       LYS  35   0.087  -4.699   5.694
  307    HG2  LYS  35          1HG       LYS  35  -1.219  -6.788   6.386
  308    HG3  LYS  35          2HG       LYS  35   0.362  -7.544   6.693
  309    HD2  LYS  35          1HD       LYS  35  -0.210  -6.700   8.791
  310    HD3  LYS  35          2HD       LYS  35   0.837  -5.425   8.123
  311    HE2  LYS  35          1HE       LYS  35  -1.070  -4.093   7.500
  312    HE3  LYS  35          2HE       LYS  35  -2.188  -5.406   7.935
  313    HZ1  LYS  35          1HZ       LYS  35  -2.079  -3.728   9.649
  314    HZ2  LYS  35          2HZ       LYS  35  -1.488  -5.159  10.220
  315    HZ3  LYS  35          3HZ       LYS  35  -0.451  -3.941   9.816
  316    H    ARG  36           H        ARG  36  -1.606  -4.425   3.325
  317    HA   ARG  36           HA       ARG  36   0.461  -2.872   2.005
  318    HB2  ARG  36          1HB       ARG  36  -2.305  -3.489   0.867
  319    HB3  ARG  36          2HB       ARG  36  -1.108  -2.426   0.108
  320    HG2  ARG  36          1HG       ARG  36  -0.660  -4.390  -1.026
  321    HG3  ARG  36          2HG       ARG  36   0.436  -4.608   0.350
  322    HD2  ARG  36          1HD       ARG  36  -0.731  -6.667   0.187
  323    HD3  ARG  36          2HD       ARG  36  -1.560  -5.819   1.500
  324    HE   ARG  36           HE       ARG  36  -2.854  -5.143  -0.944
  325   HH11  ARG  36          1HH1      ARG  36  -5.238  -7.677  -0.915
  326   HH12  ARG  36          2HH1      ARG  36  -4.777  -6.122  -1.577
  327   HH21  ARG  36          1HH2      ARG  36  -3.864  -8.741   0.625
  328   HH22  ARG  36          2HH2      ARG  36  -2.383  -7.988   1.114
  329    H    GLY  37           H        GLY  37  -0.600  -0.580   1.348
  330    HA2  GLY  37          1HA       GLY  37  -2.827   0.386   2.742
  331    HA3  GLY  37          2HA       GLY  37  -1.413   0.659   3.737
  332    H    CYS  38           H        CYS  38  -2.141   2.998   3.277
  333    HA   CYS  38           HA       CYS  38  -1.201   3.858   0.648
  334    HB2  CYS  38          1HB       CYS  38  -2.870   5.102   2.962
  335    HB3  CYS  38          2HB       CYS  38  -2.614   5.911   1.397
  336    HG   CYS  38           HG       CYS  38  -5.062   5.135   1.606
  337    H    ILE  39           H        ILE  39   0.406   5.583   0.541
  338    HA   ILE  39           HA       ILE  39   1.139   6.910   2.961
  339    HB   ILE  39           HB       ILE  39   2.570   4.784   2.992
  340   HG12  ILE  39          1HG1      ILE  39   4.252   7.233   2.645
  341   HG13  ILE  39          2HG1      ILE  39   3.100   7.068   3.990
  342   HG21  ILE  39          1HG2      ILE  39   4.464   4.706   1.407
  343   HG22  ILE  39          2HG2      ILE  39   2.909   4.603   0.551
  344   HG23  ILE  39          3HG2      ILE  39   3.817   6.132   0.562
  345   HD11  ILE  39          1HD1      ILE  39   5.370   6.402   4.676
  346   HD12  ILE  39          2HD1      ILE  39   4.252   5.018   4.726
  347   HD13  ILE  39          3HD1      ILE  39   5.405   5.184   3.381
  348    H    ASP  40           H        ASP  40   2.725   8.703   2.486
  349    HA   ASP  40           HA       ASP  40   2.059   9.737  -0.105
  350    HB2  ASP  40          1HB       ASP  40   3.067  11.893   0.831
  351    HB3  ASP  40          2HB       ASP  40   1.724  11.078   1.669
  352    HD2  ASP  40           HD       ASP  40   4.481  12.016   3.973
  353    H    VAL  41           H        VAL  41   4.955   8.932   1.931
  354    HA   VAL  41           HA       VAL  41   6.610   9.170  -0.485
  355    HB   VAL  41           HB       VAL  41   7.388   9.434   2.456
  356   HG11  VAL  41          1HG1      VAL  41   9.615  10.051   1.580
  357   HG12  VAL  41          2HG1      VAL  41   9.172   8.398   1.094
  358   HG13  VAL  41          3HG1      VAL  41   9.052   9.733  -0.077
  359   HG21  VAL  41          1HG2      VAL  41   7.873  11.765   1.910
  360   HG22  VAL  41          2HG2      VAL  41   7.246  11.508   0.264
  361   HG23  VAL  41          3HG2      VAL  41   6.156  11.364   1.663
  362    H    CYS  42           H        CYS  42   7.653   7.359  -1.214
  363    HA   CYS  42           HA       CYS  42   6.694   4.927  -0.165
  364    HB2  CYS  42          1HB       CYS  42   7.102   5.322  -2.546
  365    HB3  CYS  42          2HB       CYS  42   8.840   5.425  -2.240
  366    HG   CYS  42           HG       CYS  42   8.286   3.153  -3.446
  367    HA   PRO  43           HA       PRO  43   9.905   4.527   2.805
  368    HB2  PRO  43          1HB       PRO  43   9.185   2.118   3.884
  369    HB3  PRO  43          2HB       PRO  43   8.319   3.600   4.308
  370    HG2  PRO  43          1HG       PRO  43   7.623   1.515   2.217
  371    HG3  PRO  43          2HG       PRO  43   6.564   2.317   3.383
  372    HD2  PRO  43          1HD       PRO  43   6.686   3.147   0.778
  373    HD3  PRO  43          2HD       PRO  43   6.418   4.303   2.089
  374    H    LYS  44           H        LYS  44  11.984   3.832   2.858
  375    HA   LYS  44           HA       LYS  44  12.778   2.334   0.583
  376    HB2  LYS  44          1HB       LYS  44  14.211   3.175   3.117
  377    HB3  LYS  44          2HB       LYS  44  15.005   2.381   1.737
  378    HG2  LYS  44          1HG       LYS  44  14.406   4.277   0.293
  379    HG3  LYS  44          2HG       LYS  44  13.596   5.071   1.664
  380    HD2  LYS  44          1HD       LYS  44  15.716   5.195   2.876
  381    HD3  LYS  44          2HD       LYS  44  16.541   4.339   1.552
  382    HE2  LYS  44          1HE       LYS  44  15.991   6.176   0.017
  383    HE3  LYS  44          2HE       LYS  44  15.159   7.031   1.335
  384    HZ1  LYS  44          1HZ       LYS  44  17.391   7.855   1.011
  385    HZ2  LYS  44          2HZ       LYS  44  17.259   7.151   2.497
  386    HZ3  LYS  44          3HZ       LYS  44  18.031   6.357   1.273
  387    H    ASN  45           H        ASN  45  14.110   0.288   0.740
  388    HA   ASN  45           HA       ASN  45  12.411  -1.588   1.947
  389    HB2  ASN  45          1HB       ASN  45  15.055  -2.165   0.427
  390    HB3  ASN  45          2HB       ASN  45  13.830  -3.148   1.263
  391   HD21  ASN  45          1HD2      ASN  45  13.235  -2.571  -2.482
  392   HD22  ASN  45          2HD2      ASN  45  14.712  -2.811  -1.609
  393    H    SER  46           H        SER  46  12.855  -2.978   3.772
  394    HA   SER  46           HA       SER  46  15.177  -2.153   5.323
  395    HB2  SER  46          1HB       SER  46  13.950  -2.953   7.280
  396    HB3  SER  46          2HB       SER  46  12.977  -1.779   6.366
  397    HG   SER  46           HG       SER  46  11.873  -3.563   5.444
  398    H    LEU  47           H        LEU  47  15.761  -4.168   6.963
  399    HA   LEU  47           HA       LEU  47  16.763  -6.128   5.142
  400    HB2  LEU  47          1HB       LEU  47  16.789  -5.758   8.072
  401    HB3  LEU  47          2HB       LEU  47  17.769  -7.058   7.357
  402    HG   LEU  47           HG       LEU  47  18.117  -4.068   6.907
  403   HD11  LEU  47          1HD1      LEU  47  20.304  -4.415   8.087
  404   HD12  LEU  47          2HD1      LEU  47  18.930  -4.853   9.130
  405   HD13  LEU  47          3HD1      LEU  47  19.882  -6.126   8.331
  406   HD21  LEU  47          1HD2      LEU  47  20.127  -4.693   5.614
  407   HD22  LEU  47          2HD2      LEU  47  19.695  -6.410   5.809
  408   HD23  LEU  47          3HD2      LEU  47  18.624  -5.321   4.895
  409    H    LEU  48           H        LEU  48  13.954  -5.766   7.186
  410    HA   LEU  48           HA       LEU  48  13.651  -8.662   7.402
  411    HB2  LEU  48          1HB       LEU  48  12.271  -6.315   8.548
  412    HB3  LEU  48          2HB       LEU  48  11.743  -7.952   9.004
  413    HG   LEU  48           HG       LEU  48  14.432  -6.662   9.607
  414   HD11  LEU  48          1HD1      LEU  48  13.697  -6.903  11.993
  415   HD12  LEU  48          2HD1      LEU  48  12.566  -5.887  11.068
  416   HD13  LEU  48          3HD1      LEU  48  12.150  -7.580  11.432
  417   HD21  LEU  48          1HD2      LEU  48  14.947  -8.734  10.848
  418   HD22  LEU  48          2HD2      LEU  48  13.425  -9.445  10.258
  419   HD23  LEU  48          3HD2      LEU  48  14.713  -9.016   9.106
  420    H    VAL  49           H        VAL  49  11.932  -5.683   6.277
  421    HA   VAL  49           HA       VAL  49  10.200  -7.463   4.708
  422    HB   VAL  49           HB       VAL  49   8.390  -5.736   5.051
  423   HG11  VAL  49          1HG1      VAL  49   7.825  -6.414   7.359
  424   HG12  VAL  49          2HG1      VAL  49   8.438  -7.794   6.419
  425   HG13  VAL  49          3HG1      VAL  49   9.493  -6.984   7.601
  426   HG21  VAL  49          1HG2      VAL  49   8.610  -4.127   6.876
  427   HG22  VAL  49          2HG2      VAL  49  10.307  -4.614   7.099
  428   HG23  VAL  49          3HG2      VAL  49   9.796  -3.836   5.581
  429    H    LYS  50           H        LYS  50   9.592  -6.689   2.626
  430    HA   LYS  50           HA       LYS  50  11.334  -4.521   1.702
  431    HB2  LYS  50          1HB       LYS  50  11.630  -6.692   0.615
  432    HB3  LYS  50          2HB       LYS  50   9.892  -6.750   0.234
  433    HG2  LYS  50          1HG       LYS  50  10.150  -4.783  -1.230
  434    HG3  LYS  50          2HG       LYS  50  11.889  -4.737  -0.855
  435    HD2  LYS  50          1HD       LYS  50  12.162  -6.981  -1.830
  436    HD3  LYS  50          2HD       LYS  50  10.422  -7.031  -2.202
  437    HE2  LYS  50          1HE       LYS  50  10.693  -5.042  -3.644
  438    HE3  LYS  50          2HE       LYS  50  12.438  -5.050  -3.304
  439    HZ1  LYS  50          1HZ       LYS  50  11.935  -6.126  -5.390
  440    HZ2  LYS  50          2HZ       LYS  50  12.564  -7.220  -4.327
  441    HZ3  LYS  50          3HZ       LYS  50  10.944  -7.213  -4.644
  442    H    TYR  51           H        TYR  51  10.483  -2.810   0.421
  443    HA   TYR  51           HA       TYR  51   7.566  -2.541   0.710
  444    HB2  TYR  51          1HB       TYR  51   9.766  -0.480   0.843
  445    HB3  TYR  51          2HB       TYR  51   8.026  -0.104   0.778
  446    HD1  TYR  51          1HD       TYR  51  10.769  -1.364   2.871
  447    HD2  TYR  51          2HD       TYR  51   6.580  -0.584   2.701
  448    HE1  TYR  51          1HE       TYR  51  10.635  -1.587   5.335
  449    HE2  TYR  51          2HE       TYR  51   6.429  -0.803   5.158
  450    HH   TYR  51           HH       TYR  51   7.557  -1.201   7.096
  451    H    VAL  52           H        VAL  52   6.448  -2.429  -1.177
  452    HA   VAL  52           HA       VAL  52   7.831  -1.143  -3.425
  453    HB   VAL  52           HB       VAL  52   5.797  -3.418  -3.554
  454   HG11  VAL  52          1HG1      VAL  52   6.243  -3.360  -5.984
  455   HG12  VAL  52          2HG1      VAL  52   5.577  -1.810  -5.418
  456   HG13  VAL  52          3HG1      VAL  52   7.319  -1.962  -5.754
  457   HG21  VAL  52          1HG2      VAL  52   7.623  -4.749  -4.483
  458   HG22  VAL  52          2HG2      VAL  52   8.749  -3.399  -4.199
  459   HG23  VAL  52          3HG2      VAL  52   7.966  -4.211  -2.821
  460    H    CYS  53           H        CYS  53   6.769   0.583  -4.316
  461    HA   CYS  53           HA       CYS  53   4.039   1.008  -3.339
  462    HB2  CYS  53          1HB       CYS  53   5.989   3.206  -3.996
  463    HB3  CYS  53          2HB       CYS  53   4.433   3.337  -3.173
  464    HG   CYS  53           HG       CYS  53   6.376   3.870  -1.481
  465    H    CYS  54           H        CYS  54   2.695   2.357  -4.898
  466    HA   CYS  54           HA       CYS  54   3.788   2.769  -7.507
  467    HB2  CYS  54          1HB       CYS  54   1.828   1.503  -8.572
  468    HB3  CYS  54          2HB       CYS  54   3.247   0.594  -8.047
  469    HG   CYS  54           HG       CYS  54   1.075  -0.834  -7.634
  470    H    ASN  55           H        ASN  55   2.172   4.100  -8.838
  471    HA   ASN  55           HA       ASN  55   1.113   5.841  -6.768
  472    HB2  ASN  55          1HB       ASN  55   1.887   7.779  -8.227
  473    HB3  ASN  55          2HB       ASN  55   2.955   6.406  -7.843
  474   HD21  ASN  55          1HD2      ASN  55   3.266   7.465 -11.427
  475   HD22  ASN  55          2HD2      ASN  55   3.302   8.321  -9.921
  476    H    THR  56           H        THR  56  -0.467   3.658  -8.008
  477    HA   THR  56           HA       THR  56  -2.612   5.381  -9.025
  478    HB   THR  56           HB       THR  56  -3.312   3.504 -10.538
  479    HG1  THR  56          1HG       THR  56  -1.712   1.863 -10.942
  480   HG21  THR  56          1HG2      THR  56  -1.587   3.852 -12.272
  481   HG22  THR  56          2HG2      THR  56  -1.989   5.381 -11.452
  482   HG23  THR  56          3HG2      THR  56  -0.487   4.519 -11.044
  483    H    ASP  57           H        ASP  57  -4.768   3.987  -9.003
  484    HA   ASP  57           HA       ASP  57  -5.033   3.601  -6.223
  485    HB2  ASP  57          1HB       ASP  57  -7.064   3.462  -8.519
  486    HB3  ASP  57          2HB       ASP  57  -7.333   3.082  -6.800
  487    HD2  ASP  57           HD       ASP  57  -7.332   6.811  -7.870
  488    H    ARG  58           H        ARG  58  -5.231   1.608  -5.104
  489    HA   ARG  58           HA       ARG  58  -5.305  -0.519  -4.724
  490    HB2  ARG  58          1HB       ARG  58  -7.048  -0.519  -7.228
  491    HB3  ARG  58          2HB       ARG  58  -6.933  -1.892  -6.115
  492    HG2  ARG  58          1HG       ARG  58  -7.983  -0.702  -4.362
  493    HG3  ARG  58          2HG       ARG  58  -7.668   0.876  -5.106
  494    HD2  ARG  58          1HD       ARG  58  -9.459  -1.210  -6.407
  495    HD3  ARG  58          2HD       ARG  58 -10.092  -0.038  -5.240
  496    HE   ARG  58           HE       ARG  58  -8.655   1.470  -7.118
  497   HH11  ARG  58          1HH1      ARG  58 -11.109   1.872  -9.553
  498   HH12  ARG  58          2HH1      ARG  58  -9.599   2.470  -8.899
  499   HH21  ARG  58          1HH2      ARG  58 -12.150   0.038  -8.586
  500   HH22  ARG  58          2HH2      ARG  58 -11.426  -0.735  -7.216
  501    H    CYS  59           H        CYS  59  -3.042   0.403  -6.324
  502    HA   CYS  59           HA       CYS  59  -2.762  -1.434  -8.514
  503    HB2  CYS  59          1HB       CYS  59  -0.656   0.018  -8.753
  504    HB3  CYS  59          2HB       CYS  59  -2.047   1.063  -8.375
  505    HG   CYS  59           HG       CYS  59   0.080   1.968  -7.237
  506    H    ASN  60           H        ASN  60  -1.950  -1.149  -5.103
  507    HA   ASN  60           HA       ASN  60   0.218  -3.008  -5.307
  508    HB2  ASN  60          1HB       ASN  60   0.298  -2.740  -2.807
  509    HB3  ASN  60          2HB       ASN  60   0.367  -1.186  -3.649
  510   HD21  ASN  60          1HD2      ASN  60  -0.278  -0.663  -1.329
  511   HD22  ASN  60          2HD2      ASN  60  -1.970  -0.512  -0.997
  Start of MODEL    9
    1    H1   MET   0          1H        MET   0 -10.736  10.966  -0.911
    2    H2   MET   0          2H        MET   0 -10.652  11.684  -2.226
    3    H    MET   0           H        MET   0 -11.043  10.214  -2.195
    4    H3   MET   0          3H        MET   0 -11.057  10.240  -2.183
    5    HA   MET   0           HA       MET   0  -8.470  11.218  -2.531
    6    HB2  MET   0          1HB       MET   0  -9.038   9.950   0.118
    7    HB3  MET   0          2HB       MET   0  -7.455   9.665  -0.644
    8    HG2  MET   0          1HG       MET   0  -7.116  11.497   0.800
    9    HG3  MET   0          2HG       MET   0  -7.255  12.200  -0.828
   10    HE1  MET   0          1HE       MET   0 -10.438  12.453   2.522
   11    HE2  MET   0          2HE       MET   0  -9.935  10.899   1.812
   12    HE3  MET   0          3HE       MET   0  -8.766  11.878   2.733
   13    H    LEU   1           H        LEU   1  -6.777   9.082  -2.400
   14    HA   LEU   1           HA       LEU   1  -7.949   7.488  -4.475
   15    HB2  LEU   1          1HB       LEU   1  -5.344   7.479  -3.080
   16    HB3  LEU   1          2HB       LEU   1  -5.570   6.521  -4.561
   17    HG   LEU   1           HG       LEU   1  -5.604   9.553  -4.308
   18   HD11  LEU   1          1HD1      LEU   1  -3.613   9.413  -5.829
   19   HD12  LEU   1          2HD1      LEU   1  -3.330   8.529  -4.312
   20   HD13  LEU   1          3HD1      LEU   1  -3.733   7.639  -5.800
   21   HD21  LEU   1          1HD2      LEU   1  -5.923   9.584  -6.758
   22   HD22  LEU   1          2HD2      LEU   1  -6.093   7.812  -6.741
   23   HD23  LEU   1          3HD2      LEU   1  -7.285   8.828  -5.897
   24    H    LYS   2           H        LYS   2  -6.995   4.987  -4.310
   25    HA   LYS   2           HA       LYS   2  -7.908   4.006  -1.703
   26    HB2  LYS   2          1HB       LYS   2  -8.658   2.954  -4.448
   27    HB3  LYS   2          2HB       LYS   2  -9.074   2.187  -2.897
   28    HG2  LYS   2          1HG       LYS   2 -10.431   4.149  -2.288
   29    HG3  LYS   2          2HG       LYS   2 -10.015   4.917  -3.839
   30    HD2  LYS   2          1HD       LYS   2 -11.115   3.107  -5.060
   31    HD3  LYS   2          2HD       LYS   2 -11.480   2.275  -3.530
   32    HE2  LYS   2          1HE       LYS   2 -12.775   4.319  -2.832
   33    HE3  LYS   2          2HE       LYS   2 -12.549   4.947  -4.481
   34    HZ1  LYS   2          1HZ       LYS   2 -14.660   3.827  -4.238
   35    HZ2  LYS   2          2HZ       LYS   2 -13.706   3.010  -5.308
   36    HZ3  LYS   2          3HZ       LYS   2 -13.916   2.428  -3.779
   37    H    CYS   3           H        CYS   3  -6.695   2.340  -0.856
   38    HA   CYS   3           HA       CYS   3  -4.776   1.119  -2.702
   39    HB2  CYS   3          1HB       CYS   3  -4.344   1.825   0.202
   40    HB3  CYS   3          2HB       CYS   3  -3.229   0.877  -0.786
   41    HG   CYS   3           HG       CYS   3  -2.242   3.286  -0.398
   42    H    ASN   4           H        ASN   4  -4.231  -1.177  -2.082
   43    HA   ASN   4           HA       ASN   4  -6.708  -2.431  -1.494
   44    HB2  ASN   4          1HB       ASN   4  -4.046  -3.778  -2.358
   45    HB3  ASN   4          2HB       ASN   4  -5.642  -4.366  -1.834
   46   HD21  ASN   4          1HD2      ASN   4  -5.254  -3.899  -5.602
   47   HD22  ASN   4          2HD2      ASN   4  -4.149  -4.507  -4.414
   48    H    LYS   5           H        LYS   5  -6.803  -4.323   0.118
   49    HA   LYS   5           HA       LYS   5  -4.799  -4.133   2.232
   50    HB2  LYS   5          1HB       LYS   5  -6.675  -2.716   2.913
   51    HB3  LYS   5          2HB       LYS   5  -7.809  -4.051   2.596
   52    HG2  LYS   5          1HG       LYS   5  -6.653  -5.376   4.379
   53    HG3  LYS   5          2HG       LYS   5  -5.674  -3.937   4.751
   54    HD2  LYS   5          1HD       LYS   5  -7.539  -4.072   6.304
   55    HD3  LYS   5          2HD       LYS   5  -7.754  -2.673   5.225
   56    HE2  LYS   5          1HE       LYS   5  -9.317  -3.934   3.848
   57    HE3  LYS   5          2HE       LYS   5  -9.054  -5.387   4.840
   58    HZ1  LYS   5          1HZ       LYS   5 -11.072  -4.241   5.457
   59    HZ2  LYS   5          2HZ       LYS   5  -9.995  -4.203   6.707
   60    HZ3  LYS   5          3HZ       LYS   5 -10.239  -2.856   5.786
   61    H    LEU   6           H        LEU   6  -7.974  -5.826   2.149
   62    HA   LEU   6           HA       LEU   6  -6.475  -8.335   2.237
   63    HB2  LEU   6          1HB       LEU   6  -9.236  -7.488   2.843
   64    HB3  LEU   6          2HB       LEU   6  -8.833  -9.217   2.955
   65    HG   LEU   6           HG       LEU   6  -7.711  -6.954   4.651
   66   HD11  LEU   6          1HD1      LEU   6  -8.806  -8.204   6.530
   67   HD12  LEU   6          2HD1      LEU   6  -9.995  -7.712   5.302
   68   HD13  LEU   6          3HD1      LEU   6  -9.419  -9.395   5.360
   69   HD21  LEU   6          1HD2      LEU   6  -6.456  -8.708   5.856
   70   HD22  LEU   6          2HD2      LEU   6  -7.023  -9.906   4.667
   71   HD23  LEU   6          3HD2      LEU   6  -5.972  -8.567   4.149
   72    H    VAL   7           H        VAL   7  -7.030 -10.099   0.837
   73    HA   VAL   7           HA       VAL   7  -7.883  -9.307  -1.751
   74    HB   VAL   7           HB       VAL   7  -7.755 -11.748  -2.253
   75   HG11  VAL   7          1HG1      VAL   7  -5.355 -12.052  -1.744
   76   HG12  VAL   7          2HG1      VAL   7  -5.688 -10.393  -2.296
   77   HG13  VAL   7          3HG1      VAL   7  -5.437 -10.722  -0.564
   78   HG21  VAL   7          1HG2      VAL   7  -7.073 -13.328  -0.517
   79   HG22  VAL   7          2HG2      VAL   7  -7.218 -12.044   0.706
   80   HG23  VAL   7          3HG2      VAL   7  -8.661 -12.602  -0.174
   81    HA   PRO   8           HA       PRO   8  -8.610 -10.463  -3.257
   82    HB2  PRO   8          1HB       PRO   8 -10.295 -10.281  -5.348
   83    HB3  PRO   8          2HB       PRO   8 -10.180 -11.809  -4.467
   84    HG2  PRO   8          1HG       PRO   8 -12.226  -9.591  -4.180
   85    HG3  PRO   8          2HG       PRO   8 -12.477 -11.342  -4.206
   86    HD2  PRO   8          1HD       PRO   8 -12.339  -9.855  -1.852
   87    HD3  PRO   8          2HD       PRO   8 -11.944 -11.577  -1.930
   88    H    ILE   9           H        ILE   9 -11.172  -8.120  -2.789
   89    HA   ILE   9           HA       ILE   9  -9.554  -6.261  -4.389
   90    HB   ILE   9           HB       ILE   9 -12.555  -6.514  -4.184
   91   HG12  ILE   9          1HG1      ILE   9 -11.558  -8.258  -5.541
   92   HG13  ILE   9          2HG1      ILE   9 -12.441  -7.109  -6.561
   93   HG21  ILE   9          1HG2      ILE   9 -10.810  -4.461  -5.556
   94   HG22  ILE   9          2HG2      ILE   9 -12.509  -4.749  -5.998
   95   HG23  ILE   9          3HG2      ILE   9 -12.099  -4.197  -4.356
   96   HD11  ILE   9          1HD1      ILE   9  -9.436  -6.957  -6.063
   97   HD12  ILE   9          2HD1      ILE   9 -10.157  -7.820  -7.441
   98   HD13  ILE   9          3HD1      ILE   9 -10.378  -6.062  -7.280
   99    H    ALA  10           H        ALA  10 -10.846  -7.040  -1.308
  100    HA   ALA  10           HA       ALA  10 -11.893  -4.772  -0.305
  101    HB1  ALA  10          1HB       ALA  10  -9.980  -5.961   1.562
  102    HB2  ALA  10          2HB       ALA  10 -11.758  -5.953   1.611
  103    HB3  ALA  10          3HB       ALA  10 -10.900  -7.199   0.674
  104    H    TYR  11           H        TYR  11 -11.222  -2.731   0.300
  105    HA   TYR  11           HA       TYR  11  -8.360  -2.168   0.074
  106    HB2  TYR  11          1HB       TYR  11  -8.797  -0.276  -1.361
  107    HB3  TYR  11          2HB       TYR  11  -9.295  -1.804  -2.126
  108    HD1  TYR  11          1HD       TYR  11 -10.506   1.329  -0.575
  109    HD2  TYR  11          2HD       TYR  11 -11.613  -2.228  -2.649
  110    HE1  TYR  11          1HE       TYR  11 -12.765   2.269  -0.966
  111    HE2  TYR  11          2HE       TYR  11 -13.871  -1.307  -3.048
  112    HH   TYR  11           HH       TYR  11 -15.311   0.419  -2.635
  113    H    LYS  12           H        LYS  12  -7.797   0.028   0.936
  114    HA   LYS  12           HA       LYS  12  -9.852   0.987   2.803
  115    HB2  LYS  12          1HB       LYS  12  -6.838   1.321   2.881
  116    HB3  LYS  12          2HB       LYS  12  -7.996   1.936   4.086
  117    HG2  LYS  12          1HG       LYS  12  -8.516  -0.258   4.849
  118    HG3  LYS  12          2HG       LYS  12  -7.693  -1.012   3.462
  119    HD2  LYS  12          1HD       LYS  12  -6.206  -1.273   5.287
  120    HD3  LYS  12          2HD       LYS  12  -5.552   0.073   4.325
  121    HE2  LYS  12          1HE       LYS  12  -6.522   1.692   5.848
  122    HE3  LYS  12          2HE       LYS  12  -7.318   0.396   6.769
  123    HZ1  LYS  12          1HZ       LYS  12  -5.303   1.141   7.843
  124    HZ2  LYS  12          2HZ       LYS  12  -5.141  -0.430   7.364
  125    HZ3  LYS  12          3HZ       LYS  12  -4.403   0.774   6.510
  126    H    THR  13           H        THR  13 -10.216   3.268   2.940
  127    HA   THR  13           HA       THR  13  -9.546   4.685   0.505
  128    HB   THR  13           HB       THR  13 -11.129   5.504   2.987
  129    HG1  THR  13          1HG       THR  13 -12.919   5.172   1.539
  130   HG21  THR  13          1HG2      THR  13 -11.947   7.362   1.581
  131   HG22  THR  13          2HG2      THR  13 -10.180   7.442   1.783
  132   HG23  THR  13          3HG2      THR  13 -10.876   6.836   0.261
  133    H    CYS  14           H        CYS  14  -7.882   6.038   0.218
  134    HA   CYS  14           HA       CYS  14  -5.949   6.118   2.263
  135    HB2  CYS  14          1HB       CYS  14  -6.128   7.548  -0.389
  136    HB3  CYS  14          2HB       CYS  14  -4.718   7.602   0.673
  137    HG   CYS  14           HG       CYS  14  -4.223   6.034  -1.385
  138    HA   PRO  15           HA       PRO  15  -7.202   9.945   4.067
  139    HB2  PRO  15          1HB       PRO  15  -5.143  10.467   5.724
  140    HB3  PRO  15          2HB       PRO  15  -6.221   9.115   6.091
  141    HG2  PRO  15          1HG       PRO  15  -3.529   9.081   4.688
  142    HG3  PRO  15          2HG       PRO  15  -4.139   8.000   5.949
  143    HD2  PRO  15          1HD       PRO  15  -4.203   7.343   3.254
  144    HD3  PRO  15          2HD       PRO  15  -5.369   6.699   4.418
  145    H    GLU  16           H        GLU  16  -6.880  12.220   3.974
  146    HA   GLU  16           HA       GLU  16  -5.673  13.036   1.649
  147    HB2  GLU  16          1HB       GLU  16  -7.346  14.315   2.890
  148    HB3  GLU  16          2HB       GLU  16  -6.189  14.562   4.221
  149    HG2  GLU  16          1HG       GLU  16  -4.748  15.952   2.653
  150    HG3  GLU  16          2HG       GLU  16  -5.962  15.563   1.414
  151    HE2  GLU  16           HE       GLU  16  -6.813  18.748   2.881
  152    H    GLY  17           H        GLY  17  -3.613  13.775   1.086
  153    HA2  GLY  17          1HA       GLY  17  -1.485  14.633   1.632
  154    HA3  GLY  17          2HA       GLY  17  -1.599  13.921   3.228
  155    H    LYS  18           H        LYS  18  -2.789  11.354   1.984
  156    HA   LYS  18           HA       LYS  18  -0.259  10.278   0.990
  157    HB2  LYS  18          1HB       LYS  18  -2.805   8.976   1.996
  158    HB3  LYS  18          2HB       LYS  18  -1.404   8.085   1.355
  159    HG2  LYS  18          1HG       LYS  18  -0.022   9.167   3.184
  160    HG3  LYS  18          2HG       LYS  18  -1.550   9.755   3.882
  161    HD2  LYS  18          1HD       LYS  18  -2.332   7.549   4.292
  162    HD3  LYS  18          2HD       LYS  18  -1.066   6.832   3.266
  163    HE2  LYS  18          1HE       LYS  18   0.635   7.725   4.887
  164    HE3  LYS  18          2HE       LYS  18  -0.711   8.201   5.947
  165    HZ1  LYS  18          1HZ       LYS  18   0.192   6.063   6.563
  166    HZ2  LYS  18          2HZ       LYS  18  -1.365   5.892   6.045
  167    HZ3  LYS  18          3HZ       LYS  18  -0.117   5.450   5.062
  168    H    ASN  19           H        ASN  19  -0.375   8.734  -0.884
  169    HA   ASN  19           HA       ASN  19  -2.487   9.352  -2.712
  170    HB2  ASN  19          1HB       ASN  19  -0.929  11.466  -2.941
  171    HB3  ASN  19          2HB       ASN  19   0.224  10.125  -3.149
  172   HD21  ASN  19          1HD2      ASN  19  -1.952  11.546  -6.239
  173   HD22  ASN  19          2HD2      ASN  19  -2.075  12.176  -4.630
  174    H    LEU  20           H        LEU  20   0.588   7.850  -1.748
  175    HA   LEU  20           HA       LEU  20   0.645   6.171  -4.118
  176    HB2  LEU  20          1HB       LEU  20   2.541   6.295  -1.781
  177    HB3  LEU  20          2HB       LEU  20   2.804   5.464  -3.324
  178    HG   LEU  20           HG       LEU  20   2.647   8.449  -2.840
  179   HD11  LEU  20          1HD1      LEU  20   4.917   8.550  -3.084
  180   HD12  LEU  20          2HD1      LEU  20   4.760   6.952  -2.315
  181   HD13  LEU  20          3HD1      LEU  20   4.995   7.072  -4.074
  182   HD21  LEU  20          1HD2      LEU  20   2.878   6.926  -5.448
  183   HD22  LEU  20          2HD2      LEU  20   1.568   8.020  -4.940
  184   HD23  LEU  20          3HD2      LEU  20   3.194   8.667  -5.262
  185    H    CYS  21           H        CYS  21   0.577   3.843  -4.009
  186    HA   CYS  21           HA       CYS  21  -0.590   2.866  -1.506
  187    HB2  CYS  21          1HB       CYS  21  -0.958   1.888  -4.336
  188    HB3  CYS  21          2HB       CYS  21  -1.508   1.003  -2.909
  189    HG   CYS  21           HG       CYS  21  -3.568   2.112  -4.116
  190    H    TYR  22           H        TYR  22   0.495   1.162  -0.471
  191    HA   TYR  22           HA       TYR  22   2.976   0.298  -1.804
  192    HB2  TYR  22          1HB       TYR  22   4.125   0.455   0.220
  193    HB3  TYR  22          2HB       TYR  22   3.210   1.973   0.053
  194    HD1  TYR  22          1HD       TYR  22   3.396  -1.251   1.869
  195    HD2  TYR  22          2HD       TYR  22   1.477   2.549   1.619
  196    HE1  TYR  22          1HE       TYR  22   2.372  -1.630   4.092
  197    HE2  TYR  22          2HE       TYR  22   0.447   2.186   3.837
  198    HH   TYR  22           HH       TYR  22   0.227   0.780   5.614
  199    H    LYS  23           H        LYS  23   3.729  -1.866  -1.306
  200    HA   LYS  23           HA       LYS  23   1.944  -3.402   0.431
  201    HB2  LYS  23          1HB       LYS  23   2.296  -5.362  -1.004
  202    HB3  LYS  23          2HB       LYS  23   1.441  -4.053  -1.855
  203    HG2  LYS  23          1HG       LYS  23   3.480  -3.438  -3.037
  204    HG3  LYS  23          2HG       LYS  23   4.404  -4.657  -2.128
  205    HD2  LYS  23          1HD       LYS  23   3.720  -5.333  -4.473
  206    HD3  LYS  23          2HD       LYS  23   3.250  -6.457  -3.175
  207    HE2  LYS  23          1HE       LYS  23   0.993  -5.549  -3.160
  208    HE3  LYS  23          2HE       LYS  23   1.446  -4.337  -4.380
  209    HZ1  LYS  23          1HZ       LYS  23   0.306  -6.206  -5.365
  210    HZ2  LYS  23          2HZ       LYS  23   1.858  -6.134  -5.920
  211    HZ3  LYS  23          3HZ       LYS  23   1.437  -7.258  -4.788
  212    H    MET  24           H        MET  24   3.009  -5.024   1.699
  213    HA   MET  24           HA       MET  24   5.884  -4.528   1.809
  214    HB2  MET  24          1HB       MET  24   3.859  -5.202   3.952
  215    HB3  MET  24          2HB       MET  24   5.618  -5.242   4.223
  216    HG2  MET  24          1HG       MET  24   5.781  -2.865   3.747
  217    HG3  MET  24          2HG       MET  24   4.048  -2.799   3.349
  218    HE1  MET  24          1HE       MET  24   5.615  -3.731   7.613
  219    HE2  MET  24          2HE       MET  24   5.645  -4.900   6.270
  220    HE3  MET  24          3HE       MET  24   6.686  -3.457   6.218
  221    H    PHE  25           H        PHE  25   7.307  -6.287   1.834
  222    HA   PHE  25           HA       PHE  25   6.030  -8.931   1.850
  223    HB2  PHE  25          1HB       PHE  25   8.626  -7.843   0.620
  224    HB3  PHE  25          2HB       PHE  25   8.162  -9.545   0.553
  225    HD1  PHE  25          1HD       PHE  25   6.469 -10.290  -0.964
  226    HD2  PHE  25          2HD       PHE  25   7.422  -6.171  -0.689
  227    HE1  PHE  25          1HE       PHE  25   5.198  -9.853  -3.098
  228    HE2  PHE  25          2HE       PHE  25   6.161  -5.730  -2.814
  229    HZ   PHE  25           HZ       PHE  25   5.063  -7.574  -3.994
  230    H    MET  26           H        MET  26   7.419 -10.718   2.799
  231    HA   MET  26           HA       MET  26   9.457  -9.625   4.580
  232    HB2  MET  26          1HB       MET  26   7.814 -12.162   4.756
  233    HB3  MET  26          2HB       MET  26   9.177 -11.777   5.836
  234    HG2  MET  26          1HG       MET  26   7.987  -9.801   6.653
  235    HG3  MET  26          2HG       MET  26   6.631 -10.151   5.554
  236    HE1  MET  26          1HE       MET  26   5.128 -10.953   9.114
  237    HE2  MET  26          2HE       MET  26   6.294  -9.668   8.712
  238    HE3  MET  26          3HE       MET  26   4.934 -10.013   7.614
  239    H    MET  27           H        MET  27  11.543 -10.647   4.616
  240    HA   MET  27           HA       MET  27  12.493 -11.171   2.156
  241    HB2  MET  27          1HB       MET  27  13.443 -11.939   4.908
  242    HB3  MET  27          2HB       MET  27  14.405 -12.324   3.461
  243    HG2  MET  27          1HG       MET  27  13.551  -9.554   4.359
  244    HG3  MET  27          2HG       MET  27  15.177 -10.253   4.539
  245    HE1  MET  27          1HE       MET  27  16.456 -10.486   0.872
  246    HE2  MET  27          2HE       MET  27  16.873 -10.614   2.598
  247    HE3  MET  27          3HE       MET  27  15.721 -11.762   1.872
  248    H    SER  28           H        SER  28  11.063 -13.479   4.479
  249    HA   SER  28           HA       SER  28  11.710 -15.796   3.110
  250    HB2  SER  28          1HB       SER  28  10.755 -15.782   5.346
  251    HB3  SER  28          2HB       SER  28   9.253 -15.054   4.732
  252    HG   SER  28           HG       SER  28   9.086 -17.319   5.029
  253    H    ASP  29           H        ASP  29   8.426 -14.222   3.136
  254    HA   ASP  29           HA       ASP  29   7.912 -15.530   0.641
  255    HB2  ASP  29          1HB       ASP  29   6.212 -15.497   2.568
  256    HB3  ASP  29          2HB       ASP  29   6.230 -13.740   2.272
  257    HD2  ASP  29           HD       ASP  29   3.446 -15.212   0.450
  258    H    LEU  30           H        LEU  30   9.405 -14.198  -0.711
  259    HA   LEU  30           HA       LEU  30   8.850 -11.400  -0.979
  260    HB2  LEU  30          1HB       LEU  30  10.522 -13.471  -2.113
  261    HB3  LEU  30          2HB       LEU  30  10.315 -12.097  -3.225
  262    HG   LEU  30           HG       LEU  30  11.744 -10.796  -2.063
  263   HD11  LEU  30          1HD1      LEU  30  11.730 -10.625   0.441
  264   HD12  LEU  30          2HD1      LEU  30  10.085 -10.503  -0.225
  265   HD13  LEU  30          3HD1      LEU  30  10.636 -12.026   0.515
  266   HD21  LEU  30          1HD2      LEU  30  13.450 -11.996  -0.738
  267   HD22  LEU  30          2HD2      LEU  30  12.386 -13.423  -0.694
  268   HD23  LEU  30          3HD2      LEU  30  13.032 -12.842  -2.248
  269    H    THR  31           H        THR  31   7.413 -14.350  -2.066
  270    HA   THR  31           HA       THR  31   6.751 -13.478  -4.700
  271    HB   THR  31           HB       THR  31   5.627 -15.733  -2.969
  272    HG1  THR  31          1HG       THR  31   7.076 -17.002  -4.272
  273   HG21  THR  31          1HG2      THR  31   4.853 -16.689  -5.110
  274   HG22  THR  31          2HG2      THR  31   4.111 -15.098  -4.814
  275   HG23  THR  31          3HG2      THR  31   5.455 -15.252  -5.969
  276    H    ILE  32           H        ILE  32   5.025 -13.605  -1.544
  277    HA   ILE  32           HA       ILE  32   2.892 -12.057  -2.838
  278    HB   ILE  32           HB       ILE  32   2.653 -14.340  -0.822
  279   HG12  ILE  32          1HG1      ILE  32   2.878 -15.031  -3.116
  280   HG13  ILE  32          2HG1      ILE  32   1.264 -15.389  -2.459
  281   HG21  ILE  32          1HG2      ILE  32   0.230 -13.854  -0.810
  282   HG22  ILE  32          2HG2      ILE  32   1.163 -12.474  -0.185
  283   HG23  ILE  32          3HG2      ILE  32   0.510 -12.431  -1.840
  284   HD11  ILE  32          1HD1      ILE  32   1.118 -14.568  -4.777
  285   HD12  ILE  32          2HD1      ILE  32   0.347 -13.433  -3.643
  286   HD13  ILE  32          3HD1      ILE  32   1.961 -13.075  -4.301
  287    HA   PRO  33           HA       PRO  33   3.882  -9.354   0.437
  288    HB2  PRO  33          1HB       PRO  33   2.147  -7.335  -0.111
  289    HB3  PRO  33          2HB       PRO  33   3.589  -7.565  -1.110
  290    HG2  PRO  33          1HG       PRO  33   0.756  -8.540  -1.600
  291    HG3  PRO  33          2HG       PRO  33   1.877  -7.771  -2.731
  292    HD2  PRO  33          1HD       PRO  33   1.534 -10.497  -2.671
  293    HD3  PRO  33          2HD       PRO  33   3.090  -9.773  -3.097
  294    H    VAL  34           H        VAL  34   2.917  -8.346   2.396
  295    HA   VAL  34           HA       VAL  34   0.893 -10.314   3.220
  296    HB   VAL  34           HB       VAL  34   2.021 -10.291   5.448
  297   HG11  VAL  34          1HG1      VAL  34   4.037 -11.563   4.793
  298   HG12  VAL  34          2HG1      VAL  34   2.638 -12.020   3.793
  299   HG13  VAL  34          3HG1      VAL  34   3.890 -10.941   3.132
  300   HG21  VAL  34          1HG2      VAL  34   4.229  -9.277   5.700
  301   HG22  VAL  34          2HG2      VAL  34   4.089  -8.572   4.070
  302   HG23  VAL  34          3HG2      VAL  34   2.972  -8.065   5.360
  303    H    LYS  35           H        LYS  35   1.930  -6.980   3.043
  304    HA   LYS  35           HA       LYS  35  -0.527  -6.226   4.412
  305    HB2  LYS  35          1HB       LYS  35   2.261  -5.234   5.048
  306    HB3  LYS  35          2HB       LYS  35   0.785  -4.340   5.487
  307    HG2  LYS  35          1HG       LYS  35   0.042  -6.306   6.825
  308    HG3  LYS  35          2HG       LYS  35   1.587  -7.106   6.452
  309    HD2  LYS  35          1HD       LYS  35   2.029  -6.167   8.530
  310    HD3  LYS  35          2HD       LYS  35   2.654  -4.926   7.419
  311    HE2  LYS  35          1HE       LYS  35   0.645  -3.611   7.663
  312    HE3  LYS  35          2HE       LYS  35  -0.128  -4.894   8.623
  313    HZ1  LYS  35          1HZ       LYS  35   0.728  -3.134  10.015
  314    HZ2  LYS  35          2HZ       LYS  35   1.537  -4.540  10.318
  315    HZ3  LYS  35          3HZ       LYS  35   2.254  -3.350   9.428
  316    H    ARG  36           H        ARG  36  -1.559  -4.496   3.446
  317    HA   ARG  36           HA       ARG  36   0.059  -2.911   1.645
  318    HB2  ARG  36          1HB       ARG  36  -2.553  -4.134   0.853
  319    HB3  ARG  36          2HB       ARG  36  -1.665  -2.893  -0.062
  320    HG2  ARG  36          1HG       ARG  36  -0.920  -4.742  -1.173
  321    HG3  ARG  36          2HG       ARG  36   0.289  -4.697   0.134
  322    HD2  ARG  36          1HD       ARG  36  -0.598  -6.927  -0.333
  323    HD3  ARG  36          2HD       ARG  36  -0.865  -6.379   1.338
  324    HE   ARG  36           HE       ARG  36  -3.281  -6.528   0.873
  325   HH11  ARG  36          1HH1      ARG  36  -1.510  -6.694  -2.126
  326   HH12  ARG  36          2HH1      ARG  36  -2.968  -7.173  -2.969
  327   HH21  ARG  36          1HH2      ARG  36  -4.963  -7.069  -0.079
  328   HH22  ARG  36          2HH2      ARG  36  -4.940  -7.387  -1.804
  329    H    GLY  37           H        GLY  37  -0.868  -0.729   1.257
  330    HA2  GLY  37          1HA       GLY  37  -3.265   0.164   2.415
  331    HA3  GLY  37          2HA       GLY  37  -1.969   0.401   3.571
  332    H    CYS  38           H        CYS  38  -2.502   2.757   3.225
  333    HA   CYS  38           HA       CYS  38  -1.554   3.744   0.650
  334    HB2  CYS  38          1HB       CYS  38  -3.059   5.218   2.813
  335    HB3  CYS  38          2HB       CYS  38  -2.673   5.819   1.198
  336    HG   CYS  38           HG       CYS  38  -5.255   5.336   1.370
  337    H    ILE  39           H        ILE  39   0.067   5.492   0.633
  338    HA   ILE  39           HA       ILE  39   0.919   6.560   3.138
  339    HB   ILE  39           HB       ILE  39   2.321   4.433   2.910
  340   HG12  ILE  39          1HG1      ILE  39   4.061   6.848   2.683
  341   HG13  ILE  39          2HG1      ILE  39   2.936   6.652   4.047
  342   HG21  ILE  39          1HG2      ILE  39   4.134   4.469   1.230
  343   HG22  ILE  39          2HG2      ILE  39   2.536   4.462   0.448
  344   HG23  ILE  39          3HG2      ILE  39   3.471   5.973   0.547
  345   HD11  ILE  39          1HD1      ILE  39   5.191   5.852   4.631
  346   HD12  ILE  39          2HD1      ILE  39   4.016   4.515   4.630
  347   HD13  ILE  39          3HD1      ILE  39   5.141   4.713   3.266
  348    H    ASP  40           H        ASP  40   2.488   8.386   2.784
  349    HA   ASP  40           HA       ASP  40   1.792   9.651   0.303
  350    HB2  ASP  40          1HB       ASP  40   2.857  11.704   1.413
  351    HB3  ASP  40          2HB       ASP  40   1.489  10.851   2.170
  352    HD2  ASP  40           HD       ASP  40   4.202  11.524   4.592
  353    H    VAL  41           H        VAL  41   4.729   8.739   2.249
  354    HA   VAL  41           HA       VAL  41   6.329   9.079  -0.194
  355    HB   VAL  41           HB       VAL  41   7.165   9.348   2.731
  356   HG11  VAL  41          1HG1      VAL  41   9.349  10.047   1.807
  357   HG12  VAL  41          2HG1      VAL  41   8.949   8.383   1.317
  358   HG13  VAL  41          3HG1      VAL  41   8.757   9.723   0.161
  359   HG21  VAL  41          1HG2      VAL  41   7.558  11.698   2.194
  360   HG22  VAL  41          2HG2      VAL  41   6.901  11.433   0.560
  361   HG23  VAL  41          3HG2      VAL  41   5.852  11.242   1.985
  362    H    CYS  42           H        CYS  42   7.374   7.298  -0.971
  363    HA   CYS  42           HA       CYS  42   6.648   4.818   0.155
  364    HB2  CYS  42          1HB       CYS  42   6.907   5.181  -2.245
  365    HB3  CYS  42          2HB       CYS  42   8.638   5.459  -2.032
  366    HG   CYS  42           HG       CYS  42   8.251   3.118  -3.169
  367    HA   PRO  43           HA       PRO  43  10.060   4.687   2.899
  368    HB2  PRO  43          1HB       PRO  43   9.509   2.387   4.232
  369    HB3  PRO  43          2HB       PRO  43   8.536   3.835   4.522
  370    HG2  PRO  43          1HG       PRO  43   7.966   1.487   2.689
  371    HG3  PRO  43          2HG       PRO  43   6.868   2.335   3.786
  372    HD2  PRO  43          1HD       PRO  43   6.947   2.869   1.076
  373    HD3  PRO  43          2HD       PRO  43   6.501   4.101   2.262
  374    H    LYS  44           H        LYS  44  12.151   3.942   3.027
  375    HA   LYS  44           HA       LYS  44  12.940   2.457   0.753
  376    HB2  LYS  44          1HB       LYS  44  14.367   3.239   3.312
  377    HB3  LYS  44          2HB       LYS  44  15.161   2.460   1.924
  378    HG2  LYS  44          1HG       LYS  44  14.593   4.388   0.508
  379    HG3  LYS  44          2HG       LYS  44  13.784   5.167   1.889
  380    HD2  LYS  44          1HD       LYS  44  15.901   5.240   3.115
  381    HD3  LYS  44          2HD       LYS  44  16.722   4.403   1.776
  382    HE2  LYS  44          1HE       LYS  44  16.199   6.277   0.278
  383    HE3  LYS  44          2HE       LYS  44  15.371   7.115   1.611
  384    HZ1  LYS  44          1HZ       LYS  44  17.614   7.919   1.310
  385    HZ2  LYS  44          2HZ       LYS  44  17.468   7.186   2.781
  386    HZ3  LYS  44          3HZ       LYS  44  18.234   6.409   1.545
  387    H    ASN  45           H        ASN  45  14.242   0.392   0.879
  388    HA   ASN  45           HA       ASN  45  12.507  -1.468   2.080
  389    HB2  ASN  45          1HB       ASN  45  15.089  -2.090   0.469
  390    HB3  ASN  45          2HB       ASN  45  13.847  -3.051   1.309
  391   HD21  ASN  45          1HD2      ASN  45  13.186  -2.353  -2.403
  392   HD22  ASN  45          2HD2      ASN  45  14.672  -2.672  -1.573
  393    H    SER  46           H        SER  46  13.029  -2.992   3.803
  394    HA   SER  46           HA       SER  46  15.383  -2.207   5.332
  395    HB2  SER  46          1HB       SER  46  14.217  -3.055   7.291
  396    HB3  SER  46          2HB       SER  46  13.185  -1.891   6.429
  397    HG   SER  46           HG       SER  46  12.077  -3.662   5.531
  398    H    LEU  47           H        LEU  47  15.988  -4.297   6.888
  399    HA   LEU  47           HA       LEU  47  16.959  -6.175   4.963
  400    HB2  LEU  47          1HB       LEU  47  17.048  -5.926   7.908
  401    HB3  LEU  47          2HB       LEU  47  18.015  -7.192   7.117
  402    HG   LEU  47           HG       LEU  47  18.347  -4.184   6.790
  403   HD11  LEU  47          1HD1      LEU  47  20.562  -4.579   7.902
  404   HD12  LEU  47          2HD1      LEU  47  19.214  -5.066   8.956
  405   HD13  LEU  47          3HD1      LEU  47  20.149  -6.301   8.078
  406   HD21  LEU  47          1HD2      LEU  47  20.326  -4.747   5.423
  407   HD22  LEU  47          2HD2      LEU  47  19.902  -6.472   5.550
  408   HD23  LEU  47          3HD2      LEU  47  18.809  -5.346   4.712
  409    H    LEU  48           H        LEU  48  14.229  -5.923   7.154
  410    HA   LEU  48           HA       LEU  48  13.939  -8.824   7.231
  411    HB2  LEU  48          1HB       LEU  48  12.581  -6.537   8.522
  412    HB3  LEU  48          2HB       LEU  48  12.081  -8.195   8.927
  413    HG   LEU  48           HG       LEU  48  14.780  -6.908   9.492
  414   HD11  LEU  48          1HD1      LEU  48  14.127  -7.249  11.889
  415   HD12  LEU  48          2HD1      LEU  48  12.960  -6.207  11.044
  416   HD13  LEU  48          3HD1      LEU  48  12.566  -7.915  11.354
  417   HD21  LEU  48          1HD2      LEU  48  15.348  -9.025  10.631
  418   HD22  LEU  48          2HD2      LEU  48  13.811  -9.722  10.065
  419   HD23  LEU  48          3HD2      LEU  48  15.057  -9.240   8.889
  420    H    VAL  49           H        VAL  49  12.184  -5.810   6.274
  421    HA   VAL  49           HA       VAL  49  10.425  -7.531   4.668
  422    HB   VAL  49           HB       VAL  49   8.629  -5.814   5.077
  423   HG11  VAL  49          1HG1      VAL  49   8.097  -6.536   7.381
  424   HG12  VAL  49          2HG1      VAL  49   8.694  -7.899   6.404
  425   HG13  VAL  49          3HG1      VAL  49   9.768  -7.112   7.586
  426   HG21  VAL  49          1HG2      VAL  49   8.878  -4.240   6.929
  427   HG22  VAL  49          2HG2      VAL  49  10.578  -4.735   7.118
  428   HG23  VAL  49          3HG2      VAL  49  10.047  -3.927   5.625
  429    H    LYS  50           H        LYS  50   9.818  -6.706   2.610
  430    HA   LYS  50           HA       LYS  50  11.507  -4.472   1.743
  431    HB2  LYS  50          1HB       LYS  50  11.835  -6.577   0.558
  432    HB3  LYS  50          2HB       LYS  50  10.091  -6.684   0.224
  433    HG2  LYS  50          1HG       LYS  50  10.248  -4.635  -1.157
  434    HG3  LYS  50          2HG       LYS  50  12.002  -4.584  -0.856
  435    HD2  LYS  50          1HD       LYS  50  12.270  -6.765  -1.945
  436    HD3  LYS  50          2HD       LYS  50  10.512  -6.858  -2.213
  437    HE2  LYS  50          1HE       LYS  50  10.632  -4.815  -3.597
  438    HE3  LYS  50          2HE       LYS  50  12.394  -4.771  -3.360
  439    HZ1  LYS  50          1HZ       LYS  50  11.805  -5.793  -5.452
  440    HZ2  LYS  50          2HZ       LYS  50  12.531  -6.899  -4.466
  441    HZ3  LYS  50          3HZ       LYS  50  10.896  -6.939  -4.687
  442    H    TYR  51           H        TYR  51  10.602  -2.720   0.569
  443    HA   TYR  51           HA       TYR  51   7.683  -2.526   0.900
  444    HB2  TYR  51          1HB       TYR  51   9.845  -0.429   1.075
  445    HB3  TYR  51          2HB       TYR  51   8.098  -0.084   1.044
  446    HD1  TYR  51          1HD       TYR  51  10.904  -1.266   3.072
  447    HD2  TYR  51          2HD       TYR  51   6.673  -0.753   2.955
  448    HE1  TYR  51          1HE       TYR  51  10.808  -1.574   5.527
  449    HE2  TYR  51          2HE       TYR  51   6.558  -1.059   5.405
  450    HH   TYR  51           HH       TYR  51   7.727  -1.443   7.321
  451    H    VAL  52           H        VAL  52   6.515  -2.308  -0.948
  452    HA   VAL  52           HA       VAL  52   7.873  -0.988  -3.194
  453    HB   VAL  52           HB       VAL  52   5.772  -3.205  -3.323
  454   HG11  VAL  52          1HG1      VAL  52   6.150  -3.093  -5.765
  455   HG12  VAL  52          2HG1      VAL  52   5.542  -1.542  -5.140
  456   HG13  VAL  52          3HG1      VAL  52   7.269  -1.729  -5.530
  457   HG21  VAL  52          1HG2      VAL  52   7.535  -4.556  -4.342
  458   HG22  VAL  52          2HG2      VAL  52   8.704  -3.245  -4.055
  459   HG23  VAL  52          3HG2      VAL  52   7.940  -4.072  -2.678
  460    H    CYS  53           H        CYS  53   6.826   0.776  -4.034
  461    HA   CYS  53           HA       CYS  53   4.072   1.169  -3.111
  462    HB2  CYS  53          1HB       CYS  53   5.996   3.398  -3.736
  463    HB3  CYS  53          2HB       CYS  53   4.421   3.503  -2.946
  464    HG   CYS  53           HG       CYS  53   6.320   4.080  -1.218
  465    H    CYS  54           H        CYS  54   2.755   2.516  -4.712
  466    HA   CYS  54           HA       CYS  54   3.923   2.968  -7.276
  467    HB2  CYS  54          1HB       CYS  54   2.035   1.670  -8.429
  468    HB3  CYS  54          2HB       CYS  54   3.458   0.788  -7.863
  469    HG   CYS  54           HG       CYS  54   1.310  -0.699  -7.553
  470    H    ASN  55           H        ASN  55   2.282   4.257  -8.661
  471    HA   ASN  55           HA       ASN  55   1.236   5.992  -6.580
  472    HB2  ASN  55          1HB       ASN  55   2.041   7.929  -8.011
  473    HB3  ASN  55          2HB       ASN  55   3.090   6.533  -7.663
  474   HD21  ASN  55          1HD2      ASN  55   3.389   7.643 -11.229
  475   HD22  ASN  55          2HD2      ASN  55   3.460   8.469  -9.709
  476    H    THR  56           H        THR  56  -0.328   3.812  -7.908
  477    HA   THR  56           HA       THR  56  -2.465   5.536  -8.941
  478    HB   THR  56           HB       THR  56  -3.073   3.722 -10.556
  479    HG1  THR  56          1HG       THR  56  -1.459   2.091 -10.938
  480   HG21  THR  56          1HG2      THR  56  -1.266   4.125 -12.190
  481   HG22  THR  56          2HG2      THR  56  -1.705   5.625 -11.339
  482   HG23  THR  56          3HG2      THR  56  -0.225   4.745 -10.888
  483    H    ASP  57           H        ASP  57  -4.586   4.059  -9.080
  484    HA   ASP  57           HA       ASP  57  -4.979   3.609  -6.324
  485    HB2  ASP  57          1HB       ASP  57  -6.873   3.452  -8.730
  486    HB3  ASP  57          2HB       ASP  57  -7.224   3.004  -7.042
  487    HD2  ASP  57           HD       ASP  57  -7.264   6.776  -7.997
  488    H    ARG  58           H        ARG  58  -5.198   1.587  -5.251
  489    HA   ARG  58           HA       ARG  58  -5.157  -0.552  -4.918
  490    HB2  ARG  58          1HB       ARG  58  -6.835  -0.568  -7.466
  491    HB3  ARG  58          2HB       ARG  58  -6.704  -1.952  -6.368
  492    HG2  ARG  58          1HG       ARG  58  -7.826  -0.810  -4.621
  493    HG3  ARG  58          2HG       ARG  58  -7.570   0.780  -5.362
  494    HD2  ARG  58          1HD       ARG  58  -9.243  -1.388  -6.684
  495    HD3  ARG  58          2HD       ARG  58  -9.946  -0.234  -5.540
  496    HE   ARG  58           HE       ARG  58  -8.565   1.344  -7.377
  497   HH11  ARG  58          1HH1      ARG  58 -10.900   1.534  -9.951
  498   HH12  ARG  58          2HH1      ARG  58  -9.484   2.256  -9.217
  499   HH21  ARG  58          1HH2      ARG  58 -11.841  -0.377  -9.030
  500   HH22  ARG  58          2HH2      ARG  58 -11.137  -1.081  -7.615
  501    H    CYS  59           H        CYS  59  -2.894   0.487  -6.441
  502    HA   CYS  59           HA       CYS  59  -2.470  -1.287  -8.653
  503    HB2  CYS  59          1HB       CYS  59  -0.381   0.207  -8.748
  504    HB3  CYS  59          2HB       CYS  59  -1.804   1.219  -8.395
  505    HG   CYS  59           HG       CYS  59   0.257   2.112  -7.133
  506    H    ASN  60           H        ASN  60  -1.833  -1.108  -5.199
  507    HA   ASN  60           HA       ASN  60   0.213  -3.104  -5.327
  508    HB2  ASN  60          1HB       ASN  60   0.016  -3.023  -2.807
  509    HB3  ASN  60          2HB       ASN  60   0.335  -1.438  -3.528
  510   HD21  ASN  60          1HD2      ASN  60  -0.526  -0.991  -1.260
  511   HD22  ASN  60          2HD2      ASN  60  -2.224  -0.680  -1.114
  Start of MODEL   10
    1    H1   MET   0          1H        MET   0  -9.873  11.487  -2.719
    2    H2   MET   0          2H        MET   0  -9.182  11.863  -3.997
    3    H    MET   0           H        MET   0  -9.932  10.542  -3.907
    4    H3   MET   0          3H        MET   0  -9.942  10.572  -3.906
    5    HA   MET   0           HA       MET   0  -7.221  10.923  -3.407
    6    HB2  MET   0          1HB       MET   0  -8.862  10.143  -0.992
    7    HB3  MET   0          2HB       MET   0  -7.110   9.850  -1.112
    8    HG2  MET   0          1HG       MET   0  -6.672  12.223  -1.260
    9    HG3  MET   0          2HG       MET   0  -8.414  12.580  -1.320
   10    HE1  MET   0          1HE       MET   0  -9.646  12.153   2.264
   11    HE2  MET   0          2HE       MET   0  -9.883  12.957   0.693
   12    HE3  MET   0          3HE       MET   0  -9.924  11.179   0.800
   13    H    LEU   1           H        LEU   1  -5.993   8.845  -3.302
   14    HA   LEU   1           HA       LEU   1  -7.312   7.148  -5.141
   15    HB2  LEU   1          1HB       LEU   1  -4.753   7.552  -3.908
   16    HB3  LEU   1          2HB       LEU   1  -4.928   5.856  -4.413
   17    HG   LEU   1           HG       LEU   1  -5.618   6.866  -6.713
   18   HD11  LEU   1          1HD1      LEU   1  -4.505   9.062  -7.194
   19   HD12  LEU   1          2HD1      LEU   1  -5.741   9.228  -5.926
   20   HD13  LEU   1          3HD1      LEU   1  -4.018   9.171  -5.486
   21   HD21  LEU   1          1HD2      LEU   1  -3.258   6.914  -7.441
   22   HD22  LEU   1          2HD2      LEU   1  -2.751   6.977  -5.736
   23   HD23  LEU   1          3HD2      LEU   1  -3.613   5.549  -6.357
   24    H    LYS   2           H        LYS   2  -6.859   4.591  -4.765
   25    HA   LYS   2           HA       LYS   2  -7.735   3.978  -2.032
   26    HB2  LYS   2          1HB       LYS   2  -8.509   2.356  -4.448
   27    HB3  LYS   2          2HB       LYS   2  -9.247   2.375  -2.828
   28    HG2  LYS   2          1HG       LYS   2  -9.369   4.734  -4.727
   29    HG3  LYS   2          2HG       LYS   2 -10.601   3.449  -4.704
   30    HD2  LYS   2          1HD       LYS   2 -11.144   3.929  -2.397
   31    HD3  LYS   2          2HD       LYS   2  -9.801   5.093  -2.281
   32    HE2  LYS   2          1HE       LYS   2 -11.954   6.238  -2.553
   33    HE3  LYS   2          2HE       LYS   2 -10.873   6.533  -3.935
   34    HZ1  LYS   2          1HZ       LYS   2 -13.115   6.047  -4.647
   35    HZ2  LYS   2          2HZ       LYS   2 -12.089   4.860  -5.159
   36    HZ3  LYS   2          3HZ       LYS   2 -13.091   4.588  -3.876
   37    H    CYS   3           H        CYS   3  -6.746   2.213  -1.040
   38    HA   CYS   3           HA       CYS   3  -4.749   0.851  -2.699
   39    HB2  CYS   3          1HB       CYS   3  -4.546   1.530   0.238
   40    HB3  CYS   3          2HB       CYS   3  -3.362   0.608  -0.693
   41    HG   CYS   3           HG       CYS   3  -2.403   3.001  -0.161
   42    H    ASN   4           H        ASN   4  -4.467  -1.457  -2.193
   43    HA   ASN   4           HA       ASN   4  -6.986  -2.582  -1.519
   44    HB2  ASN   4          1HB       ASN   4  -4.428  -4.075  -2.453
   45    HB3  ASN   4          2HB       ASN   4  -6.045  -4.567  -1.892
   46   HD21  ASN   4          1HD2      ASN   4  -5.744  -4.158  -5.662
   47   HD22  ASN   4          2HD2      ASN   4  -4.667  -4.852  -4.496
   48    H    LYS   5           H        LYS   5  -7.293  -4.222   0.219
   49    HA   LYS   5           HA       LYS   5  -5.254  -4.134   2.308
   50    HB2  LYS   5          1HB       LYS   5  -8.186  -3.420   2.603
   51    HB3  LYS   5          2HB       LYS   5  -7.087  -3.743   3.965
   52    HG2  LYS   5          1HG       LYS   5  -6.714  -1.523   1.927
   53    HG3  LYS   5          2HG       LYS   5  -7.462  -1.309   3.527
   54    HD2  LYS   5          1HD       LYS   5  -4.624  -2.229   2.957
   55    HD3  LYS   5          2HD       LYS   5  -5.114  -0.644   3.600
   56    HE2  LYS   5          1HE       LYS   5  -6.238  -1.999   5.494
   57    HE3  LYS   5          2HE       LYS   5  -5.228  -3.350   4.929
   58    HZ1  LYS   5          1HZ       LYS   5  -4.162  -2.122   6.697
   59    HZ2  LYS   5          2HZ       LYS   5  -3.294  -1.975   5.302
   60    HZ3  LYS   5          3HZ       LYS   5  -4.231  -0.722   5.826
   61    H    LEU   6           H        LEU   6  -8.688  -5.211   2.401
   62    HA   LEU   6           HA       LEU   6  -7.752  -7.860   3.075
   63    HB2  LEU   6          1HB       LEU   6  -9.434  -6.841   4.296
   64    HB3  LEU   6          2HB       LEU   6 -10.552  -6.593   2.936
   65    HG   LEU   6           HG       LEU   6 -10.578  -9.126   2.667
   66   HD11  LEU   6          1HD1      LEU   6  -9.962 -10.442   4.712
   67   HD12  LEU   6          2HD1      LEU   6  -8.550  -9.597   4.039
   68   HD13  LEU   6          3HD1      LEU   6  -9.372  -8.948   5.477
   69   HD21  LEU   6          1HD2      LEU   6 -12.239  -9.451   4.466
   70   HD22  LEU   6          2HD2      LEU   6 -11.693  -7.934   5.221
   71   HD23  LEU   6          3HD2      LEU   6 -12.448  -7.906   3.610
   72    H    VAL   7           H        VAL   7  -7.843  -9.660   1.775
   73    HA   VAL   7           HA       VAL   7  -8.078  -9.279  -0.997
   74    HB   VAL   7           HB       VAL   7  -7.980 -11.777  -1.096
   75   HG11  VAL   7          1HG1      VAL   7  -5.794 -12.046   0.026
   76   HG12  VAL   7          2HG1      VAL   7  -5.889 -10.486  -0.826
   77   HG13  VAL   7          3HG1      VAL   7  -6.080 -10.548   0.943
   78   HG21  VAL   7          1HG2      VAL   7  -7.827 -13.081   0.964
   79   HG22  VAL   7          2HG2      VAL   7  -8.186 -11.620   1.914
   80   HG23  VAL   7          3HG2      VAL   7  -9.406 -12.279   0.797
   81    HA   PRO   8           HA       PRO   8  -8.473 -10.638  -2.457
   82    HB2  PRO   8          1HB       PRO   8  -9.575 -10.747  -4.912
   83    HB3  PRO   8          2HB       PRO   8  -9.767 -12.125  -3.820
   84    HG2  PRO   8          1HG       PRO   8 -11.695  -9.856  -4.387
   85    HG3  PRO   8          2HG       PRO   8 -12.028 -11.584  -4.215
   86    HD2  PRO   8          1HD       PRO   8 -12.387  -9.743  -2.150
   87    HD3  PRO   8          2HD       PRO   8 -12.092 -11.464  -1.871
   88    H    ILE   9           H        ILE   9 -10.940  -8.210  -3.026
   89    HA   ILE   9           HA       ILE   9  -8.852  -6.630  -4.360
   90    HB   ILE   9           HB       ILE   9 -11.795  -6.846  -4.997
   91   HG12  ILE   9          1HG1      ILE   9 -10.526  -8.772  -5.744
   92   HG13  ILE   9          2HG1      ILE   9 -11.035  -7.788  -7.128
   93   HG21  ILE   9          1HG2      ILE   9 -11.363  -5.297  -6.827
   94   HG22  ILE   9          2HG2      ILE   9 -10.988  -4.545  -5.259
   95   HG23  ILE   9          3HG2      ILE   9  -9.669  -5.127  -6.304
   96   HD11  ILE   9          1HD1      ILE   9  -8.812  -6.854  -7.363
   97   HD12  ILE   9          2HD1      ILE   9  -8.292  -7.561  -5.816
   98   HD13  ILE   9          3HD1      ILE   9  -8.628  -8.616  -7.209
   99    H    ALA  10           H        ALA  10 -10.974  -6.932  -1.690
  100    HA   ALA  10           HA       ALA  10 -12.169  -4.528  -1.386
  101    HB1  ALA  10          1HB       ALA  10 -12.608  -5.315   0.695
  102    HB2  ALA  10          2HB       ALA  10 -11.760  -6.780   0.144
  103    HB3  ALA  10          3HB       ALA  10 -10.885  -5.545   1.077
  104    H    TYR  11           H        TYR  11 -11.606  -2.433  -0.832
  105    HA   TYR  11           HA       TYR  11  -8.768  -1.946  -0.290
  106    HB2  TYR  11          1HB       TYR  11  -8.949  -0.118  -2.039
  107    HB3  TYR  11          2HB       TYR  11  -9.220  -1.714  -2.747
  108    HD1  TYR  11          1HD       TYR  11 -10.769   1.460  -1.770
  109    HD2  TYR  11          2HD       TYR  11 -11.404  -2.346  -3.566
  110    HE1  TYR  11          1HE       TYR  11 -13.007   2.276  -2.690
  111    HE2  TYR  11          2HE       TYR  11 -13.638  -1.551  -4.493
  112    HH   TYR  11           HH       TYR  11 -15.356   0.387  -3.627
  113    H    LYS  12           H        LYS  12  -8.366   0.306   0.510
  114    HA   LYS  12           HA       LYS  12 -10.793   1.444   1.712
  115    HB2  LYS  12          1HB       LYS  12  -8.012   1.063   2.843
  116    HB3  LYS  12          2HB       LYS  12  -9.177   2.222   3.526
  117    HG2  LYS  12          1HG       LYS  12 -10.758   0.333   3.916
  118    HG3  LYS  12          2HG       LYS  12  -9.504  -0.792   3.342
  119    HD2  LYS  12          1HD       LYS  12  -8.016  -0.099   5.150
  120    HD3  LYS  12          2HD       LYS  12  -9.209   1.101   5.700
  121    HE2  LYS  12          1HE       LYS  12 -10.821  -0.748   6.106
  122    HE3  LYS  12          2HE       LYS  12  -9.553  -1.913   5.660
  123    HZ1  LYS  12          1HZ       LYS  12  -9.706  -1.632   8.040
  124    HZ2  LYS  12          2HZ       LYS  12  -8.243  -1.093   7.499
  125    HZ3  LYS  12          3HZ       LYS  12  -9.420  -0.012   7.913
  126    H    THR  13           H        THR  13 -10.711   3.798   2.051
  127    HA   THR  13           HA       THR  13  -9.407   5.027  -0.219
  128    HB   THR  13           HB       THR  13 -11.235   6.162   1.954
  129    HG1  THR  13          1HG       THR  13 -12.798   6.042   0.235
  130   HG21  THR  13          1HG2      THR  13 -11.521   8.063   0.403
  131   HG22  THR  13          2HG2      THR  13  -9.819   7.887   0.892
  132   HG23  THR  13          3HG2      THR  13 -10.346   7.330  -0.714
  133    H    CYS  14           H        CYS  14  -7.635   6.296  -0.231
  134    HA   CYS  14           HA       CYS  14  -5.982   6.119   2.039
  135    HB2  CYS  14          1HB       CYS  14  -5.726   7.636  -0.555
  136    HB3  CYS  14          2HB       CYS  14  -4.468   7.616   0.685
  137    HG   CYS  14           HG       CYS  14  -3.764   6.059  -1.318
  138    HA   PRO  15           HA       PRO  15  -7.211   9.873   3.939
  139    HB2  PRO  15          1HB       PRO  15  -5.303  10.214   5.818
  140    HB3  PRO  15          2HB       PRO  15  -6.449   8.876   5.976
  141    HG2  PRO  15          1HG       PRO  15  -3.640   8.852   4.820
  142    HG3  PRO  15          2HG       PRO  15  -4.386   7.712   5.947
  143    HD2  PRO  15          1HD       PRO  15  -4.226   7.205   3.239
  144    HD3  PRO  15          2HD       PRO  15  -5.543   6.570   4.234
  145    H    GLU  16           H        GLU  16  -6.839  12.144   4.093
  146    HA   GLU  16           HA       GLU  16  -5.441  13.114   1.937
  147    HB2  GLU  16          1HB       GLU  16  -7.196  14.323   3.138
  148    HB3  GLU  16          2HB       GLU  16  -6.151  14.442   4.574
  149    HG2  GLU  16          1HG       GLU  16  -4.571  15.930   3.252
  150    HG3  GLU  16          2HG       GLU  16  -5.675  15.659   1.885
  151    HE2  GLU  16           HE       GLU  16  -6.624  18.733   3.521
  152    H    GLY  17           H        GLY  17  -3.338  13.899   1.611
  153    HA2  GLY  17          1HA       GLY  17  -1.222  14.588   2.358
  154    HA3  GLY  17          2HA       GLY  17  -1.485  13.778   3.887
  155    H    LYS  18           H        LYS  18  -2.618  11.296   2.602
  156    HA   LYS  18           HA       LYS  18  -0.136  10.243   1.468
  157    HB2  LYS  18          1HB       LYS  18  -2.652   8.903   2.504
  158    HB3  LYS  18          2HB       LYS  18  -1.254   8.046   1.811
  159    HG2  LYS  18          1HG       LYS  18   0.161   9.007   3.642
  160    HG3  LYS  18          2HG       LYS  18  -1.317   9.681   4.368
  161    HD2  LYS  18          1HD       LYS  18  -2.200   7.544   4.837
  162    HD3  LYS  18          2HD       LYS  18  -1.064   6.739   3.729
  163    HE2  LYS  18          1HE       LYS  18   0.803   7.459   5.240
  164    HE3  LYS  18          2HE       LYS  18  -0.422   8.055   6.384
  165    HZ1  LYS  18          1HZ       LYS  18   0.318   5.841   6.946
  166    HZ2  LYS  18          2HZ       LYS  18  -1.278   5.815   6.532
  167    HZ3  LYS  18          3HZ       LYS  18  -0.141   5.263   5.472
  168    H    ASN  19           H        ASN  19  -0.322   8.800  -0.460
  169    HA   ASN  19           HA       ASN  19  -2.569   9.452  -2.129
  170    HB2  ASN  19          1HB       ASN  19  -0.915  11.471  -2.505
  171    HB3  ASN  19          2HB       ASN  19   0.144  10.066  -2.771
  172   HD21  ASN  19          1HD2      ASN  19  -0.396  10.202  -6.156
  173   HD22  ASN  19          2HD2      ASN  19   0.684  10.048  -4.811
  174    H    LEU  20           H        LEU  20   0.528   7.824  -1.412
  175    HA   LEU  20           HA       LEU  20   0.379   6.248  -3.846
  176    HB2  LEU  20          1HB       LEU  20   2.275   6.292  -1.578
  177    HB3  LEU  20          2HB       LEU  20   2.670   5.464  -3.101
  178    HG   LEU  20           HG       LEU  20   2.440   8.451  -2.595
  179   HD11  LEU  20          1HD1      LEU  20   4.798   8.454  -3.450
  180   HD12  LEU  20          2HD1      LEU  20   4.627   7.397  -2.029
  181   HD13  LEU  20          3HD1      LEU  20   4.709   6.690  -3.660
  182   HD21  LEU  20          1HD2      LEU  20   2.873   8.767  -5.006
  183   HD22  LEU  20          2HD2      LEU  20   2.740   7.007  -5.243
  184   HD23  LEU  20          3HD2      LEU  20   1.330   7.940  -4.689
  185    H    CYS  21           H        CYS  21   0.488   3.886  -3.794
  186    HA   CYS  21           HA       CYS  21  -0.671   2.829  -1.321
  187    HB2  CYS  21          1HB       CYS  21  -0.928   1.899  -4.178
  188    HB3  CYS  21          2HB       CYS  21  -1.447   0.935  -2.792
  189    HG   CYS  21           HG       CYS  21  -3.550   1.965  -3.996
  190    H    TYR  22           H        TYR  22   0.561   1.331  -0.194
  191    HA   TYR  22           HA       TYR  22   3.017   0.428  -1.538
  192    HB2  TYR  22          1HB       TYR  22   4.162   0.604   0.477
  193    HB3  TYR  22          2HB       TYR  22   3.210   2.102   0.331
  194    HD1  TYR  22          1HD       TYR  22   3.525  -1.111   2.132
  195    HD2  TYR  22          2HD       TYR  22   1.422   2.590   1.882
  196    HE1  TYR  22          1HE       TYR  22   2.516  -1.543   4.353
  197    HE2  TYR  22          2HE       TYR  22   0.406   2.175   4.097
  198    HH   TYR  22           HH       TYR  22   1.124  -0.777   5.976
  199    H    LYS  23           H        LYS  23   3.781  -1.734  -1.054
  200    HA   LYS  23           HA       LYS  23   2.032  -3.281   0.706
  201    HB2  LYS  23          1HB       LYS  23   2.345  -5.234  -0.762
  202    HB3  LYS  23          2HB       LYS  23   1.430  -3.925  -1.547
  203    HG2  LYS  23          1HG       LYS  23   3.353  -3.286  -2.863
  204    HG3  LYS  23          2HG       LYS  23   4.392  -4.426  -1.976
  205    HD2  LYS  23          1HD       LYS  23   3.693  -5.260  -4.224
  206    HD3  LYS  23          2HD       LYS  23   3.197  -6.319  -2.881
  207    HE2  LYS  23          1HE       LYS  23   0.947  -5.396  -2.941
  208    HE3  LYS  23          2HE       LYS  23   1.426  -4.244  -4.209
  209    HZ1  LYS  23          1HZ       LYS  23   0.285  -6.150  -5.123
  210    HZ2  LYS  23          2HZ       LYS  23   1.845  -6.115  -5.658
  211    HZ3  LYS  23          3HZ       LYS  23   1.401  -7.182  -4.481
  212    H    MET  24           H        MET  24   3.121  -4.840   1.985
  213    HA   MET  24           HA       MET  24   6.008  -4.420   1.954
  214    HB2  MET  24          1HB       MET  24   4.100  -5.164   4.181
  215    HB3  MET  24          2HB       MET  24   5.871  -5.124   4.354
  216    HG2  MET  24          1HG       MET  24   5.764  -2.691   3.663
  217    HG3  MET  24          2HG       MET  24   3.996  -2.806   3.823
  218    HE1  MET  24          1HE       MET  24   3.460  -3.393   7.618
  219    HE2  MET  24          2HE       MET  24   2.706  -2.980   6.059
  220    HE3  MET  24          3HE       MET  24   3.455  -4.578   6.291
  221    H    PHE  25           H        PHE  25   7.405  -6.195   1.862
  222    HA   PHE  25           HA       PHE  25   6.101  -8.824   1.901
  223    HB2  PHE  25          1HB       PHE  25   8.699  -7.759   0.652
  224    HB3  PHE  25          2HB       PHE  25   8.201  -9.452   0.565
  225    HD1  PHE  25          1HD       PHE  25   7.380  -6.030  -0.517
  226    HD2  PHE  25          2HD       PHE  25   6.601 -10.163  -1.043
  227    HE1  PHE  25          1HE       PHE  25   6.100  -5.520  -2.627
  228    HE2  PHE  25          2HE       PHE  25   5.321  -9.660  -3.144
  229    HZ   PHE  25           HZ       PHE  25   5.087  -7.346  -3.911
  230    H    MET  26           H        MET  26   7.511 -10.643   2.794
  231    HA   MET  26           HA       MET  26   9.608  -9.576   4.526
  232    HB2  MET  26          1HB       MET  26   8.000 -12.137   4.710
  233    HB3  MET  26          2HB       MET  26   9.380 -11.738   5.761
  234    HG2  MET  26          1HG       MET  26   8.170  -9.793   6.628
  235    HG3  MET  26          2HG       MET  26   6.795 -10.160   5.559
  236    HE1  MET  26          1HE       MET  26   5.417 -11.025   9.161
  237    HE2  MET  26          2HE       MET  26   6.554  -9.720   8.741
  238    HE3  MET  26          3HE       MET  26   5.164 -10.065   7.683
  239    H    MET  27           H        MET  27  11.688 -10.629   4.499
  240    HA   MET  27           HA       MET  27  12.558 -11.102   1.986
  241    HB2  MET  27          1HB       MET  27  13.612 -11.885   4.696
  242    HB3  MET  27          2HB       MET  27  14.524 -12.248   3.210
  243    HG2  MET  27          1HG       MET  27  13.682  -9.496   4.171
  244    HG3  MET  27          2HG       MET  27  15.320 -10.182   4.275
  245    HE1  MET  27          1HE       MET  27  16.439 -10.366   0.551
  246    HE2  MET  27          2HE       MET  27  16.932 -10.515   2.256
  247    HE3  MET  27          3HE       MET  27  15.754 -11.659   1.566
  248    H    SER  28           H        SER  28  11.197 -13.427   4.327
  249    HA   SER  28           HA       SER  28  11.845 -15.747   2.993
  250    HB2  SER  28          1HB       SER  28  10.852 -15.703   5.206
  251    HB3  SER  28          2HB       SER  28   9.361 -14.987   4.556
  252    HG   SER  28           HG       SER  28   9.192 -17.247   4.882
  253    H    ASP  29           H        ASP  29   8.546 -14.217   2.937
  254    HA   ASP  29           HA       ASP  29   8.130 -15.512   0.411
  255    HB2  ASP  29          1HB       ASP  29   6.384 -15.592   2.289
  256    HB3  ASP  29          2HB       ASP  29   6.345 -13.829   2.046
  257    HD2  ASP  29           HD       ASP  29   3.662 -15.361   0.114
  258    H    LEU  30           H        LEU  30   9.568 -14.111  -0.908
  259    HA   LEU  30           HA       LEU  30   8.990 -11.313  -1.069
  260    HB2  LEU  30          1HB       LEU  30  10.679 -13.327  -2.268
  261    HB3  LEU  30          2HB       LEU  30  10.450 -11.937  -3.354
  262    HG   LEU  30           HG       LEU  30  11.883 -10.652  -2.184
  263   HD11  LEU  30          1HD1      LEU  30  11.845 -10.481   0.318
  264   HD12  LEU  30          2HD1      LEU  30  10.205 -10.362  -0.362
  265   HD13  LEU  30          3HD1      LEU  30  10.751 -11.883   0.382
  266   HD21  LEU  30          1HD2      LEU  30  13.577 -11.849  -0.845
  267   HD22  LEU  30          2HD2      LEU  30  12.515 -13.278  -0.810
  268   HD23  LEU  30          3HD2      LEU  30  13.175 -12.696  -2.358
  269    H    THR  31           H        THR  31   7.603 -14.239  -2.314
  270    HA   THR  31           HA       THR  31   6.903 -13.229  -4.885
  271    HB   THR  31           HB       THR  31   5.815 -15.591  -3.276
  272    HG1  THR  31          1HG       THR  31   7.279 -16.770  -4.649
  273   HG21  THR  31          1HG2      THR  31   5.050 -16.440  -5.466
  274   HG22  THR  31          2HG2      THR  31   4.288 -14.877  -5.082
  275   HG23  THR  31          3HG2      THR  31   5.632 -14.951  -6.246
  276    H    ILE  32           H        ILE  32   5.214 -13.533  -1.723
  277    HA   ILE  32           HA       ILE  32   3.042 -11.961  -2.917
  278    HB   ILE  32           HB       ILE  32   2.866 -14.342  -1.013
  279   HG12  ILE  32          1HG1      ILE  32   3.069 -14.896  -3.355
  280   HG13  ILE  32          2HG1      ILE  32   1.487 -15.344  -2.675
  281   HG21  ILE  32          1HG2      ILE  32   0.436 -13.895  -0.942
  282   HG22  ILE  32          2HG2      ILE  32   1.357 -12.533  -0.263
  283   HG23  ILE  32          3HG2      ILE  32   0.679 -12.418  -1.903
  284   HD11  ILE  32          1HD1      ILE  32   1.248 -14.406  -4.940
  285   HD12  ILE  32          2HD1      ILE  32   0.473 -13.360  -3.727
  286   HD13  ILE  32          3HD1      ILE  32   2.054 -12.913  -4.407
  287    HA   PRO  33           HA       PRO  33   4.068  -9.377   0.428
  288    HB2  PRO  33          1HB       PRO  33   2.238  -7.397   0.041
  289    HB3  PRO  33          2HB       PRO  33   3.657  -7.527  -1.008
  290    HG2  PRO  33          1HG       PRO  33   0.846  -8.584  -1.461
  291    HG3  PRO  33          2HG       PRO  33   1.905  -7.725  -2.588
  292    HD2  PRO  33          1HD       PRO  33   1.664 -10.458  -2.653
  293    HD3  PRO  33          2HD       PRO  33   3.186  -9.662  -3.070
  294    H    VAL  34           H        VAL  34   3.109  -8.395   2.439
  295    HA   VAL  34           HA       VAL  34   1.323 -10.546   3.340
  296    HB   VAL  34           HB       VAL  34   2.411 -10.318   5.536
  297   HG11  VAL  34          1HG1      VAL  34   4.689 -11.080   4.946
  298   HG12  VAL  34          2HG1      VAL  34   3.469 -11.831   3.892
  299   HG13  VAL  34          3HG1      VAL  34   4.458 -10.482   3.286
  300   HG21  VAL  34          1HG2      VAL  34   4.316  -8.826   5.876
  301   HG22  VAL  34          2HG2      VAL  34   4.073  -8.147   4.248
  302   HG23  VAL  34          3HG2      VAL  34   2.826  -7.931   5.500
  303    H    LYS  35           H        LYS  35   2.007  -7.058   3.263
  304    HA   LYS  35           HA       LYS  35  -0.689  -6.594   4.214
  305    HB2  LYS  35          1HB       LYS  35   1.834  -5.658   5.573
  306    HB3  LYS  35          2HB       LYS  35   0.341  -4.692   5.654
  307    HG2  LYS  35          1HG       LYS  35  -0.783  -6.828   6.539
  308    HG3  LYS  35          2HG       LYS  35   0.868  -7.453   6.773
  309    HD2  LYS  35          1HD       LYS  35   0.293  -6.516   8.858
  310    HD3  LYS  35          2HD       LYS  35   1.319  -5.289   8.079
  311    HE2  LYS  35          1HE       LYS  35  -0.579  -3.972   7.464
  312    HE3  LYS  35          2HE       LYS  35  -1.705  -5.264   7.939
  313    HZ1  LYS  35          1HZ       LYS  35  -1.584  -3.535   9.601
  314    HZ2  LYS  35          2HZ       LYS  35  -1.001  -4.951  10.215
  315    HZ3  LYS  35          3HZ       LYS  35   0.042  -3.753   9.774
  316    H    ARG  36           H        ARG  36  -1.568  -4.625   3.431
  317    HA   ARG  36           HA       ARG  36   0.316  -2.982   1.956
  318    HB2  ARG  36          1HB       ARG  36  -2.482  -3.759   1.009
  319    HB3  ARG  36          2HB       ARG  36  -1.391  -2.650   0.160
  320    HG2  ARG  36          1HG       ARG  36  -0.929  -4.611  -0.975
  321    HG3  ARG  36          2HG       ARG  36   0.276  -4.743   0.317
  322    HD2  ARG  36          1HD       ARG  36  -0.850  -6.870   0.163
  323    HD3  ARG  36          2HD       ARG  36  -1.445  -6.092   1.637
  324    HE   ARG  36           HE       ARG  36  -3.190  -5.330  -0.450
  325   HH11  ARG  36          1HH1      ARG  36  -5.418  -7.997  -0.269
  326   HH12  ARG  36          2HH1      ARG  36  -5.155  -6.360  -0.827
  327   HH21  ARG  36          1HH2      ARG  36  -3.739  -9.123   0.872
  328   HH22  ARG  36          2HH2      ARG  36  -2.225  -8.333   1.163
  329    H    GLY  37           H        GLY  37  -0.852  -0.747   1.388
  330    HA2  GLY  37          1HA       GLY  37  -3.141   0.102   2.711
  331    HA3  GLY  37          2HA       GLY  37  -1.799   0.402   3.799
  332    H    CYS  38           H        CYS  38  -2.568   2.725   3.377
  333    HA   CYS  38           HA       CYS  38  -1.525   3.726   0.848
  334    HB2  CYS  38          1HB       CYS  38  -3.164   5.115   2.969
  335    HB3  CYS  38          2HB       CYS  38  -2.648   5.825   1.438
  336    HG   CYS  38           HG       CYS  38  -5.230   5.325   1.356
  337    H    ILE  39           H        ILE  39   0.091   5.462   0.875
  338    HA   ILE  39           HA       ILE  39   0.952   6.467   3.414
  339    HB   ILE  39           HB       ILE  39   2.320   4.334   3.127
  340   HG12  ILE  39          1HG1      ILE  39   4.124   6.696   2.912
  341   HG13  ILE  39          2HG1      ILE  39   2.988   6.549   4.273
  342   HG21  ILE  39          1HG2      ILE  39   4.111   4.369   1.424
  343   HG22  ILE  39          2HG2      ILE  39   2.503   4.404   0.663
  344   HG23  ILE  39          3HG2      ILE  39   3.466   5.896   0.777
  345   HD11  ILE  39          1HD1      ILE  39   5.209   5.665   4.869
  346   HD12  ILE  39          2HD1      ILE  39   3.983   4.375   4.869
  347   HD13  ILE  39          3HD1      ILE  39   5.120   4.524   3.509
  348    H    ASP  40           H        ASP  40   2.569   8.270   3.099
  349    HA   ASP  40           HA       ASP  40   1.811   9.642   0.692
  350    HB2  ASP  40          1HB       ASP  40   2.894  11.649   1.867
  351    HB3  ASP  40          2HB       ASP  40   1.548  10.758   2.619
  352    HD2  ASP  40           HD       ASP  40   4.328  11.338   4.994
  353    H    VAL  41           H        VAL  41   4.794   8.677   2.541
  354    HA   VAL  41           HA       VAL  41   6.334   9.089   0.070
  355    HB   VAL  41           HB       VAL  41   7.246   9.264   2.979
  356   HG11  VAL  41          1HG1      VAL  41   9.406   9.992   2.022
  357   HG12  VAL  41          2HG1      VAL  41   8.991   8.346   1.489
  358   HG13  VAL  41          3HG1      VAL  41   8.771   9.722   0.382
  359   HG21  VAL  41          1HG2      VAL  41   7.628  11.631   2.509
  360   HG22  VAL  41          2HG2      VAL  41   6.928  11.420   0.886
  361   HG23  VAL  41          3HG2      VAL  41   5.916  11.182   2.331
  362    H    CYS  42           H        CYS  42   7.355   7.332  -0.787
  363    HA   CYS  42           HA       CYS  42   6.667   4.818   0.290
  364    HB2  CYS  42          1HB       CYS  42   6.846   5.249  -2.107
  365    HB3  CYS  42          2HB       CYS  42   8.582   5.526  -1.943
  366    HG   CYS  42           HG       CYS  42   8.161   3.215  -3.131
  367    HA   PRO  43           HA       PRO  43  10.144   4.680   2.959
  368    HB2  PRO  43          1HB       PRO  43   9.632   2.325   4.233
  369    HB3  PRO  43          2HB       PRO  43   8.705   3.781   4.621
  370    HG2  PRO  43          1HG       PRO  43   8.001   1.515   2.730
  371    HG3  PRO  43          2HG       PRO  43   6.973   2.341   3.909
  372    HD2  PRO  43          1HD       PRO  43   6.903   2.979   1.236
  373    HD3  PRO  43          2HD       PRO  43   6.599   4.195   2.484
  374    H    LYS  44           H        LYS  44  12.243   3.961   2.990
  375    HA   LYS  44           HA       LYS  44  12.961   2.495   0.676
  376    HB2  LYS  44          1HB       LYS  44  14.479   3.298   3.175
  377    HB3  LYS  44          2HB       LYS  44  15.226   2.528   1.755
  378    HG2  LYS  44          1HG       LYS  44  14.576   4.448   0.363
  379    HG3  LYS  44          2HG       LYS  44  13.813   5.217   1.776
  380    HD2  LYS  44          1HD       LYS  44  15.974   5.323   2.917
  381    HD3  LYS  44          2HD       LYS  44  16.753   4.492   1.549
  382    HE2  LYS  44          1HE       LYS  44  16.141   6.356   0.067
  383    HE3  LYS  44          2HE       LYS  44  15.364   7.188   1.434
  384    HZ1  LYS  44          1HZ       LYS  44  17.582   8.015   1.034
  385    HZ2  LYS  44          2HZ       LYS  44  17.509   7.284   2.511
  386    HZ3  LYS  44          3HZ       LYS  44  18.230   6.513   1.243
  387    H    ASN  45           H        ASN  45  14.324   0.454   0.770
  388    HA   ASN  45           HA       ASN  45  12.638  -1.434   1.997
  389    HB2  ASN  45          1HB       ASN  45  15.187  -1.995   0.312
  390    HB3  ASN  45          2HB       ASN  45  14.013  -2.994   1.202
  391   HD21  ASN  45          1HD2      ASN  45  13.190  -2.330  -2.488
  392   HD22  ASN  45          2HD2      ASN  45  14.720  -2.584  -1.714
  393    H    SER  46           H        SER  46  13.202  -2.942   3.713
  394    HA   SER  46           HA       SER  46  15.611  -2.179   5.165
  395    HB2  SER  46          1HB       SER  46  14.514  -3.075   7.152
  396    HB3  SER  46          2HB       SER  46  13.473  -1.872   6.358
  397    HG   SER  46           HG       SER  46  12.303  -3.600   5.454
  398    H    LEU  47           H        LEU  47  16.265  -4.291   6.673
  399    HA   LEU  47           HA       LEU  47  17.150  -6.168   4.714
  400    HB2  LEU  47          1HB       LEU  47  17.308  -5.951   7.654
  401    HB3  LEU  47          2HB       LEU  47  18.225  -7.235   6.833
  402    HG   LEU  47           HG       LEU  47  18.625  -4.237   6.505
  403   HD11  LEU  47          1HD1      LEU  47  20.846  -4.680   7.586
  404   HD12  LEU  47          2HD1      LEU  47  19.501  -5.131   8.661
  405   HD13  LEU  47          3HD1      LEU  47  20.394  -6.390   7.775
  406   HD21  LEU  47          1HD2      LEU  47  20.571  -4.849   5.112
  407   HD22  LEU  47          2HD2      LEU  47  20.108  -6.564   5.251
  408   HD23  LEU  47          3HD2      LEU  47  19.029  -5.414   4.425
  409    H    LEU  48           H        LEU  48  14.492  -5.906   7.005
  410    HA   LEU  48           HA       LEU  48  14.167  -8.799   7.059
  411    HB2  LEU  48          1HB       LEU  48  12.850  -6.509   8.381
  412    HB3  LEU  48          2HB       LEU  48  12.354  -8.167   8.795
  413    HG   LEU  48           HG       LEU  48  15.074  -6.895   9.296
  414   HD11  LEU  48          1HD1      LEU  48  14.473  -7.224  11.710
  415   HD12  LEU  48          2HD1      LEU  48  13.295  -6.174  10.889
  416   HD13  LEU  48          3HD1      LEU  48  12.896  -7.878  11.213
  417   HD21  LEU  48          1HD2      LEU  48  15.652  -9.013  10.429
  418   HD22  LEU  48          2HD2      LEU  48  14.096  -9.700   9.900
  419   HD23  LEU  48          3HD2      LEU  48  15.318  -9.231   8.695
  420    H    VAL  49           H        VAL  49  12.408  -5.774   6.148
  421    HA   VAL  49           HA       VAL  49  10.596  -7.479   4.586
  422    HB   VAL  49           HB       VAL  49   8.813  -5.755   5.084
  423   HG11  VAL  49          1HG1      VAL  49   8.331  -6.561   7.371
  424   HG12  VAL  49          2HG1      VAL  49   8.894  -7.890   6.328
  425   HG13  VAL  49          3HG1      VAL  49  10.002  -7.157   7.513
  426   HG21  VAL  49          1HG2      VAL  49   9.120  -4.256   6.989
  427   HG22  VAL  49          2HG2      VAL  49  10.819  -4.768   7.118
  428   HG23  VAL  49          3HG2      VAL  49  10.258  -3.900   5.668
  429    H    LYS  50           H        LYS  50   9.896  -6.608   2.572
  430    HA   LYS  50           HA       LYS  50  11.541  -4.342   1.696
  431    HB2  LYS  50          1HB       LYS  50  11.912  -6.429   0.488
  432    HB3  LYS  50          2HB       LYS  50  10.167  -6.574   0.172
  433    HG2  LYS  50          1HG       LYS  50  10.256  -4.516  -1.195
  434    HG3  LYS  50          2HG       LYS  50  12.009  -4.413  -0.905
  435    HD2  LYS  50          1HD       LYS  50  12.330  -6.584  -2.008
  436    HD3  LYS  50          2HD       LYS  50  10.576  -6.711  -2.281
  437    HE2  LYS  50          1HE       LYS  50  10.651  -4.661  -3.649
  438    HE3  LYS  50          2HE       LYS  50  12.408  -4.565  -3.395
  439    HZ1  LYS  50          1HZ       LYS  50  11.868  -5.583  -5.502
  440    HZ2  LYS  50          2HZ       LYS  50  12.620  -6.676  -4.522
  441    HZ3  LYS  50          3HZ       LYS  50  10.991  -6.764  -4.757
  442    H    TYR  51           H        TYR  51  10.577  -2.596   0.570
  443    HA   TYR  51           HA       TYR  51   7.658  -2.496   0.925
  444    HB2  TYR  51          1HB       TYR  51   9.933  -0.432   1.070
  445    HB3  TYR  51          2HB       TYR  51   8.231   0.035   1.117
  446    HD1  TYR  51          1HD       TYR  51  11.039  -1.285   2.979
  447    HD2  TYR  51          2HD       TYR  51   6.835  -0.631   3.055
  448    HE1  TYR  51          1HE       TYR  51  11.044  -1.601   5.514
  449    HE2  TYR  51          2HE       TYR  51   6.821  -0.946   5.586
  450    HH   TYR  51           HH       TYR  51   7.996  -1.419   7.348
  451    H    VAL  52           H        VAL  52   6.463  -2.221  -0.899
  452    HA   VAL  52           HA       VAL  52   7.795  -0.872  -3.142
  453    HB   VAL  52           HB       VAL  52   5.755  -3.140  -3.291
  454   HG11  VAL  52          1HG1      VAL  52   6.151  -3.016  -5.728
  455   HG12  VAL  52          2HG1      VAL  52   5.501  -1.480  -5.106
  456   HG13  VAL  52          3HG1      VAL  52   7.235  -1.626  -5.480
  457   HG21  VAL  52          1HG2      VAL  52   7.558  -4.448  -4.295
  458   HG22  VAL  52          2HG2      VAL  52   8.693  -3.110  -3.995
  459   HG23  VAL  52          3HG2      VAL  52   7.936  -3.959  -2.626
  460    H    CYS  53           H        CYS  53   6.731   0.898  -3.924
  461    HA   CYS  53           HA       CYS  53   3.976   1.237  -2.977
  462    HB2  CYS  53          1HB       CYS  53   5.844   3.510  -3.605
  463    HB3  CYS  53          2HB       CYS  53   4.306   3.555  -2.740
  464    HG   CYS  53           HG       CYS  53   6.271   4.131  -1.086
  465    H    CYS  54           H        CYS  54   2.607   2.556  -4.532
  466    HA   CYS  54           HA       CYS  54   3.693   3.071  -7.116
  467    HB2  CYS  54          1HB       CYS  54   1.896   1.689  -8.267
  468    HB3  CYS  54          2HB       CYS  54   3.330   0.850  -7.670
  469    HG   CYS  54           HG       CYS  54   1.218  -0.696  -7.391
  470    H    ASN  55           H        ASN  55   2.083   4.382  -8.403
  471    HA   ASN  55           HA       ASN  55   0.701   5.876  -6.328
  472    HB2  ASN  55          1HB       ASN  55   1.376   7.972  -7.613
  473    HB3  ASN  55          2HB       ASN  55   2.548   6.696  -7.207
  474   HD21  ASN  55          1HD2      ASN  55   3.042   7.994 -10.690
  475   HD22  ASN  55          2HD2      ASN  55   2.860   8.757  -9.145
  476    H    THR  56           H        THR  56  -0.579   3.649  -7.760
  477    HA   THR  56           HA       THR  56  -2.732   5.190  -9.021
  478    HB   THR  56           HB       THR  56  -3.055   3.262 -10.613
  479    HG1  THR  56          1HG       THR  56  -0.481   2.485  -9.636
  480   HG21  THR  56          1HG2      THR  56  -1.201   3.851 -12.136
  481   HG22  THR  56          2HG2      THR  56  -1.874   5.303 -11.355
  482   HG23  THR  56          3HG2      THR  56  -0.335   4.618 -10.784
  483    H    ASP  57           H        ASP  57  -4.738   3.607  -9.289
  484    HA   ASP  57           HA       ASP  57  -5.294   3.219  -6.544
  485    HB2  ASP  57          1HB       ASP  57  -7.051   2.981  -9.046
  486    HB3  ASP  57          2HB       ASP  57  -7.484   2.596  -7.362
  487    HD2  ASP  57           HD       ASP  57  -7.508   6.325  -8.461
  488    H    ARG  58           H        ARG  58  -5.566   1.211  -5.454
  489    HA   ARG  58           HA       ARG  58  -5.536  -0.921  -5.084
  490    HB2  ARG  58          1HB       ARG  58  -6.980  -1.018  -7.770
  491    HB3  ARG  58          2HB       ARG  58  -6.929  -2.372  -6.627
  492    HG2  ARG  58          1HG       ARG  58  -8.230  -1.213  -5.024
  493    HG3  ARG  58          2HG       ARG  58  -7.914   0.368  -5.764
  494    HD2  ARG  58          1HD       ARG  58  -9.432  -1.829  -7.217
  495    HD3  ARG  58          2HD       ARG  58 -10.257  -0.686  -6.148
  496    HE   ARG  58           HE       ARG  58  -8.659   0.834  -7.922
  497   HH11  ARG  58          1HH1      ARG  58 -10.981   1.221 -10.486
  498   HH12  ARG  58          2HH1      ARG  58  -9.499   1.815  -9.766
  499   HH21  ARG  58          1HH2      ARG  58 -12.091  -0.587  -9.543
  500   HH22  ARG  58          2HH2      ARG  58 -11.445  -1.343  -8.126
  501    H    CYS  59           H        CYS  59  -3.142   0.092  -6.344
  502    HA   CYS  59           HA       CYS  59  -2.527  -1.628  -8.559
  503    HB2  CYS  59          1HB       CYS  59  -0.392  -0.432  -8.604
  504    HB3  CYS  59          2HB       CYS  59  -1.786   0.653  -8.662
  505    HG   CYS  59           HG       CYS  59   0.170   1.793  -7.322
  506    H    ASN  60           H        ASN  60  -2.055  -1.415  -5.055
  507    HA   ASN  60           HA       ASN  60  -0.074  -3.513  -5.156
  508    HB2  ASN  60          1HB       ASN  60   0.036  -3.162  -2.676
  509    HB3  ASN  60          2HB       ASN  60   0.305  -1.654  -3.563
  510   HD21  ASN  60          1HD2      ASN  60  -0.270  -0.960  -1.283
  511   HD22  ASN  60          2HD2      ASN  60  -1.930  -0.592  -0.958
  Start of MODEL   11
    1    H1   MET   0          1H        MET   0 -10.504  10.725  -0.233
    2    H2   MET   0          2H        MET   0 -10.650  11.546  -1.480
    3    H    MET   0           H        MET   0 -10.929  10.051  -1.526
    4    H3   MET   0          3H        MET   0 -10.944  10.076  -1.511
    5    HA   MET   0           HA       MET   0  -8.503  11.284  -2.106
    6    HB2  MET   0          1HB       MET   0  -8.447   9.501   0.336
    7    HB3  MET   0          2HB       MET   0  -6.996   9.996  -0.569
    8    HG2  MET   0          1HG       MET   0  -8.930  11.862   0.841
    9    HG3  MET   0          2HG       MET   0  -7.347  11.349   1.471
   10    HE1  MET   0          1HE       MET   0  -4.856  12.994  -1.065
   11    HE2  MET   0          2HE       MET   0  -5.030  12.069   0.447
   12    HE3  MET   0          3HE       MET   0  -5.518  11.341  -1.104
   13    H    LEU   1           H        LEU   1  -6.673   9.122  -2.128
   14    HA   LEU   1           HA       LEU   1  -7.873   7.608  -4.249
   15    HB2  LEU   1          1HB       LEU   1  -5.252   7.574  -2.885
   16    HB3  LEU   1          2HB       LEU   1  -5.488   6.635  -4.377
   17    HG   LEU   1           HG       LEU   1  -5.578   9.664  -4.099
   18   HD11  LEU   1          1HD1      LEU   1  -3.554   9.588  -5.579
   19   HD12  LEU   1          2HD1      LEU   1  -3.276   8.708  -4.058
   20   HD13  LEU   1          3HD1      LEU   1  -3.622   7.810  -5.555
   21   HD21  LEU   1          1HD2      LEU   1  -5.848   9.693  -6.555
   22   HD22  LEU   1          2HD2      LEU   1  -5.966   7.916  -6.544
   23   HD23  LEU   1          3HD2      LEU   1  -7.205   8.895  -5.724
   24    H    LYS   2           H        LYS   2  -6.918   5.103  -4.186
   25    HA   LYS   2           HA       LYS   2  -7.813   4.026  -1.612
   26    HB2  LYS   2          1HB       LYS   2  -8.611   3.095  -4.388
   27    HB3  LYS   2          2HB       LYS   2  -9.020   2.273  -2.864
   28    HG2  LYS   2          1HG       LYS   2 -10.338   4.234  -2.162
   29    HG3  LYS   2          2HG       LYS   2  -9.937   5.047  -3.695
   30    HD2  LYS   2          1HD       LYS   2 -11.079   3.286  -4.953
   31    HD3  LYS   2          2HD       LYS   2 -11.435   2.416  -3.442
   32    HE2  LYS   2          1HE       LYS   2 -12.687   4.462  -2.669
   33    HE3  LYS   2          2HE       LYS   2 -12.479   5.126  -4.306
   34    HZ1  LYS   2          1HZ       LYS   2 -14.601   4.031  -4.053
   35    HZ2  LYS   2          2HZ       LYS   2 -13.678   3.227  -5.159
   36    HZ3  LYS   2          3HZ       LYS   2 -13.870   2.611  -3.641
   37    H    CYS   3           H        CYS   3  -6.629   2.293  -0.860
   38    HA   CYS   3           HA       CYS   3  -4.726   1.150  -2.773
   39    HB2  CYS   3          1HB       CYS   3  -4.286   1.730   0.151
   40    HB3  CYS   3          2HB       CYS   3  -3.176   0.801  -0.872
   41    HG   CYS   3           HG       CYS   3  -2.157   3.181  -0.391
   42    H    ASN   4           H        ASN   4  -4.172  -1.179  -2.230
   43    HA   ASN   4           HA       ASN   4  -6.683  -2.428  -1.822
   44    HB2  ASN   4          1HB       ASN   4  -3.983  -3.716  -2.653
   45    HB3  ASN   4          2HB       ASN   4  -5.560  -4.373  -2.152
   46   HD21  ASN   4          1HD2      ASN   4  -5.076  -3.626  -5.918
   47   HD22  ASN   4          2HD2      ASN   4  -3.899  -4.120  -4.746
   48    H    LYS   5           H        LYS   5  -6.857  -4.431  -0.334
   49    HA   LYS   5           HA       LYS   5  -5.069  -4.263   1.970
   50    HB2  LYS   5          1HB       LYS   5  -6.999  -2.900   2.532
   51    HB3  LYS   5          2HB       LYS   5  -8.099  -4.196   2.009
   52    HG2  LYS   5          1HG       LYS   5  -7.134  -5.636   3.838
   53    HG3  LYS   5          2HG       LYS   5  -6.253  -4.201   4.416
   54    HD2  LYS   5          1HD       LYS   5  -8.232  -4.330   5.730
   55    HD3  LYS   5          2HD       LYS   5  -8.498  -3.024   4.551
   56    HE2  LYS   5          1HE       LYS   5  -9.816  -4.492   3.147
   57    HE3  LYS   5          2HE       LYS   5  -9.454  -5.880   4.199
   58    HZ1  LYS   5          1HZ       LYS   5 -11.631  -4.971   4.644
   59    HZ2  LYS   5          2HZ       LYS   5 -10.657  -4.775   5.962
   60    HZ3  LYS   5          3HZ       LYS   5 -10.992  -3.489   4.985
   61    H    LEU   6           H        LEU   6  -8.187  -6.005   1.471
   62    HA   LEU   6           HA       LEU   6  -6.617  -8.484   1.607
   63    HB2  LEU   6          1HB       LEU   6  -7.890  -8.019   3.502
   64    HB3  LEU   6          2HB       LEU   6  -9.443  -7.859   2.651
   65    HG   LEU   6           HG       LEU   6  -9.110 -10.274   1.889
   66   HD11  LEU   6          1HD1      LEU   6  -7.612 -11.664   3.343
   67   HD12  LEU   6          2HD1      LEU   6  -6.687 -10.432   2.451
   68   HD13  LEU   6          3HD1      LEU   6  -7.070 -10.186   4.172
   69   HD21  LEU   6          1HD2      LEU   6  -9.973 -11.206   4.008
   70   HD22  LEU   6          2HD2      LEU   6  -9.479  -9.714   4.845
   71   HD23  LEU   6          3HD2      LEU   6 -10.732  -9.654   3.581
   72    H    VAL   7           H        VAL   7  -7.125 -10.174   0.172
   73    HA   VAL   7           HA       VAL   7  -8.238  -9.449  -2.291
   74    HB   VAL   7           HB       VAL   7  -8.187 -11.900  -2.765
   75   HG11  VAL   7          1HG1      VAL   7  -5.763 -12.239  -2.414
   76   HG12  VAL   7          2HG1      VAL   7  -6.104 -10.583  -2.966
   77   HG13  VAL   7          3HG1      VAL   7  -5.742 -10.893  -1.251
   78   HG21  VAL   7          1HG2      VAL   7  -7.417 -13.469  -1.057
   79   HG22  VAL   7          2HG2      VAL   7  -7.456 -12.165   0.154
   80   HG23  VAL   7          3HG2      VAL   7  -8.965 -12.710  -0.618
   81    HA   PRO   8           HA       PRO   8  -9.105 -10.533  -3.747
   82    HB2  PRO   8          1HB       PRO   8 -10.935 -10.213  -5.696
   83    HB3  PRO   8          2HB       PRO   8 -10.807 -11.777  -4.880
   84    HG2  PRO   8          1HG       PRO   8 -12.744  -9.503  -4.357
   85    HG3  PRO   8          2HG       PRO   8 -13.062 -11.242  -4.429
   86    HD2  PRO   8          1HD       PRO   8 -12.699  -9.862  -2.038
   87    HD3  PRO   8          2HD       PRO   8 -12.355 -11.588  -2.213
   88    H    ILE   9           H        ILE   9 -11.521  -8.106  -3.005
   89    HA   ILE   9           HA       ILE   9  -9.946  -6.255  -4.657
   90    HB   ILE   9           HB       ILE   9 -12.940  -6.419  -4.294
   91   HG12  ILE   9          1HG1      ILE   9 -12.076  -8.162  -5.742
   92   HG13  ILE   9          2HG1      ILE   9 -12.980  -6.962  -6.684
   93   HG21  ILE   9          1HG2      ILE   9 -11.284  -4.453  -5.902
   94   HG22  ILE   9          2HG2      ILE   9 -13.060  -4.573  -5.901
   95   HG23  ILE   9          3HG2      ILE   9 -12.198  -4.094  -4.417
   96   HD11  ILE   9          1HD1      ILE   9 -10.766  -7.728  -7.703
   97   HD12  ILE   9          2HD1      ILE   9 -10.937  -5.966  -7.510
   98   HD13  ILE   9          3HD1      ILE   9  -9.949  -6.898  -6.357
   99    H    ALA  10           H        ALA  10 -11.127  -7.082  -1.534
  100    HA   ALA  10           HA       ALA  10 -12.064  -4.789  -0.461
  101    HB1  ALA  10          1HB       ALA  10 -10.168  -6.156   1.319
  102    HB2  ALA  10          2HB       ALA  10 -11.936  -5.996   1.444
  103    HB3  ALA  10          3HB       ALA  10 -11.228  -7.286   0.442
  104    H    TYR  11           H        TYR  11 -11.274  -2.815   0.232
  105    HA   TYR  11           HA       TYR  11  -8.392  -2.385  -0.030
  106    HB2  TYR  11          1HB       TYR  11  -8.754  -0.415  -1.384
  107    HB3  TYR  11          2HB       TYR  11  -9.331  -1.889  -2.200
  108    HD1  TYR  11          1HD       TYR  11 -10.368   1.248  -0.544
  109    HD2  TYR  11          2HD       TYR  11 -11.680  -2.198  -2.686
  110    HE1  TYR  11          1HE       TYR  11 -12.584   2.306  -0.873
  111    HE2  TYR  11          2HE       TYR  11 -13.897  -1.157  -3.024
  112    HH   TYR  11           HH       TYR  11 -15.251   0.617  -2.519
  113    H    LYS  12           H        LYS  12  -7.722  -0.227   0.879
  114    HA   LYS  12           HA       LYS  12  -9.673   0.711   2.864
  115    HB2  LYS  12          1HB       LYS  12  -6.645   0.767   2.778
  116    HB3  LYS  12          2HB       LYS  12  -7.608   1.701   3.947
  117    HG2  LYS  12          1HG       LYS  12  -8.592  -0.446   4.767
  118    HG3  LYS  12          2HG       LYS  12  -7.482  -1.321   3.685
  119    HD2  LYS  12          1HD       LYS  12  -5.555  -0.374   4.842
  120    HD3  LYS  12          2HD       LYS  12  -6.627   0.598   5.878
  121    HE2  LYS  12          1HE       LYS  12  -7.636  -1.520   6.727
  122    HE3  LYS  12          2HE       LYS  12  -6.436  -2.428   5.780
  123    HZ1  LYS  12          1HZ       LYS  12  -5.748  -2.159   8.065
  124    HZ2  LYS  12          2HZ       LYS  12  -4.710  -1.358   7.063
  125    HZ3  LYS  12          3HZ       LYS  12  -5.824  -0.515   7.941
  126    H    THR  13           H        THR  13 -10.024   2.976   3.079
  127    HA   THR  13           HA       THR  13  -9.398   4.486   0.684
  128    HB   THR  13           HB       THR  13 -10.929   5.210   3.233
  129    HG1  THR  13          1HG       THR  13 -12.749   4.950   1.808
  130   HG21  THR  13          1HG2      THR  13 -11.761   7.131   1.922
  131   HG22  THR  13          2HG2      THR  13  -9.990   7.192   2.091
  132   HG23  THR  13          3HG2      THR  13 -10.720   6.655   0.561
  133    H    CYS  14           H        CYS  14  -7.785   5.916   0.431
  134    HA   CYS  14           HA       CYS  14  -5.764   5.847   2.387
  135    HB2  CYS  14          1HB       CYS  14  -6.094   7.419  -0.158
  136    HB3  CYS  14          2HB       CYS  14  -4.642   7.512   0.854
  137    HG   CYS  14           HG       CYS  14  -4.141   6.061  -1.284
  138    HA   PRO  15           HA       PRO  15  -6.945   9.494   4.550
  139    HB2  PRO  15          1HB       PRO  15  -4.801   9.951   6.115
  140    HB3  PRO  15          2HB       PRO  15  -5.806   8.528   6.425
  141    HG2  PRO  15          1HG       PRO  15  -3.212   8.727   4.861
  142    HG3  PRO  15          2HG       PRO  15  -3.702   7.515   6.052
  143    HD2  PRO  15          1HD       PRO  15  -3.920   7.104   3.316
  144    HD3  PRO  15          2HD       PRO  15  -4.978   6.306   4.485
  145    H    GLU  16           H        GLU  16  -6.670  11.784   4.681
  146    HA   GLU  16           HA       GLU  16  -5.860  12.779   2.260
  147    HB2  GLU  16          1HB       GLU  16  -7.398  13.896   3.800
  148    HB3  GLU  16          2HB       GLU  16  -6.071  14.151   4.959
  149    HG2  GLU  16          1HG       GLU  16  -4.956  15.700   3.279
  150    HG3  GLU  16          2HG       GLU  16  -6.315  15.293   2.206
  151    HE2  GLU  16           HE       GLU  16  -7.112  18.350   3.958
  152    H    GLY  17           H        GLY  17  -3.934  13.587   1.425
  153    HA2  GLY  17          1HA       GLY  17  -1.862  14.646   1.637
  154    HA3  GLY  17          2HA       GLY  17  -1.718  14.071   3.286
  155    H    LYS  18           H        LYS  18  -2.871  11.349   2.001
  156    HA   LYS  18           HA       LYS  18  -0.227  10.426   1.137
  157    HB2  LYS  18          1HB       LYS  18  -2.644   8.822   2.008
  158    HB3  LYS  18          2HB       LYS  18  -0.998   8.212   1.718
  159    HG2  LYS  18          1HG       LYS  18  -1.869  10.081   3.949
  160    HG3  LYS  18          2HG       LYS  18  -1.442   8.361   4.118
  161    HD2  LYS  18          1HD       LYS  18   0.841   8.896   3.258
  162    HD3  LYS  18          2HD       LYS  18   0.395  10.618   3.251
  163    HE2  LYS  18          1HE       LYS  18  -0.154  10.362   5.713
  164    HE3  LYS  18          2HE       LYS  18   0.611   8.758   5.631
  165    HZ1  LYS  18          1HZ       LYS  18   2.150  10.441   6.384
  166    HZ2  LYS  18          2HZ       LYS  18   2.642   9.834   4.930
  167    HZ3  LYS  18          3HZ       LYS  18   1.932  11.321   5.007
  168    H    ASN  19           H        ASN  19  -0.094   8.988  -0.740
  169    HA   ASN  19           HA       ASN  19  -2.267   9.558  -2.583
  170    HB2  ASN  19          1HB       ASN  19  -0.392  11.391  -2.911
  171    HB3  ASN  19          2HB       ASN  19   0.531   9.874  -3.040
  172   HD21  ASN  19          1HD2      ASN  19  -1.458  11.427  -6.204
  173   HD22  ASN  19          2HD2      ASN  19  -1.502  12.145  -4.628
  174    H    LEU  20           H        LEU  20   0.883   7.878  -1.896
  175    HA   LEU  20           HA       LEU  20   0.523   6.211  -4.227
  176    HB2  LEU  20          1HB       LEU  20   2.549   6.236  -2.076
  177    HB3  LEU  20          2HB       LEU  20   2.839   5.410  -3.623
  178    HG   LEU  20           HG       LEU  20   2.601   8.409  -3.165
  179   HD11  LEU  20          1HD1      LEU  20   4.986   8.433  -3.942
  180   HD12  LEU  20          2HD1      LEU  20   4.792   7.432  -2.485
  181   HD13  LEU  20          3HD1      LEU  20   4.943   6.660  -4.082
  182   HD21  LEU  20          1HD2      LEU  20   3.107   8.637  -5.572
  183   HD22  LEU  20          2HD2      LEU  20   3.021   6.866  -5.740
  184   HD23  LEU  20          3HD2      LEU  20   1.573   7.788  -5.271
  185    H    CYS  21           H        CYS  21   0.608   3.846  -4.133
  186    HA   CYS  21           HA       CYS  21  -0.507   2.876  -1.604
  187    HB2  CYS  21          1HB       CYS  21  -0.954   1.958  -4.435
  188    HB3  CYS  21          2HB       CYS  21  -1.470   1.026  -3.016
  189    HG   CYS  21           HG       CYS  21  -3.559   2.177  -4.131
  190    H    TYR  22           H        TYR  22   0.689   1.307  -0.528
  191    HA   TYR  22           HA       TYR  22   3.022   0.264  -1.990
  192    HB2  TYR  22          1HB       TYR  22   4.324   0.491  -0.049
  193    HB3  TYR  22          2HB       TYR  22   3.491   2.043  -0.305
  194    HD1  TYR  22          1HD       TYR  22   3.659  -0.979   1.816
  195    HD2  TYR  22          2HD       TYR  22   1.847   2.843   1.278
  196    HE1  TYR  22          1HE       TYR  22   2.762  -1.089   4.123
  197    HE2  TYR  22          2HE       TYR  22   0.944   2.750   3.577
  198    HH   TYR  22           HH       TYR  22   0.792   1.545   5.503
  199    H    LYS  23           H        LYS  23   3.794  -1.865  -1.324
  200    HA   LYS  23           HA       LYS  23   1.989  -3.273   0.502
  201    HB2  LYS  23          1HB       LYS  23   2.268  -5.298  -0.862
  202    HB3  LYS  23          2HB       LYS  23   1.422  -3.999  -1.738
  203    HG2  LYS  23          1HG       LYS  23   3.444  -3.474  -2.990
  204    HG3  LYS  23          2HG       LYS  23   4.363  -4.684  -2.061
  205    HD2  LYS  23          1HD       LYS  23   3.607  -5.425  -4.361
  206    HD3  LYS  23          2HD       LYS  23   3.133  -6.490  -3.016
  207    HE2  LYS  23          1HE       LYS  23   0.903  -5.518  -2.987
  208    HE3  LYS  23          2HE       LYS  23   1.364  -4.362  -4.258
  209    HZ1  LYS  23          1HZ       LYS  23   0.151  -6.230  -5.154
  210    HZ2  LYS  23          2HZ       LYS  23   1.692  -6.222  -5.741
  211    HZ3  LYS  23          3HZ       LYS  23   1.265  -7.294  -4.563
  212    H    MET  24           H        MET  24   3.027  -4.963   1.749
  213    HA   MET  24           HA       MET  24   5.902  -4.475   1.878
  214    HB2  MET  24          1HB       MET  24   3.884  -5.136   4.032
  215    HB3  MET  24          2HB       MET  24   5.646  -5.106   4.294
  216    HG2  MET  24          1HG       MET  24   5.717  -2.736   3.748
  217    HG3  MET  24          2HG       MET  24   3.977  -2.744   3.379
  218    HE1  MET  24          1HE       MET  24   5.617  -3.558   7.639
  219    HE2  MET  24          2HE       MET  24   5.641  -4.751   6.317
  220    HE3  MET  24          3HE       MET  24   6.669  -3.300   6.227
  221    H    PHE  25           H        PHE  25   7.306  -6.240   1.890
  222    HA   PHE  25           HA       PHE  25   6.016  -8.877   1.966
  223    HB2  PHE  25          1HB       PHE  25   8.600  -7.822   0.682
  224    HB3  PHE  25          2HB       PHE  25   8.124  -9.522   0.647
  225    HD1  PHE  25          1HD       PHE  25   7.424  -6.176  -0.643
  226    HD2  PHE  25          2HD       PHE  25   6.362 -10.273  -0.823
  227    HE1  PHE  25          1HE       PHE  25   6.130  -5.747  -2.765
  228    HE2  PHE  25          2HE       PHE  25   5.067  -9.851  -2.935
  229    HZ   PHE  25           HZ       PHE  25   4.968  -7.595  -3.879
  230    H    MET  26           H        MET  26   7.394 -10.654   2.932
  231    HA   MET  26           HA       MET  26   9.471  -9.555   4.665
  232    HB2  MET  26          1HB       MET  26   7.837 -12.093   4.872
  233    HB3  MET  26          2HB       MET  26   9.216 -11.705   5.928
  234    HG2  MET  26          1HG       MET  26   8.036  -9.728   6.762
  235    HG3  MET  26          2HG       MET  26   6.664 -10.083   5.685
  236    HE1  MET  26          1HE       MET  26   5.215 -10.881   9.268
  237    HE2  MET  26          2HE       MET  26   6.370  -9.593   8.844
  238    HE3  MET  26          3HE       MET  26   4.996  -9.948   7.768
  239    H    MET  27           H        MET  27  11.559 -10.563   4.668
  240    HA   MET  27           HA       MET  27  12.473 -11.106   2.198
  241    HB2  MET  27          1HB       MET  27  13.472 -11.844   4.939
  242    HB3  MET  27          2HB       MET  27  14.409 -12.241   3.478
  243    HG2  MET  27          1HG       MET  27  13.566  -9.467   4.375
  244    HG3  MET  27          2HG       MET  27  15.199 -10.160   4.513
  245    HE1  MET  27          1HE       MET  27  16.370 -10.414   0.810
  246    HE2  MET  27          2HE       MET  27  16.838 -10.534   2.523
  247    HE3  MET  27          3HE       MET  27  15.665 -11.684   1.837
  248    H    SER  28           H        SER  28  11.089 -13.393   4.567
  249    HA   SER  28           HA       SER  28  11.791 -15.717   3.213
  250    HB2  SER  28          1HB       SER  28  10.954 -15.700   5.497
  251    HB3  SER  28          2HB       SER  28   9.390 -15.056   4.948
  252    HG   SER  28           HG       SER  28   9.348 -17.320   5.292
  253    H    ASP  29           H        ASP  29   8.574 -13.991   3.289
  254    HA   ASP  29           HA       ASP  29   7.882 -15.448   0.902
  255    HB2  ASP  29          1HB       ASP  29   6.284 -15.334   2.910
  256    HB3  ASP  29          2HB       ASP  29   6.308 -13.588   2.559
  257    HD2  ASP  29           HD       ASP  29   3.418 -15.082   0.927
  258    H    LEU  30           H        LEU  30   9.346 -14.162  -0.539
  259    HA   LEU  30           HA       LEU  30   8.792 -11.368  -0.863
  260    HB2  LEU  30          1HB       LEU  30  10.424 -13.474  -1.998
  261    HB3  LEU  30          2HB       LEU  30  10.191 -12.123  -3.131
  262    HG   LEU  30           HG       LEU  30  11.658 -10.805  -2.037
  263   HD11  LEU  30          1HD1      LEU  30  11.720 -10.584   0.461
  264   HD12  LEU  30          2HD1      LEU  30  10.055 -10.467  -0.158
  265   HD13  LEU  30          3HD1      LEU  30  10.621 -11.977   0.595
  266   HD21  LEU  30          1HD2      LEU  30  13.398 -11.986  -0.741
  267   HD22  LEU  30          2HD2      LEU  30  12.329 -13.407  -0.636
  268   HD23  LEU  30          3HD2      LEU  30  12.931 -12.860  -2.219
  269    H    THR  31           H        THR  31   7.319 -14.344  -1.826
  270    HA   THR  31           HA       THR  31   6.579 -13.539  -4.464
  271    HB   THR  31           HB       THR  31   5.502 -15.747  -2.641
  272    HG1  THR  31          1HG       THR  31   6.910 -17.053  -3.954
  273   HG21  THR  31          1HG2      THR  31   4.662 -16.756  -4.734
  274   HG22  THR  31          2HG2      THR  31   3.932 -15.156  -4.456
  275   HG23  THR  31          3HG2      THR  31   5.241 -15.342  -5.647
  276    H    ILE  32           H        ILE  32   4.953 -13.580  -1.250
  277    HA   ILE  32           HA       ILE  32   2.773 -12.076  -2.519
  278    HB   ILE  32           HB       ILE  32   2.607 -14.305  -0.437
  279   HG12  ILE  32          1HG1      ILE  32   2.762 -15.055  -2.719
  280   HG13  ILE  32          2HG1      ILE  32   1.171 -15.400  -2.002
  281   HG21  ILE  32          1HG2      ILE  32   0.184 -13.826  -0.361
  282   HG22  ILE  32          2HG2      ILE  32   1.129 -12.427   0.197
  283   HG23  ILE  32          3HG2      ILE  32   0.425 -12.429  -1.437
  284   HD11  ILE  32          1HD1      ILE  32   0.949 -14.641  -4.335
  285   HD12  ILE  32          2HD1      ILE  32   0.209 -13.479  -3.208
  286   HD13  ILE  32          3HD1      ILE  32   1.800 -13.134  -3.926
  287    HA   PRO  33           HA       PRO  33   3.842  -9.289   0.662
  288    HB2  PRO  33          1HB       PRO  33   2.114  -7.273   0.093
  289    HB3  PRO  33          2HB       PRO  33   3.531  -7.543  -0.932
  290    HG2  PRO  33          1HG       PRO  33   0.678  -8.506  -1.329
  291    HG3  PRO  33          2HG       PRO  33   1.779  -7.779  -2.506
  292    HD2  PRO  33          1HD       PRO  33   1.414 -10.502  -2.356
  293    HD3  PRO  33          2HD       PRO  33   2.961  -9.803  -2.849
  294    H    VAL  34           H        VAL  34   2.914  -8.223   2.608
  295    HA   VAL  34           HA       VAL  34   0.879 -10.142   3.516
  296    HB   VAL  34           HB       VAL  34   2.030 -10.058   5.730
  297   HG11  VAL  34          1HG1      VAL  34   4.034 -11.359   5.098
  298   HG12  VAL  34          2HG1      VAL  34   2.625 -11.841   4.125
  299   HG13  VAL  34          3HG1      VAL  34   3.877 -10.789   3.420
  300   HG21  VAL  34          1HG2      VAL  34   4.245  -9.046   5.931
  301   HG22  VAL  34          2HG2      VAL  34   4.095  -8.393   4.282
  302   HG23  VAL  34          3HG2      VAL  34   2.990  -7.840   5.564
  303    H    LYS  35           H        LYS  35   1.956  -6.824   3.232
  304    HA   LYS  35           HA       LYS  35  -0.488  -5.997   4.581
  305    HB2  LYS  35          1HB       LYS  35   2.319  -5.061   5.223
  306    HB3  LYS  35          2HB       LYS  35   0.868  -4.111   5.621
  307    HG2  LYS  35          1HG       LYS  35   0.047  -6.010   7.003
  308    HG3  LYS  35          2HG       LYS  35   1.563  -6.879   6.662
  309    HD2  LYS  35          1HD       LYS  35   2.021  -5.905   8.722
  310    HD3  LYS  35          2HD       LYS  35   2.708  -4.722   7.584
  311    HE2  LYS  35          1HE       LYS  35   0.756  -3.317   7.773
  312    HE3  LYS  35          2HE       LYS  35  -0.080  -4.540   8.757
  313    HZ1  LYS  35          1HZ       LYS  35   0.834  -2.781  10.112
  314    HZ2  LYS  35          2HZ       LYS  35   1.581  -4.210  10.460
  315    HZ3  LYS  35          3HZ       LYS  35   2.356  -3.077   9.548
  316    H    ARG  36           H        ARG  36  -1.472  -4.255   3.583
  317    HA   ARG  36           HA       ARG  36   0.181  -2.753   1.746
  318    HB2  ARG  36          1HB       ARG  36  -2.477  -3.888   0.971
  319    HB3  ARG  36          2HB       ARG  36  -1.494  -2.751   0.020
  320    HG2  ARG  36          1HG       ARG  36  -0.885  -4.715  -0.989
  321    HG3  ARG  36          2HG       ARG  36   0.339  -4.646   0.301
  322    HD2  ARG  36          1HD       ARG  36  -0.511  -6.846   0.143
  323    HD3  ARG  36          2HD       ARG  36  -1.085  -6.110   1.658
  324    HE   ARG  36           HE       ARG  36  -3.371  -6.383   0.783
  325   HH11  ARG  36          1HH1      ARG  36  -1.080  -6.825  -1.809
  326   HH12  ARG  36          2HH1      ARG  36  -2.359  -7.430  -2.844
  327   HH21  ARG  36          1HH2      ARG  36  -4.848  -7.065  -0.392
  328   HH22  ARG  36          2HH2      ARG  36  -4.508  -7.567  -2.038
  329    H    GLY  37           H        GLY  37  -0.682  -0.559   1.313
  330    HA2  GLY  37          1HA       GLY  37  -3.025   0.431   2.533
  331    HA3  GLY  37          2HA       GLY  37  -1.670   0.658   3.621
  332    H    CYS  38           H        CYS  38  -2.151   3.020   3.238
  333    HA   CYS  38           HA       CYS  38  -1.250   3.890   0.593
  334    HB2  CYS  38          1HB       CYS  38  -2.951   5.133   2.880
  335    HB3  CYS  38          2HB       CYS  38  -2.703   5.915   1.300
  336    HG   CYS  38           HG       CYS  38  -5.140   5.108   1.519
  337    H    ILE  39           H        ILE  39   0.343   5.619   0.503
  338    HA   ILE  39           HA       ILE  39   1.042   6.962   2.921
  339    HB   ILE  39           HB       ILE  39   2.470   4.837   2.997
  340   HG12  ILE  39          1HG1      ILE  39   4.153   7.286   2.653
  341   HG13  ILE  39          2HG1      ILE  39   2.987   7.123   3.987
  342   HG21  ILE  39          1HG2      ILE  39   4.390   4.740   1.444
  343   HG22  ILE  39          2HG2      ILE  39   2.848   4.631   0.563
  344   HG23  ILE  39          3HG2      ILE  39   3.759   6.158   0.574
  345   HD11  ILE  39          1HD1      ILE  39   5.252   6.468   4.701
  346   HD12  ILE  39          2HD1      ILE  39   4.138   5.080   4.745
  347   HD13  ILE  39          3HD1      ILE  39   5.305   5.245   3.413
  348    H    ASP  40           H        ASP  40   2.644   8.748   2.453
  349    HA   ASP  40           HA       ASP  40   2.015   9.766  -0.151
  350    HB2  ASP  40          1HB       ASP  40   3.021  11.921   0.776
  351    HB3  ASP  40          2HB       ASP  40   1.674  11.116   1.617
  352    HD2  ASP  40           HD       ASP  40   4.428  12.064   3.920
  353    H    VAL  41           H        VAL  41   4.883   8.945   1.914
  354    HA   VAL  41           HA       VAL  41   6.549   9.094  -0.503
  355    HB   VAL  41           HB       VAL  41   7.335   9.429   2.430
  356   HG11  VAL  41          1HG1      VAL  41   9.571   9.981   1.535
  357   HG12  VAL  41          2HG1      VAL  41   9.097   8.324   1.095
  358   HG13  VAL  41          3HG1      VAL  41   8.999   9.628  -0.113
  359   HG21  VAL  41          1HG2      VAL  41   7.860  11.735   1.819
  360   HG22  VAL  41          2HG2      VAL  41   7.227  11.444   0.182
  361   HG23  VAL  41          3HG2      VAL  41   6.137  11.358   1.587
  362    H    CYS  42           H        CYS  42   7.528   7.237  -1.184
  363    HA   CYS  42           HA       CYS  42   6.611   4.847  -0.015
  364    HB2  CYS  42          1HB       CYS  42   6.953   5.084  -2.394
  365    HB3  CYS  42          2HB       CYS  42   8.696   5.317  -2.157
  366    HG   CYS  42           HG       CYS  42   8.254   2.950  -3.220
  367    HA   PRO  43           HA       PRO  43   9.858   4.592   2.929
  368    HB2  PRO  43          1HB       PRO  43   9.214   2.190   4.072
  369    HB3  PRO  43          2HB       PRO  43   8.309   3.658   4.465
  370    HG2  PRO  43          1HG       PRO  43   7.659   1.503   2.431
  371    HG3  PRO  43          2HG       PRO  43   6.584   2.302   3.586
  372    HD2  PRO  43          1HD       PRO  43   6.666   3.072   0.960
  373    HD3  PRO  43          2HD       PRO  43   6.374   4.252   2.245
  374    H    LYS  44           H        LYS  44  11.952   3.914   3.030
  375    HA   LYS  44           HA       LYS  44  12.786   2.490   0.729
  376    HB2  LYS  44          1HB       LYS  44  14.192   3.301   3.290
  377    HB3  LYS  44          2HB       LYS  44  15.009   2.565   1.891
  378    HG2  LYS  44          1HG       LYS  44  14.363   4.486   0.496
  379    HG3  LYS  44          2HG       LYS  44  13.534   5.220   1.889
  380    HD2  LYS  44          1HD       LYS  44  15.654   5.357   3.106
  381    HD3  LYS  44          2HD       LYS  44  16.498   4.567   1.753
  382    HE2  LYS  44          1HE       LYS  44  15.895   6.438   0.280
  383    HE3  LYS  44          2HE       LYS  44  15.046   7.228   1.628
  384    HZ1  LYS  44          1HZ       LYS  44  17.256   8.118   1.324
  385    HZ2  LYS  44          2HZ       LYS  44  17.147   7.363   2.786
  386    HZ3  LYS  44          3HZ       LYS  44  17.933   6.629   1.535
  387    H    ASN  45           H        ASN  45  14.138   0.467   0.809
  388    HA   ASN  45           HA       ASN  45  12.486  -1.462   2.012
  389    HB2  ASN  45          1HB       ASN  45  15.074  -1.978   0.373
  390    HB3  ASN  45          2HB       ASN  45  13.873  -2.989   1.215
  391   HD21  ASN  45          1HD2      ASN  45  13.153  -2.283  -2.485
  392   HD22  ASN  45          2HD2      ASN  45  14.658  -2.561  -1.671
  393    H    SER  46           H        SER  46  13.040  -2.944   3.745
  394    HA   SER  46           HA       SER  46  15.409  -2.127   5.234
  395    HB2  SER  46          1HB       SER  46  14.268  -2.945   7.222
  396    HB3  SER  46          2HB       SER  46  13.231  -1.787   6.358
  397    HG   SER  46           HG       SER  46  12.094  -3.555   5.505
  398    H    LEU  47           H        LEU  47  16.029  -4.192   6.819
  399    HA   LEU  47           HA       LEU  47  16.976  -6.102   4.916
  400    HB2  LEU  47          1HB       LEU  47  17.095  -5.810   7.852
  401    HB3  LEU  47          2HB       LEU  47  18.049  -7.093   7.072
  402    HG   LEU  47           HG       LEU  47  18.390  -4.092   6.696
  403   HD11  LEU  47          1HD1      LEU  47  20.613  -4.479   7.792
  404   HD12  LEU  47          2HD1      LEU  47  19.273  -4.944   8.866
  405   HD13  LEU  47          3HD1      LEU  47  20.195  -6.195   7.999
  406   HD21  LEU  47          1HD2      LEU  47  20.353  -4.684   5.318
  407   HD22  LEU  47          2HD2      LEU  47  19.924  -6.405   5.476
  408   HD23  LEU  47          3HD2      LEU  47  18.826  -5.286   4.631
  409    H    LEU  48           H        LEU  48  14.260  -5.805   7.113
  410    HA   LEU  48           HA       LEU  48  13.957  -8.703   7.238
  411    HB2  LEU  48          1HB       LEU  48  12.618  -6.395   8.504
  412    HB3  LEU  48          2HB       LEU  48  12.113  -8.046   8.933
  413    HG   LEU  48           HG       LEU  48  14.822  -6.765   9.465
  414   HD11  LEU  48          1HD1      LEU  48  14.183  -7.073  11.872
  415   HD12  LEU  48          2HD1      LEU  48  13.016  -6.035  11.019
  416   HD13  LEU  48          3HD1      LEU  48  12.615  -7.737  11.353
  417   HD21  LEU  48          1HD2      LEU  48  15.388  -8.871  10.628
  418   HD22  LEU  48          2HD2      LEU  48  13.843  -9.567  10.080
  419   HD23  LEU  48          3HD2      LEU  48  15.084  -9.107   8.891
  420    H    VAL  49           H        VAL  49  12.205  -5.695   6.253
  421    HA   VAL  49           HA       VAL  49  10.427  -7.433   4.687
  422    HB   VAL  49           HB       VAL  49   8.638  -5.704   5.100
  423   HG11  VAL  49          1HG1      VAL  49   8.127  -6.405   7.417
  424   HG12  VAL  49          2HG1      VAL  49   8.709  -7.777   6.445
  425   HG13  VAL  49          3HG1      VAL  49   9.798  -6.985   7.609
  426   HG21  VAL  49          1HG2      VAL  49   8.912  -4.116   6.936
  427   HG22  VAL  49          2HG2      VAL  49  10.612  -4.614   7.112
  428   HG23  VAL  49          3HG2      VAL  49  10.066  -3.817   5.616
  429    H    LYS  50           H        LYS  50   9.781  -6.618   2.632
  430    HA   LYS  50           HA       LYS  50  11.474  -4.402   1.726
  431    HB2  LYS  50          1HB       LYS  50  11.836  -6.530   0.590
  432    HB3  LYS  50          2HB       LYS  50  10.095  -6.660   0.241
  433    HG2  LYS  50          1HG       LYS  50  10.249  -4.639  -1.182
  434    HG3  LYS  50          2HG       LYS  50  11.999  -4.566  -0.864
  435    HD2  LYS  50          1HD       LYS  50  12.299  -6.764  -1.904
  436    HD3  LYS  50          2HD       LYS  50  10.546  -6.883  -2.185
  437    HE2  LYS  50          1HE       LYS  50  10.655  -4.867  -3.611
  438    HE3  LYS  50          2HE       LYS  50  12.415  -4.803  -3.362
  439    HZ1  LYS  50          1HZ       LYS  50  11.848  -5.873  -5.436
  440    HZ2  LYS  50          2HZ       LYS  50  12.578  -6.953  -4.423
  441    HZ3  LYS  50          3HZ       LYS  50  10.945  -7.011  -4.653
  442    H    TYR  51           H        TYR  51  10.560  -2.689   0.501
  443    HA   TYR  51           HA       TYR  51   7.634  -2.527   0.791
  444    HB2  TYR  51          1HB       TYR  51   9.756  -0.383   0.934
  445    HB3  TYR  51          2HB       TYR  51   8.001  -0.084   0.911
  446    HD1  TYR  51          1HD       TYR  51  10.842  -1.239   2.927
  447    HD2  TYR  51          2HD       TYR  51   6.616  -0.677   2.853
  448    HE1  TYR  51          1HE       TYR  51  10.771  -1.509   5.388
  449    HE2  TYR  51          2HE       TYR  51   6.526  -0.945   5.308
  450    HH   TYR  51           HH       TYR  51   9.465  -1.550   7.247
  451    H    VAL  52           H        VAL  52   6.491  -2.359  -1.077
  452    HA   VAL  52           HA       VAL  52   7.868  -1.080  -3.335
  453    HB   VAL  52           HB       VAL  52   5.811  -3.338  -3.442
  454   HG11  VAL  52          1HG1      VAL  52   6.241  -3.290  -5.877
  455   HG12  VAL  52          2HG1      VAL  52   5.594  -1.733  -5.311
  456   HG13  VAL  52          3HG1      VAL  52   7.332  -1.902  -5.657
  457   HG21  VAL  52          1HG2      VAL  52   7.619  -4.687  -4.381
  458   HG22  VAL  52          2HG2      VAL  52   8.758  -3.348  -4.108
  459   HG23  VAL  52          3HG2      VAL  52   7.977  -4.150  -2.724
  460    H    CYS  53           H        CYS  53   6.838   0.683  -4.169
  461    HA   CYS  53           HA       CYS  53   4.079   1.085  -3.263
  462    HB2  CYS  53          1HB       CYS  53   6.065   3.256  -3.897
  463    HB3  CYS  53          2HB       CYS  53   4.457   3.438  -3.169
  464    HG   CYS  53           HG       CYS  53   6.308   4.000  -1.384
  465    H    CYS  54           H        CYS  54   2.743   2.389  -4.862
  466    HA   CYS  54           HA       CYS  54   3.887   2.788  -7.454
  467    HB2  CYS  54          1HB       CYS  54   1.950   1.521  -8.539
  468    HB3  CYS  54          2HB       CYS  54   3.359   0.606  -7.978
  469    HG   CYS  54           HG       CYS  54   1.173  -0.812  -7.602
  470    H    ASN  55           H        ASN  55   2.267   4.092  -8.835
  471    HA   ASN  55           HA       ASN  55   1.260   5.882  -6.782
  472    HB2  ASN  55          1HB       ASN  55   2.074   7.783  -8.260
  473    HB3  ASN  55          2HB       ASN  55   3.110   6.385  -7.878
  474   HD21  ASN  55          1HD2      ASN  55   3.425   7.403 -11.468
  475   HD22  ASN  55          2HD2      ASN  55   3.506   8.264  -9.967
  476    H    THR  56           H        THR  56  -0.349   3.703  -8.044
  477    HA   THR  56           HA       THR  56  -2.478   5.455  -9.038
  478    HB   THR  56           HB       THR  56  -3.190   3.624 -10.589
  479    HG1  THR  56          1HG       THR  56  -1.632   1.943 -10.992
  480   HG21  THR  56          1HG2      THR  56  -1.434   3.944 -12.296
  481   HG22  THR  56          2HG2      THR  56  -1.804   5.473 -11.463
  482   HG23  THR  56          3HG2      THR  56  -0.331   4.565 -11.045
  483    H    ASP  57           H        ASP  57  -4.645   4.069  -9.043
  484    HA   ASP  57           HA       ASP  57  -4.930   3.635  -6.274
  485    HB2  ASP  57          1HB       ASP  57  -6.932   3.538  -8.594
  486    HB3  ASP  57          2HB       ASP  57  -7.223   3.099  -6.892
  487    HD2  ASP  57           HD       ASP  57  -7.200   6.869  -7.846
  488    H    ARG  58           H        ARG  58  -5.181   1.623  -5.185
  489    HA   ARG  58           HA       ARG  58  -5.215  -0.516  -4.847
  490    HB2  ARG  58          1HB       ARG  58  -6.972  -0.458  -7.341
  491    HB3  ARG  58          2HB       ARG  58  -6.845  -1.864  -6.269
  492    HG2  ARG  58          1HG       ARG  58  -7.865  -0.711  -4.463
  493    HG3  ARG  58          2HG       ARG  58  -7.598   0.881  -5.198
  494    HD2  ARG  58          1HD       ARG  58  -9.370  -1.229  -6.483
  495    HD3  ARG  58          2HD       ARG  58 -10.005  -0.081  -5.293
  496    HE   ARG  58           HE       ARG  58  -8.657   1.496  -7.158
  497   HH11  ARG  58          1HH1      ARG  58 -11.098   1.799  -9.620
  498   HH12  ARG  58          2HH1      ARG  58  -9.632   2.469  -8.938
  499   HH21  ARG  58          1HH2      ARG  58 -12.052  -0.103  -8.690
  500   HH22  ARG  58          2HH2      ARG  58 -11.303  -0.854  -7.321
  501    H    CYS  59           H        CYS  59  -2.955   0.432  -6.422
  502    HA   CYS  59           HA       CYS  59  -2.637  -1.407  -8.606
  503    HB2  CYS  59          1HB       CYS  59  -0.508   0.027  -8.787
  504    HB3  CYS  59          2HB       CYS  59  -1.908   1.080  -8.468
  505    HG   CYS  59           HG       CYS  59   0.181   1.990  -7.264
  506    H    ASN  60           H        ASN  60  -1.856  -1.088  -5.182
  507    HA   ASN  60           HA       ASN  60   0.220  -3.056  -5.327
  508    HB2  ASN  60          1HB       ASN  60   0.282  -2.771  -2.840
  509    HB3  ASN  60          2HB       ASN  60   0.397  -1.216  -3.677
  510   HD21  ASN  60          1HD2      ASN  60  -0.256  -0.823  -1.276
  511   HD22  ASN  60          2HD2      ASN  60  -1.948  -0.583  -0.989
  Start of MODEL   12
    1    H1   MET   0          1H        MET   0  -9.588  10.127   0.780
    2    H2   MET   0          2H        MET   0 -10.523  10.823  -0.164
    3    H    MET   0           H        MET   0 -10.336   9.316  -0.264
    4    H3   MET   0          3H        MET   0 -10.349   9.335  -0.241
    5    HA   MET   0           HA       MET   0  -8.929  11.239  -1.703
    6    HB2  MET   0          1HB       MET   0  -7.166   9.576   0.114
    7    HB3  MET   0          2HB       MET   0  -6.600  10.687  -1.157
    8    HG2  MET   0          1HG       MET   0  -8.213  11.527   1.270
    9    HG3  MET   0          2HG       MET   0  -6.438  11.604   1.172
   10    HE1  MET   0          1HE       MET   0  -5.768  14.359  -1.453
   11    HE2  MET   0          2HE       MET   0  -5.094  13.358  -0.143
   12    HE3  MET   0          3HE       MET   0  -5.703  12.589  -1.629
   13    H    LEU   1           H        LEU   1  -6.550   9.278  -2.161
   14    HA   LEU   1           HA       LEU   1  -7.829   7.709  -4.148
   15    HB2  LEU   1          1HB       LEU   1  -5.164   7.700  -2.874
   16    HB3  LEU   1          2HB       LEU   1  -5.440   6.703  -4.322
   17    HG   LEU   1           HG       LEU   1  -5.597   9.739  -4.174
   18   HD11  LEU   1          1HD1      LEU   1  -3.561   9.663  -5.638
   19   HD12  LEU   1          2HD1      LEU   1  -3.262   8.871  -4.073
   20   HD13  LEU   1          3HD1      LEU   1  -3.566   7.887  -5.525
   21   HD21  LEU   1          1HD2      LEU   1  -5.850   9.635  -6.628
   22   HD22  LEU   1          2HD2      LEU   1  -5.904   7.859  -6.530
   23   HD23  LEU   1          3HD2      LEU   1  -7.184   8.831  -5.766
   24    H    LYS   2           H        LYS   2  -6.826   5.192  -4.108
   25    HA   LYS   2           HA       LYS   2  -7.812   4.105  -1.573
   26    HB2  LYS   2          1HB       LYS   2  -8.608   3.228  -4.364
   27    HB3  LYS   2          2HB       LYS   2  -9.104   2.452  -2.841
   28    HG2  LYS   2          1HG       LYS   2 -10.349   4.456  -2.198
   29    HG3  LYS   2          2HG       LYS   2  -9.811   5.286  -3.678
   30    HD2  LYS   2          1HD       LYS   2 -10.961   3.566  -5.038
   31    HD3  LYS   2          2HD       LYS   2 -11.536   2.789  -3.543
   32    HE2  LYS   2          1HE       LYS   2 -12.751   4.827  -2.935
   33    HE3  LYS   2          2HE       LYS   2 -12.154   5.633  -4.403
   34    HZ1  LYS   2          1HZ       LYS   2 -14.382   4.790  -4.696
   35    HZ2  LYS   2          2HZ       LYS   2 -13.342   4.001  -5.705
   36    HZ3  LYS   2          3HZ       LYS   2 -13.897   3.254  -4.343
   37    H    CYS   3           H        CYS   3  -6.685   2.336  -0.831
   38    HA   CYS   3           HA       CYS   3  -4.828   1.132  -2.750
   39    HB2  CYS   3          1HB       CYS   3  -4.344   1.658   0.184
   40    HB3  CYS   3          2HB       CYS   3  -3.271   0.738  -0.876
   41    HG   CYS   3           HG       CYS   3  -2.202   3.086  -0.353
   42    H    ASN   4           H        ASN   4  -4.347  -1.207  -2.205
   43    HA   ASN   4           HA       ASN   4  -6.813  -2.444  -1.525
   44    HB2  ASN   4          1HB       ASN   4  -4.203  -3.854  -2.446
   45    HB3  ASN   4          2HB       ASN   4  -5.829  -4.373  -1.937
   46   HD21  ASN   4          1HD2      ASN   4  -5.280  -3.674  -5.710
   47   HD22  ASN   4          2HD2      ASN   4  -4.137  -4.242  -4.538
   48    H    LYS   5           H        LYS   5  -6.909  -4.263   0.133
   49    HA   LYS   5           HA       LYS   5  -4.861  -4.077   2.199
   50    HB2  LYS   5          1HB       LYS   5  -7.835  -3.632   2.576
   51    HB3  LYS   5          2HB       LYS   5  -6.708  -3.986   3.907
   52    HG2  LYS   5          1HG       LYS   5  -6.531  -1.579   2.062
   53    HG3  LYS   5          2HG       LYS   5  -7.247  -1.562   3.691
   54    HD2  LYS   5          1HD       LYS   5  -4.366  -2.198   2.971
   55    HD3  LYS   5          2HD       LYS   5  -4.959  -0.733   3.789
   56    HE2  LYS   5          1HE       LYS   5  -5.905  -2.349   5.563
   57    HE3  LYS   5          2HE       LYS   5  -4.837  -3.566   4.828
   58    HZ1  LYS   5          1HZ       LYS   5  -3.783  -2.459   6.680
   59    HZ2  LYS   5          2HZ       LYS   5  -2.978  -2.113   5.280
   60    HZ3  LYS   5          3HZ       LYS   5  -3.969  -0.985   5.963
   61    H    LEU   6           H        LEU   6  -8.183  -5.476   2.247
   62    HA   LEU   6           HA       LEU   6  -6.969  -8.053   2.781
   63    HB2  LEU   6          1HB       LEU   6  -8.671  -7.268   4.133
   64    HB3  LEU   6          2HB       LEU   6  -9.874  -7.036   2.843
   65    HG   LEU   6           HG       LEU   6  -9.700  -9.542   2.415
   66   HD11  LEU   6          1HD1      LEU   6  -8.883 -10.918   4.347
   67   HD12  LEU   6          2HD1      LEU   6  -7.578  -9.917   3.668
   68   HD13  LEU   6          3HD1      LEU   6  -8.384  -9.426   5.179
   69   HD21  LEU   6          1HD2      LEU   6 -11.243 -10.113   4.258
   70   HD22  LEU   6          2HD2      LEU   6 -10.790  -8.601   5.082
   71   HD23  LEU   6          3HD2      LEU   6 -11.620  -8.542   3.509
   72    H    VAL   7           H        VAL   7  -6.914  -9.765   1.377
   73    HA   VAL   7           HA       VAL   7  -7.377  -9.302  -1.349
   74    HB   VAL   7           HB       VAL   7  -7.045 -11.772  -1.572
   75   HG11  VAL   7          1HG1      VAL   7  -4.770 -11.861  -0.607
   76   HG12  VAL   7          2HG1      VAL   7  -5.077 -10.287  -1.378
   77   HG13  VAL   7          3HG1      VAL   7  -5.139 -10.437   0.396
   78   HG21  VAL   7          1HG2      VAL   7  -6.622 -13.134   0.412
   79   HG22  VAL   7          2HG2      VAL   7  -7.057 -11.756   1.449
   80   HG23  VAL   7          3HG2      VAL   7  -8.279 -12.490   0.384
   81    HA   PRO   8           HA       PRO   8  -7.738 -10.622  -2.855
   82    HB2  PRO   8          1HB       PRO   8  -8.999 -10.687  -5.238
   83    HB3  PRO   8          2HB       PRO   8  -8.979 -12.141  -4.230
   84    HG2  PRO   8          1HG       PRO   8 -11.149 -10.044  -4.514
   85    HG3  PRO   8          2HG       PRO   8 -11.304 -11.803  -4.437
   86    HD2  PRO   8          1HD       PRO   8 -11.692 -10.142  -2.234
   87    HD3  PRO   8          2HD       PRO   8 -11.198 -11.834  -2.089
   88    H    ILE   9           H        ILE   9 -10.434  -8.395  -3.080
   89    HA   ILE   9           HA       ILE   9  -8.609  -6.565  -4.479
   90    HB   ILE   9           HB       ILE   9 -11.646  -6.846  -4.717
   91   HG12  ILE   9          1HG1      ILE   9 -10.518  -8.655  -5.786
   92   HG13  ILE   9          2HG1      ILE   9 -11.229  -7.550  -6.985
   93   HG21  ILE   9          1HG2      ILE   9 -11.435  -5.157  -6.509
   94   HG22  ILE   9          2HG2      ILE   9 -10.884  -4.506  -4.948
   95   HG23  ILE   9          3HG2      ILE   9  -9.694  -5.013  -6.170
   96   HD11  ILE   9          1HD1      ILE   9  -8.999  -8.319  -7.696
   97   HD12  ILE   9          2HD1      ILE   9  -9.007  -6.566  -7.395
   98   HD13  ILE   9          3HD1      ILE   9  -8.297  -7.672  -6.196
   99    H    ALA  10           H        ALA  10 -10.595  -7.183  -1.696
  100    HA   ALA  10           HA       ALA  10 -11.865  -4.874  -1.176
  101    HB1  ALA  10          1HB       ALA  10 -10.506  -5.857   1.217
  102    HB2  ALA  10          2HB       ALA  10 -12.233  -5.911   0.788
  103    HB3  ALA  10          3HB       ALA  10 -11.135  -7.192   0.221
  104    H    TYR  11           H        TYR  11 -11.395  -2.792  -0.469
  105    HA   TYR  11           HA       TYR  11  -8.560  -2.161  -0.108
  106    HB2  TYR  11          1HB       TYR  11  -8.980  -0.278  -1.781
  107    HB3  TYR  11          2HB       TYR  11  -9.120  -1.876  -2.522
  108    HD1  TYR  11          1HD       TYR  11 -10.916   1.126  -1.447
  109    HD2  TYR  11          2HD       TYR  11 -11.278  -2.721  -3.233
  110    HE1  TYR  11          1HE       TYR  11 -13.259   1.732  -2.262
  111    HE2  TYR  11          2HE       TYR  11 -13.619  -2.131  -4.054
  112    HH   TYR  11           HH       TYR  11 -14.726   0.566  -4.534
  113    H    LYS  12           H        LYS  12  -8.245   0.119   0.693
  114    HA   LYS  12           HA       LYS  12 -10.633   1.043   2.131
  115    HB2  LYS  12          1HB       LYS  12  -7.783   0.673   3.067
  116    HB3  LYS  12          2HB       LYS  12  -8.891   1.813   3.868
  117    HG2  LYS  12          1HG       LYS  12 -10.460  -0.093   4.280
  118    HG3  LYS  12          2HG       LYS  12  -9.227  -1.194   3.618
  119    HD2  LYS  12          1HD       LYS  12  -7.651  -0.511   5.364
  120    HD3  LYS  12          2HD       LYS  12  -8.846   0.640   6.010
  121    HE2  LYS  12          1HE       LYS  12 -10.387  -1.254   6.449
  122    HE3  LYS  12          2HE       LYS  12  -9.131  -2.378   5.882
  123    HZ1  LYS  12          1HZ       LYS  12  -9.142  -2.190   8.276
  124    HZ2  LYS  12          2HZ       LYS  12  -7.724  -1.604   7.669
  125    HZ3  LYS  12          3HZ       LYS  12  -8.889  -0.561   8.194
  126    H    THR  13           H        THR  13 -10.573   3.385   2.674
  127    HA   THR  13           HA       THR  13  -9.485   4.843   0.431
  128    HB   THR  13           HB       THR  13 -11.090   5.743   2.875
  129    HG1  THR  13          1HG       THR  13 -12.813   5.783   1.312
  130   HG21  THR  13          1HG2      THR  13 -11.522   7.787   1.556
  131   HG22  THR  13          2HG2      THR  13  -9.780   7.576   1.858
  132   HG23  THR  13          3HG2      THR  13 -10.461   7.177   0.265
  133    H    CYS  14           H        CYS  14  -7.705   6.092   0.366
  134    HA   CYS  14           HA       CYS  14  -5.860   5.769   2.465
  135    HB2  CYS  14          1HB       CYS  14  -5.844   7.480  -0.017
  136    HB3  CYS  14          2HB       CYS  14  -4.484   7.392   1.109
  137    HG   CYS  14           HG       CYS  14  -3.934   5.999  -1.056
  138    HA   PRO  15           HA       PRO  15  -6.850   9.396   4.730
  139    HB2  PRO  15          1HB       PRO  15  -4.659   9.779   6.258
  140    HB3  PRO  15          2HB       PRO  15  -5.686   8.369   6.551
  141    HG2  PRO  15          1HG       PRO  15  -3.125   8.561   4.932
  142    HG3  PRO  15          2HG       PRO  15  -3.610   7.326   6.103
  143    HD2  PRO  15          1HD       PRO  15  -3.897   6.984   3.368
  144    HD3  PRO  15          2HD       PRO  15  -4.956   6.189   4.539
  145    H    GLU  16           H        GLU  16  -6.502  11.684   4.980
  146    HA   GLU  16           HA       GLU  16  -5.820  12.756   2.553
  147    HB2  GLU  16          1HB       GLU  16  -7.246  13.838   4.218
  148    HB3  GLU  16          2HB       GLU  16  -5.853  14.027   5.309
  149    HG2  GLU  16          1HG       GLU  16  -4.805  15.623   3.631
  150    HG3  GLU  16          2HG       GLU  16  -6.229  15.280   2.621
  151    HE2  GLU  16           HE       GLU  16  -6.873  18.277   4.531
  152    H    GLY  17           H        GLY  17  -3.934  13.575   1.636
  153    HA2  GLY  17          1HA       GLY  17  -1.852  14.620   1.767
  154    HA3  GLY  17          2HA       GLY  17  -1.616  13.989   3.384
  155    H    LYS  18           H        LYS  18  -2.808  11.290   2.175
  156    HA   LYS  18           HA       LYS  18  -0.207  10.374   1.204
  157    HB2  LYS  18          1HB       LYS  18  -2.639   8.794   2.080
  158    HB3  LYS  18          2HB       LYS  18  -1.015   8.154   1.738
  159    HG2  LYS  18          1HG       LYS  18  -1.828   9.958   4.042
  160    HG3  LYS  18          2HG       LYS  18  -1.353   8.245   4.139
  161    HD2  LYS  18          1HD       LYS  18   0.889   8.871   3.228
  162    HD3  LYS  18          2HD       LYS  18   0.399  10.579   3.300
  163    HE2  LYS  18          1HE       LYS  18  -0.055  10.236   5.763
  164    HE3  LYS  18          2HE       LYS  18   0.715   8.640   5.606
  165    HZ1  LYS  18          1HZ       LYS  18   2.269  10.306   6.367
  166    HZ2  LYS  18          2HZ       LYS  18   2.718   9.749   4.880
  167    HZ3  LYS  18          3HZ       LYS  18   2.004  11.229   5.025
  168    H    ASN  19           H        ASN  19  -0.115   8.949  -0.693
  169    HA   ASN  19           HA       ASN  19  -2.286   9.588  -2.516
  170    HB2  ASN  19          1HB       ASN  19  -0.369  11.388  -2.823
  171    HB3  ASN  19          2HB       ASN  19   0.514   9.851  -3.001
  172   HD21  ASN  19          1HD2      ASN  19  -1.485  11.525  -6.096
  173   HD22  ASN  19          2HD2      ASN  19  -1.484  12.208  -4.504
  174    H    LEU  20           H        LEU  20   0.857   7.858  -1.903
  175    HA   LEU  20           HA       LEU  20   0.427   6.232  -4.251
  176    HB2  LEU  20          1HB       LEU  20   2.512   6.194  -2.159
  177    HB3  LEU  20          2HB       LEU  20   2.754   5.419  -3.743
  178    HG   LEU  20           HG       LEU  20   2.527   8.404  -3.190
  179   HD11  LEU  20          1HD1      LEU  20   4.906   8.455  -3.987
  180   HD12  LEU  20          2HD1      LEU  20   4.727   7.417  -2.553
  181   HD13  LEU  20          3HD1      LEU  20   4.866   6.686  -4.170
  182   HD21  LEU  20          1HD2      LEU  20   3.013   8.693  -5.595
  183   HD22  LEU  20          2HD2      LEU  20   2.931   6.927  -5.807
  184   HD23  LEU  20          3HD2      LEU  20   1.483   7.832  -5.302
  185    H    CYS  21           H        CYS  21   0.475   3.871  -4.205
  186    HA   CYS  21           HA       CYS  21  -0.543   2.858  -1.652
  187    HB2  CYS  21          1HB       CYS  21  -1.095   1.975  -4.481
  188    HB3  CYS  21          2HB       CYS  21  -1.553   1.032  -3.061
  189    HG   CYS  21           HG       CYS  21  -3.684   2.196  -4.077
  190    H    TYR  22           H        TYR  22   0.733   1.332  -0.628
  191    HA   TYR  22           HA       TYR  22   2.957   0.234  -2.215
  192    HB2  TYR  22          1HB       TYR  22   4.391   0.495  -0.380
  193    HB3  TYR  22          2HB       TYR  22   3.551   2.049  -0.602
  194    HD1  TYR  22          1HD       TYR  22   3.912  -0.906   1.573
  195    HD2  TYR  22          2HD       TYR  22   1.970   2.855   1.061
  196    HE1  TYR  22          1HE       TYR  22   3.183  -0.969   3.941
  197    HE2  TYR  22          2HE       TYR  22   1.233   2.808   3.419
  198    HH   TYR  22           HH       TYR  22   1.245   1.656   5.384
  199    H    LYS  23           H        LYS  23   3.814  -1.858  -1.434
  200    HA   LYS  23           HA       LYS  23   1.986  -3.258   0.372
  201    HB2  LYS  23          1HB       LYS  23   2.252  -5.280  -1.000
  202    HB3  LYS  23          2HB       LYS  23   1.418  -3.972  -1.872
  203    HG2  LYS  23          1HG       LYS  23   3.485  -3.446  -3.085
  204    HG3  LYS  23          2HG       LYS  23   4.342  -4.727  -2.197
  205    HD2  LYS  23          1HD       LYS  23   3.559  -5.339  -4.533
  206    HD3  LYS  23          2HD       LYS  23   3.060  -6.441  -3.229
  207    HE2  LYS  23          1HE       LYS  23   0.862  -5.396  -3.142
  208    HE3  LYS  23          2HE       LYS  23   1.352  -4.212  -4.375
  209    HZ1  LYS  23          1HZ       LYS  23   0.072  -6.008  -5.325
  210    HZ2  LYS  23          2HZ       LYS  23   1.609  -6.030  -5.925
  211    HZ3  LYS  23          3HZ       LYS  23   1.154  -7.127  -4.781
  212    H    MET  24           H        MET  24   3.003  -4.964   1.617
  213    HA   MET  24           HA       MET  24   5.889  -4.527   1.733
  214    HB2  MET  24          1HB       MET  24   3.862  -5.100   3.903
  215    HB3  MET  24          2HB       MET  24   5.623  -5.139   4.160
  216    HG2  MET  24          1HG       MET  24   5.736  -2.756   3.470
  217    HG3  MET  24          2HG       MET  24   3.963  -2.739   3.330
  218    HE1  MET  24          1HE       MET  24   2.708  -2.946   6.958
  219    HE2  MET  24          2HE       MET  24   2.328  -2.508   5.274
  220    HE3  MET  24          3HE       MET  24   2.750  -4.189   5.685
  221    H    PHE  25           H        PHE  25   7.248  -6.322   1.744
  222    HA   PHE  25           HA       PHE  25   5.893  -8.925   1.796
  223    HB2  PHE  25          1HB       PHE  25   8.570  -7.974   0.624
  224    HB3  PHE  25          2HB       PHE  25   7.961  -9.627   0.488
  225    HD1  PHE  25          1HD       PHE  25   6.361 -10.194  -1.161
  226    HD2  PHE  25          2HD       PHE  25   7.426  -6.133  -0.574
  227    HE1  PHE  25          1HE       PHE  25   5.179  -9.573  -3.301
  228    HE2  PHE  25          2HE       PHE  25   6.255  -5.512  -2.704
  229    HZ   PHE  25           HZ       PHE  25   5.144  -7.238  -4.044
  230    H    MET  26           H        MET  26   7.396 -10.759   2.622
  231    HA   MET  26           HA       MET  26   9.174  -9.688   4.675
  232    HB2  MET  26          1HB       MET  26   7.573 -12.252   4.582
  233    HB3  MET  26          2HB       MET  26   8.808 -11.895   5.814
  234    HG2  MET  26          1HG       MET  26   7.502  -9.942   6.548
  235    HG3  MET  26          2HG       MET  26   6.264 -10.316   5.326
  236    HE1  MET  26          1HE       MET  26   4.543 -11.210   8.788
  237    HE2  MET  26          2HE       MET  26   5.730  -9.914   8.507
  238    HE3  MET  26          3HE       MET  26   4.440 -10.214   7.317
  239    H    MET  27           H        MET  27  11.268 -10.644   4.905
  240    HA   MET  27           HA       MET  27  12.495 -11.570   2.664
  241    HB2  MET  27          1HB       MET  27  13.064 -11.899   5.602
  242    HB3  MET  27          2HB       MET  27  14.173 -12.534   4.362
  243    HG2  MET  27          1HG       MET  27  13.346  -9.635   4.709
  244    HG3  MET  27          2HG       MET  27  14.903 -10.340   5.202
  245    HE1  MET  27          1HE       MET  27  16.611 -11.188   1.810
  246    HE2  MET  27          2HE       MET  27  16.806 -11.050   3.575
  247    HE3  MET  27          3HE       MET  27  15.700 -12.268   2.893
  248    H    SER  28           H        SER  28  10.496 -13.336   4.992
  249    HA   SER  28           HA       SER  28  11.135 -15.895   4.112
  250    HB2  SER  28          1HB       SER  28   9.804 -15.464   6.097
  251    HB3  SER  28          2HB       SER  28   8.529 -14.707   5.116
  252    HG   SER  28           HG       SER  28   8.055 -16.880   5.664
  253    H    ASP  29           H        ASP  29   8.076 -14.098   3.309
  254    HA   ASP  29           HA       ASP  29   8.085 -15.570   0.814
  255    HB2  ASP  29          1HB       ASP  29   6.056 -15.765   2.347
  256    HB3  ASP  29          2HB       ASP  29   5.981 -13.997   2.153
  257    HD2  ASP  29           HD       ASP  29   3.733 -15.636  -0.234
  258    H    LEU  30           H        LEU  30   9.422 -14.232  -0.539
  259    HA   LEU  30           HA       LEU  30   8.923 -11.408  -0.679
  260    HB2  LEU  30          1HB       LEU  30  10.742 -13.349  -2.046
  261    HB3  LEU  30          2HB       LEU  30  10.532 -11.711  -2.690
  262    HG   LEU  30           HG       LEU  30  12.446 -11.556  -1.386
  263   HD11  LEU  30          1HD1      LEU  30  10.167 -10.185  -0.565
  264   HD12  LEU  30          2HD1      LEU  30  10.911 -10.754   0.949
  265   HD13  LEU  30          3HD1      LEU  30  11.858  -9.772  -0.195
  266   HD21  LEU  30          1HD2      LEU  30  11.430 -12.752   1.122
  267   HD22  LEU  30          2HD2      LEU  30  11.693 -13.883  -0.229
  268   HD23  LEU  30          3HD2      LEU  30  13.032 -12.863   0.352
  269    H    THR  31           H        THR  31   7.700 -14.353  -2.153
  270    HA   THR  31           HA       THR  31   7.179 -13.260  -4.713
  271    HB   THR  31           HB       THR  31   5.958 -15.660  -3.264
  272    HG1  THR  31          1HG       THR  31   7.521 -16.802  -4.556
  273   HG21  THR  31          1HG2      THR  31   5.358 -16.444  -5.529
  274   HG22  THR  31          2HG2      THR  31   4.571 -14.891  -5.159
  275   HG23  THR  31          3HG2      THR  31   5.998 -14.934  -6.221
  276    H    ILE  32           H        ILE  32   5.253 -13.563  -1.698
  277    HA   ILE  32           HA       ILE  32   3.159 -12.025  -3.067
  278    HB   ILE  32           HB       ILE  32   2.866 -14.352  -1.109
  279   HG12  ILE  32          1HG1      ILE  32   3.240 -14.982  -3.409
  280   HG13  ILE  32          2HG1      ILE  32   1.614 -15.417  -2.833
  281   HG21  ILE  32          1HG2      ILE  32   0.434 -13.923  -1.228
  282   HG22  ILE  32          2HG2      ILE  32   1.296 -12.532  -0.530
  283   HG23  ILE  32          3HG2      ILE  32   0.737 -12.477  -2.218
  284   HD11  ILE  32          1HD1      ILE  32   1.539 -14.556  -5.140
  285   HD12  ILE  32          2HD1      ILE  32   0.672 -13.476  -4.022
  286   HD13  ILE  32          3HD1      ILE  32   2.298 -13.042  -4.599
  287    HA   PRO  33           HA       PRO  33   3.903  -9.344   0.273
  288    HB2  PRO  33          1HB       PRO  33   2.012  -7.451  -0.233
  289    HB3  PRO  33          2HB       PRO  33   3.478  -7.540  -1.216
  290    HG2  PRO  33          1HG       PRO  33   0.736  -8.722  -1.768
  291    HG3  PRO  33          2HG       PRO  33   1.807  -7.842  -2.865
  292    HD2  PRO  33          1HD       PRO  33   1.682 -10.579  -2.894
  293    HD3  PRO  33          2HD       PRO  33   3.193  -9.730  -3.246
  294    H    VAL  34           H        VAL  34   2.852  -8.404   2.238
  295    HA   VAL  34           HA       VAL  34   1.020 -10.546   3.067
  296    HB   VAL  34           HB       VAL  34   2.056 -10.344   5.309
  297   HG11  VAL  34          1HG1      VAL  34   4.282 -11.273   4.762
  298   HG12  VAL  34          2HG1      VAL  34   3.025 -11.955   3.704
  299   HG13  VAL  34          3HG1      VAL  34   4.115 -10.689   3.089
  300   HG21  VAL  34          1HG2      VAL  34   4.056  -8.982   5.650
  301   HG22  VAL  34          2HG2      VAL  34   3.882  -8.316   4.009
  302   HG23  VAL  34          3HG2      VAL  34   2.637  -7.992   5.240
  303    H    LYS  35           H        LYS  35   1.841  -7.077   3.119
  304    HA   LYS  35           HA       LYS  35  -0.882  -6.525   3.906
  305    HB2  LYS  35          1HB       LYS  35   1.553  -5.787   5.525
  306    HB3  LYS  35          2HB       LYS  35   0.095  -4.768   5.544
  307    HG2  LYS  35          1HG       LYS  35  -1.191  -6.861   6.227
  308    HG3  LYS  35          2HG       LYS  35   0.392  -7.630   6.492
  309    HD2  LYS  35          1HD       LYS  35  -0.110  -6.832   8.616
  310    HD3  LYS  35          2HD       LYS  35   0.886  -5.517   7.946
  311    HE2  LYS  35          1HE       LYS  35  -1.073  -4.222   7.406
  312    HE3  LYS  35          2HE       LYS  35  -2.143  -5.570   7.857
  313    HZ1  LYS  35          1HZ       LYS  35  -2.014  -3.917   9.594
  314    HZ2  LYS  35          2HZ       LYS  35  -1.370  -5.342  10.120
  315    HZ3  LYS  35          3HZ       LYS  35  -0.378  -4.092   9.701
  316    H    ARG  36           H        ARG  36  -1.601  -4.491   3.154
  317    HA   ARG  36           HA       ARG  36   0.461  -2.912   1.852
  318    HB2  ARG  36          1HB       ARG  36  -2.322  -3.506   0.742
  319    HB3  ARG  36          2HB       ARG  36  -1.135  -2.430  -0.014
  320    HG2  ARG  36          1HG       ARG  36  -0.715  -4.380  -1.187
  321    HG3  ARG  36          2HG       ARG  36   0.417  -4.609   0.157
  322    HD2  ARG  36          1HD       ARG  36  -0.755  -6.673  -0.027
  323    HD3  ARG  36          2HD       ARG  36  -1.524  -5.857   1.343
  324    HE   ARG  36           HE       ARG  36  -2.938  -5.104  -0.999
  325   HH11  ARG  36          1HH1      ARG  36  -5.282  -7.677  -1.000
  326   HH12  ARG  36          2HH1      ARG  36  -4.876  -6.082  -1.596
  327   HH21  ARG  36          1HH2      ARG  36  -3.823  -8.801   0.413
  328   HH22  ARG  36          2HH2      ARG  36  -2.330  -8.051   0.874
  329    H    GLY  37           H        GLY  37  -0.578  -0.605   1.258
  330    HA2  GLY  37          1HA       GLY  37  -2.782   0.358   2.697
  331    HA3  GLY  37          2HA       GLY  37  -1.351   0.596   3.676
  332    H    CYS  38           H        CYS  38  -2.040   2.953   3.280
  333    HA   CYS  38           HA       CYS  38  -1.188   3.843   0.630
  334    HB2  CYS  38          1HB       CYS  38  -2.825   5.061   2.976
  335    HB3  CYS  38          2HB       CYS  38  -2.622   5.862   1.400
  336    HG   CYS  38           HG       CYS  38  -5.050   5.045   1.674
  337    H    ILE  39           H        ILE  39   0.404   5.575   0.499
  338    HA   ILE  39           HA       ILE  39   1.126   6.938   2.901
  339    HB   ILE  39           HB       ILE  39   2.598   4.837   2.941
  340   HG12  ILE  39          1HG1      ILE  39   4.231   7.316   2.571
  341   HG13  ILE  39          2HG1      ILE  39   3.086   7.138   3.922
  342   HG21  ILE  39          1HG2      ILE  39   4.488   4.788   1.348
  343   HG22  ILE  39          2HG2      ILE  39   2.931   4.648   0.499
  344   HG23  ILE  39          3HG2      ILE  39   3.808   6.195   0.498
  345   HD11  ILE  39          1HD1      ILE  39   5.371   6.521   4.604
  346   HD12  ILE  39          2HD1      ILE  39   4.279   5.116   4.668
  347   HD13  ILE  39          3HD1      ILE  39   5.424   5.294   3.318
  348    H    ASP  40           H        ASP  40   2.663   8.764   2.401
  349    HA   ASP  40           HA       ASP  40   1.980   9.754  -0.201
  350    HB2  ASP  40          1HB       ASP  40   2.961  11.934   0.707
  351    HB3  ASP  40          2HB       ASP  40   1.628  11.111   1.554
  352    HD2  ASP  40           HD       ASP  40   4.366  12.112   3.853
  353    H    VAL  41           H        VAL  41   4.889   8.997   1.833
  354    HA   VAL  41           HA       VAL  41   6.535   9.231  -0.590
  355    HB   VAL  41           HB       VAL  41   7.318   9.520   2.350
  356   HG11  VAL  41          1HG1      VAL  41   9.538  10.153   1.464
  357   HG12  VAL  41          2HG1      VAL  41   9.108   8.494   0.987
  358   HG13  VAL  41          3HG1      VAL  41   8.973   9.822  -0.190
  359   HG21  VAL  41          1HG2      VAL  41   7.780  11.853   1.791
  360   HG22  VAL  41          2HG2      VAL  41   7.152  11.583   0.147
  361   HG23  VAL  41          3HG2      VAL  41   6.068  11.435   1.551
  362    H    CYS  42           H        CYS  42   7.616   7.431  -1.298
  363    HA   CYS  42           HA       CYS  42   6.658   4.995  -0.251
  364    HB2  CYS  42          1HB       CYS  42   7.082   5.386  -2.631
  365    HB3  CYS  42          2HB       CYS  42   8.815   5.501  -2.311
  366    HG   CYS  42           HG       CYS  42   8.284   3.219  -3.516
  367    HA   PRO  43           HA       PRO  43   9.852   4.614   2.739
  368    HB2  PRO  43          1HB       PRO  43   9.140   2.199   3.812
  369    HB3  PRO  43          2HB       PRO  43   8.264   3.678   4.231
  370    HG2  PRO  43          1HG       PRO  43   7.588   1.589   2.138
  371    HG3  PRO  43          2HG       PRO  43   6.519   2.389   3.296
  372    HD2  PRO  43          1HD       PRO  43   6.653   3.216   0.691
  373    HD3  PRO  43          2HD       PRO  43   6.376   4.373   1.999
  374    H    LYS  44           H        LYS  44  11.935   3.930   2.806
  375    HA   LYS  44           HA       LYS  44  12.756   2.419   0.551
  376    HB2  LYS  44          1HB       LYS  44  14.155   3.264   3.107
  377    HB3  LYS  44          2HB       LYS  44  14.969   2.465   1.740
  378    HG2  LYS  44          1HG       LYS  44  14.395   4.361   0.283
  379    HG3  LYS  44          2HG       LYS  44  13.568   5.160   1.642
  380    HD2  LYS  44          1HD       LYS  44  15.673   5.276   2.884
  381    HD3  LYS  44          2HD       LYS  44  16.513   4.420   1.570
  382    HE2  LYS  44          1HE       LYS  44  15.986   6.259   0.029
  383    HE3  LYS  44          2HE       LYS  44  15.141   7.116   1.338
  384    HZ1  LYS  44          1HZ       LYS  44  17.380   7.932   1.039
  385    HZ2  LYS  44          2HZ       LYS  44  17.229   7.228   2.523
  386    HZ3  LYS  44          3HZ       LYS  44  18.012   6.432   1.308
  387    H    ASN  45           H        ASN  45  14.076   0.371   0.728
  388    HA   ASN  45           HA       ASN  45  12.360  -1.497   1.918
  389    HB2  ASN  45          1HB       ASN  45  15.031  -2.082   0.442
  390    HB3  ASN  45          2HB       ASN  45  13.792  -3.063   1.263
  391   HD21  ASN  45          1HD2      ASN  45  13.260  -2.500  -2.494
  392   HD22  ASN  45          2HD2      ASN  45  14.725  -2.731  -1.597
  393    H    SER  46           H        SER  46  12.766  -2.879   3.756
  394    HA   SER  46           HA       SER  46  15.070  -2.063   5.340
  395    HB2  SER  46          1HB       SER  46  13.819  -2.861   7.277
  396    HB3  SER  46          2HB       SER  46  12.841  -1.702   6.346
  397    HG   SER  46           HG       SER  46  11.767  -3.498   5.423
  398    H    LEU  47           H        LEU  47  15.680  -4.061   6.956
  399    HA   LEU  47           HA       LEU  47  16.650  -6.054   5.161
  400    HB2  LEU  47          1HB       LEU  47  16.665  -5.658   8.089
  401    HB3  LEU  47          2HB       LEU  47  17.625  -6.984   7.392
  402    HG   LEU  47           HG       LEU  47  18.031  -4.006   6.908
  403   HD11  LEU  47          1HD1      LEU  47  20.199  -4.374   8.115
  404   HD12  LEU  47          2HD1      LEU  47  18.808  -4.772   9.150
  405   HD13  LEU  47          3HD1      LEU  47  19.745  -6.074   8.379
  406   HD21  LEU  47          1HD2      LEU  47  20.040  -4.687   5.644
  407   HD22  LEU  47          2HD2      LEU  47  19.577  -6.393   5.859
  408   HD23  LEU  47          3HD2      LEU  47  18.534  -5.298   4.920
  409    H    LEU  48           H        LEU  48  13.864  -5.654   7.254
  410    HA   LEU  48           HA       LEU  48  13.523  -8.535   7.489
  411    HB2  LEU  48          1HB       LEU  48  12.114  -6.153   8.528
  412    HB3  LEU  48          2HB       LEU  48  11.571  -7.774   9.019
  413    HG   LEU  48           HG       LEU  48  14.248  -6.474   9.653
  414   HD11  LEU  48          1HD1      LEU  48  13.446  -6.627  12.026
  415   HD12  LEU  48          2HD1      LEU  48  12.349  -5.637  11.034
  416   HD13  LEU  48          3HD1      LEU  48  11.910  -7.312  11.446
  417   HD21  LEU  48          1HD2      LEU  48  14.714  -8.505  10.981
  418   HD22  LEU  48          2HD2      LEU  48  13.202  -9.226  10.374
  419   HD23  LEU  48          3HD2      LEU  48  14.525  -8.848   9.244
  420    H    VAL  49           H        VAL  49  11.800  -5.589   6.273
  421    HA   VAL  49           HA       VAL  49  10.153  -7.411   4.662
  422    HB   VAL  49           HB       VAL  49   8.291  -5.735   4.946
  423   HG11  VAL  49          1HG1      VAL  49   7.682  -6.409   7.245
  424   HG12  VAL  49          2HG1      VAL  49   8.359  -7.780   6.334
  425   HG13  VAL  49          3HG1      VAL  49   9.358  -6.930   7.537
  426   HG21  VAL  49          1HG2      VAL  49   8.416  -4.105   6.761
  427   HG22  VAL  49          2HG2      VAL  49  10.120  -4.543   7.037
  428   HG23  VAL  49          3HG2      VAL  49   9.630  -3.793   5.499
  429    H    LYS  50           H        LYS  50   9.573  -6.640   2.566
  430    HA   LYS  50           HA       LYS  50  11.310  -4.454   1.681
  431    HB2  LYS  50          1HB       LYS  50  11.621  -6.623   0.590
  432    HB3  LYS  50          2HB       LYS  50   9.890  -6.672   0.176
  433    HG2  LYS  50          1HG       LYS  50  10.186  -4.690  -1.264
  434    HG3  LYS  50          2HG       LYS  50  11.921  -4.666  -0.865
  435    HD2  LYS  50          1HD       LYS  50  12.182  -6.904  -1.854
  436    HD3  LYS  50          2HD       LYS  50  10.447  -6.932  -2.250
  437    HE2  LYS  50          1HE       LYS  50  10.768  -4.920  -3.663
  438    HE3  LYS  50          2HE       LYS  50  12.510  -4.979  -3.314
  439    HZ1  LYS  50          1HZ       LYS  50  11.989  -6.017  -5.415
  440    HZ2  LYS  50          2HZ       LYS  50  12.583  -7.139  -4.361
  441    HZ3  LYS  50          3HZ       LYS  50  10.966  -7.085  -4.686
  442    H    TYR  51           H        TYR  51  10.471  -2.741   0.392
  443    HA   TYR  51           HA       TYR  51   7.550  -2.480   0.641
  444    HB2  TYR  51          1HB       TYR  51   9.745  -0.415   0.801
  445    HB3  TYR  51          2HB       TYR  51   8.007  -0.040   0.707
  446    HD1  TYR  51          1HD       TYR  51  10.717  -1.286   2.849
  447    HD2  TYR  51          2HD       TYR  51   6.529  -0.523   2.609
  448    HE1  TYR  51          1HE       TYR  51  10.544  -1.502   5.310
  449    HE2  TYR  51          2HE       TYR  51   6.338  -0.735   5.064
  450    HH   TYR  51           HH       TYR  51   7.437  -1.123   7.020
  451    H    VAL  52           H        VAL  52   6.465  -2.405  -1.264
  452    HA   VAL  52           HA       VAL  52   7.857  -1.088  -3.491
  453    HB   VAL  52           HB       VAL  52   5.869  -3.402  -3.641
  454   HG11  VAL  52          1HG1      VAL  52   6.311  -3.319  -6.072
  455   HG12  VAL  52          2HG1      VAL  52   5.607  -1.789  -5.496
  456   HG13  VAL  52          3HG1      VAL  52   7.352  -1.896  -5.834
  457   HG21  VAL  52          1HG2      VAL  52   7.726  -4.681  -4.580
  458   HG22  VAL  52          2HG2      VAL  52   8.819  -3.306  -4.289
  459   HG23  VAL  52          3HG2      VAL  52   8.058  -4.145  -2.915
  460    H    CYS  53           H        CYS  53   6.789   0.638  -4.370
  461    HA   CYS  53           HA       CYS  53   4.046   1.028  -3.407
  462    HB2  CYS  53          1HB       CYS  53   5.979   3.241  -4.073
  463    HB3  CYS  53          2HB       CYS  53   4.421   3.362  -3.249
  464    HG   CYS  53           HG       CYS  53   6.362   3.918  -1.560
  465    H    CYS  54           H        CYS  54   2.681   2.349  -4.968
  466    HA   CYS  54           HA       CYS  54   3.782   2.770  -7.577
  467    HB2  CYS  54          1HB       CYS  54   1.819   1.525  -8.644
  468    HB3  CYS  54          2HB       CYS  54   3.220   0.595  -8.105
  469    HG   CYS  54           HG       CYS  54   1.023  -0.799  -7.703
  470    H    ASN  55           H        ASN  55   2.145   4.100  -8.913
  471    HA   ASN  55           HA       ASN  55   1.184   5.880  -6.831
  472    HB2  ASN  55          1HB       ASN  55   1.997   7.787  -8.301
  473    HB3  ASN  55          2HB       ASN  55   3.026   6.376  -7.953
  474   HD21  ASN  55          1HD2      ASN  55   3.266   7.443 -11.542
  475   HD22  ASN  55          2HD2      ASN  55   3.371   8.292 -10.036
  476    H    THR  56           H        THR  56  -0.482   3.741  -8.042
  477    HA   THR  56           HA       THR  56  -2.597   5.516  -9.017
  478    HB   THR  56           HB       THR  56  -3.345   3.684 -10.564
  479    HG1  THR  56          1HG       THR  56  -1.779   2.024 -11.016
  480   HG21  THR  56          1HG2      THR  56  -1.629   4.038 -12.305
  481   HG22  THR  56          2HG2      THR  56  -1.996   5.556 -11.450
  482   HG23  THR  56          3HG2      THR  56  -0.506   4.659 -11.073
  483    H    ASP  57           H        ASP  57  -4.775   4.140  -9.017
  484    HA   ASP  57           HA       ASP  57  -5.041   3.690  -6.248
  485    HB2  ASP  57          1HB       ASP  57  -7.059   3.628  -8.552
  486    HB3  ASP  57          2HB       ASP  57  -7.340   3.163  -6.857
  487    HD2  ASP  57           HD       ASP  57  -7.355   6.940  -7.744
  488    H    ARG  58           H        ARG  58  -5.240   1.672  -5.172
  489    HA   ARG  58           HA       ARG  58  -5.314  -0.465  -4.842
  490    HB2  ARG  58          1HB       ARG  58  -7.144  -0.422  -7.208
  491    HB3  ARG  58          2HB       ARG  58  -6.924  -1.804  -6.109
  492    HG2  ARG  58          1HG       ARG  58  -7.976  -0.730  -4.332
  493    HG3  ARG  58          2HG       ARG  58  -7.698   0.888  -5.018
  494    HD2  ARG  58          1HD       ARG  58  -9.548  -1.115  -6.250
  495    HD3  ARG  58          2HD       ARG  58 -10.053   0.043  -4.998
  496    HE   ARG  58           HE       ARG  58  -8.997   1.635  -7.122
  497   HH11  ARG  58          1HH1      ARG  58 -11.548  -0.723  -6.821
  498   HH12  ARG  58          2HH1      ARG  58 -12.459   0.094  -8.075
  499   HH21  ARG  58          1HH2      ARG  58 -10.025   2.577  -8.566
  500   HH22  ARG  58          2HH2      ARG  58 -11.592   1.976  -9.071
  501    H    CYS  59           H        CYS  59  -3.068   0.472  -6.454
  502    HA   CYS  59           HA       CYS  59  -2.817  -1.343  -8.667
  503    HB2  CYS  59          1HB       CYS  59  -0.684   0.080  -8.881
  504    HB3  CYS  59          2HB       CYS  59  -2.068   1.138  -8.513
  505    HG   CYS  59           HG       CYS  59   0.057   2.017  -7.352
  506    H    ASN  60           H        ASN  60  -1.963  -1.086  -5.257
  507    HA   ASN  60           HA       ASN  60   0.086  -3.080  -5.492
  508    HB2  ASN  60          1HB       ASN  60   0.259  -2.800  -3.011
  509    HB3  ASN  60          2HB       ASN  60   0.363  -1.243  -3.847
  510   HD21  ASN  60          1HD2      ASN  60  -0.180  -0.706  -1.507
  511   HD22  ASN  60          2HD2      ASN  60  -1.854  -0.490  -1.117
  Start of MODEL   13
    1    H1   MET   0          1H        MET   0  -8.127  10.214   0.405
    2    H2   MET   0          2H        MET   0  -9.206  10.828  -0.437
    3    H    MET   0           H        MET   0  -9.088   9.313  -0.351
    4    H3   MET   0          3H        MET   0  -9.096   9.336  -0.330
    5    HA   MET   0           HA       MET   0  -7.932  10.939  -2.291
    6    HB2  MET   0          1HB       MET   0  -5.899   9.440  -0.622
    7    HB3  MET   0          2HB       MET   0  -5.561  10.341  -2.120
    8    HG2  MET   0          1HG       MET   0  -6.750  11.668   0.320
    9    HG3  MET   0          2HG       MET   0  -4.992  11.470   0.123
   10    HE1  MET   0          1HE       MET   0  -7.675  14.605  -1.774
   11    HE2  MET   0          2HE       MET   0  -8.270  12.941  -1.547
   12    HE3  MET   0          3HE       MET   0  -7.721  13.891  -0.144
   13    H    LEU   1           H        LEU   1  -5.722   8.701  -2.739
   14    HA   LEU   1           HA       LEU   1  -7.324   7.218  -4.518
   15    HB2  LEU   1          1HB       LEU   1  -4.609   7.328  -3.522
   16    HB3  LEU   1          2HB       LEU   1  -4.962   5.777  -4.319
   17    HG   LEU   1           HG       LEU   1  -5.877   7.447  -6.217
   18   HD11  LEU   1          1HD1      LEU   1  -4.286   9.374  -6.443
   19   HD12  LEU   1          2HD1      LEU   1  -5.235   9.493  -4.944
   20   HD13  LEU   1          3HD1      LEU   1  -3.548   8.927  -4.887
   21   HD21  LEU   1          1HD2      LEU   1  -3.723   7.132  -7.385
   22   HD22  LEU   1          2HD2      LEU   1  -2.980   6.638  -5.843
   23   HD23  LEU   1          3HD2      LEU   1  -4.280   5.656  -6.560
   24    H    LYS   2           H        LYS   2  -6.796   4.599  -4.423
   25    HA   LYS   2           HA       LYS   2  -7.730   3.798  -1.754
   26    HB2  LYS   2          1HB       LYS   2  -8.406   2.402  -4.343
   27    HB3  LYS   2          2HB       LYS   2  -9.176   2.219  -2.749
   28    HG2  LYS   2          1HG       LYS   2  -9.317   4.744  -4.427
   29    HG3  LYS   2          2HG       LYS   2 -10.554   3.466  -4.454
   30    HD2  LYS   2          1HD       LYS   2 -11.034   3.794  -2.109
   31    HD3  LYS   2          2HD       LYS   2  -9.679   4.936  -1.948
   32    HE2  LYS   2          1HE       LYS   2 -11.821   6.120  -2.085
   33    HE3  LYS   2          2HE       LYS   2 -10.779   6.493  -3.477
   34    HZ1  LYS   2          1HZ       LYS   2 -13.046   6.076  -4.150
   35    HZ2  LYS   2          2HZ       LYS   2 -12.049   4.915  -4.769
   36    HZ3  LYS   2          3HZ       LYS   2 -13.017   4.570  -3.478
   37    H    CYS   3           H        CYS   3  -6.689   2.080  -0.790
   38    HA   CYS   3           HA       CYS   3  -4.677   0.755  -2.459
   39    HB2  CYS   3          1HB       CYS   3  -4.540   1.353   0.499
   40    HB3  CYS   3          2HB       CYS   3  -3.338   0.446  -0.423
   41    HG   CYS   3           HG       CYS   3  -2.379   2.819   0.187
   42    H    ASN   4           H        ASN   4  -4.434  -1.565  -2.079
   43    HA   ASN   4           HA       ASN   4  -6.966  -2.701  -1.513
   44    HB2  ASN   4          1HB       ASN   4  -4.375  -4.127  -2.462
   45    HB3  ASN   4          2HB       ASN   4  -5.966  -4.691  -1.896
   46   HD21  ASN   4          1HD2      ASN   4  -5.705  -4.163  -5.661
   47   HD22  ASN   4          2HD2      ASN   4  -4.580  -4.830  -4.525
   48    H    LYS   5           H        LYS   5  -7.330  -4.431   0.129
   49    HA   LYS   5           HA       LYS   5  -5.296  -4.554   2.221
   50    HB2  LYS   5          1HB       LYS   5  -8.246  -3.961   2.601
   51    HB3  LYS   5          2HB       LYS   5  -7.107  -4.348   3.912
   52    HG2  LYS   5          1HG       LYS   5  -6.771  -1.973   2.057
   53    HG3  LYS   5          2HG       LYS   5  -7.647  -1.885   3.603
   54    HD2  LYS   5          1HD       LYS   5  -5.629  -2.634   4.795
   55    HD3  LYS   5          2HD       LYS   5  -4.752  -2.736   3.249
   56    HE2  LYS   5          1HE       LYS   5  -4.807  -0.398   2.935
   57    HE3  LYS   5          2HE       LYS   5  -6.060  -0.177   4.176
   58    HZ1  LYS   5          1HZ       LYS   5  -3.894   0.485   4.973
   59    HZ2  LYS   5          2HZ       LYS   5  -4.441  -0.813   5.833
   60    HZ3  LYS   5          3HZ       LYS   5  -3.278  -1.017   4.681
   61    H    LEU   6           H        LEU   6  -8.712  -5.686   2.192
   62    HA   LEU   6           HA       LEU   6  -7.725  -8.384   2.544
   63    HB2  LEU   6          1HB       LEU   6  -9.384  -7.525   3.919
   64    HB3  LEU   6          2HB       LEU   6 -10.546  -7.159   2.623
   65    HG   LEU   6           HG       LEU   6 -10.521  -9.652   2.086
   66   HD11  LEU   6          1HD1      LEU   6  -9.836 -11.157   3.972
   67   HD12  LEU   6          2HD1      LEU   6  -8.455 -10.215   3.362
   68   HD13  LEU   6          3HD1      LEU   6  -9.261  -9.737   4.876
   69   HD21  LEU   6          1HD2      LEU   6 -12.137 -10.200   3.872
   70   HD22  LEU   6          2HD2      LEU   6 -11.607  -8.755   4.770
   71   HD23  LEU   6          3HD2      LEU   6 -12.397  -8.579   3.184
   72    H    VAL   7           H        VAL   7  -7.889 -10.043   1.059
   73    HA   VAL   7           HA       VAL   7  -8.231  -9.370  -1.649
   74    HB   VAL   7           HB       VAL   7  -8.177 -11.842  -2.010
   75   HG11  VAL   7          1HG1      VAL   7  -5.949 -12.252  -1.020
   76   HG12  VAL   7          2HG1      VAL   7  -6.056 -10.612  -1.700
   77   HG13  VAL   7          3HG1      VAL   7  -6.171 -10.855   0.060
   78   HG21  VAL   7          1HG2      VAL   7  -7.956 -13.357  -0.105
   79   HG22  VAL   7          2HG2      VAL   7  -8.250 -11.999   1.007
   80   HG23  VAL   7          3HG2      VAL   7  -9.527 -12.524  -0.116
   81    HA   PRO   8           HA       PRO   8  -8.717 -10.535  -3.230
   82    HB2  PRO   8          1HB       PRO   8  -9.932 -10.336  -5.623
   83    HB3  PRO   8          2HB       PRO   8 -10.101 -11.832  -4.694
   84    HG2  PRO   8          1HG       PRO   8 -12.007  -9.482  -4.894
   85    HG3  PRO   8          2HG       PRO   8 -12.367 -11.213  -4.921
   86    HD2  PRO   8          1HD       PRO   8 -12.604  -9.640  -2.632
   87    HD3  PRO   8          2HD       PRO   8 -12.321 -11.385  -2.580
   88    H    ILE   9           H        ILE   9 -11.160  -8.022  -3.372
   89    HA   ILE   9           HA       ILE   9  -9.122  -6.336  -4.655
   90    HB   ILE   9           HB       ILE   9 -12.106  -6.431  -5.111
   91   HG12  ILE   9          1HG1      ILE   9 -10.939  -8.278  -6.156
   92   HG13  ILE   9          2HG1      ILE   9 -11.504  -7.131  -7.385
   93   HG21  ILE   9          1HG2      ILE   9 -11.327  -4.798  -7.027
   94   HG22  ILE   9          2HG2      ILE   9 -11.710  -4.192  -5.399
   95   HG23  ILE   9          3HG2      ILE   9 -10.015  -4.435  -5.881
   96   HD11  ILE   9          1HD1      ILE   9  -8.680  -7.112  -6.231
   97   HD12  ILE   9          2HD1      ILE   9  -9.130  -7.992  -7.712
   98   HD13  ILE   9          3HD1      ILE   9  -9.276  -6.219  -7.654
   99    H    ALA  10           H        ALA  10 -11.106  -6.890  -1.907
  100    HA   ALA  10           HA       ALA  10 -12.250  -4.535  -1.289
  101    HB1  ALA  10          1HB       ALA  10 -12.626  -5.620   0.648
  102    HB2  ALA  10          2HB       ALA  10 -11.604  -6.933   0.018
  103    HB3  ALA  10          3HB       ALA  10 -10.891  -5.661   1.038
  104    H    TYR  11           H        TYR  11 -11.650  -2.491  -0.617
  105    HA   TYR  11           HA       TYR  11  -8.782  -2.033  -0.236
  106    HB2  TYR  11          1HB       TYR  11  -8.906  -0.113  -1.751
  107    HB3  TYR  11          2HB       TYR  11  -9.159  -1.674  -2.570
  108    HD1  TYR  11          1HD       TYR  11 -10.778   1.462  -1.482
  109    HD2  TYR  11          2HD       TYR  11 -11.294  -2.215  -3.580
  110    HE1  TYR  11          1HE       TYR  11 -12.905   2.310  -2.428
  111    HE2  TYR  11          2HE       TYR  11 -13.418  -1.384  -4.533
  112    HH   TYR  11           HH       TYR  11 -14.894   0.346  -4.643
  113    H    LYS  12           H        LYS  12  -8.319   0.154   0.681
  114    HA   LYS  12           HA       LYS  12 -10.668   1.263   2.048
  115    HB2  LYS  12          1HB       LYS  12  -7.873   0.707   3.055
  116    HB3  LYS  12          2HB       LYS  12  -8.933   1.907   3.832
  117    HG2  LYS  12          1HG       LYS  12 -10.613   0.112   4.223
  118    HG3  LYS  12          2HG       LYS  12  -9.470  -1.068   3.539
  119    HD2  LYS  12          1HD       LYS  12  -7.851  -0.561   5.297
  120    HD3  LYS  12          2HD       LYS  12  -8.933   0.687   5.958
  121    HE2  LYS  12          1HE       LYS  12 -10.643  -1.060   6.378
  122    HE3  LYS  12          2HE       LYS  12  -9.497  -2.289   5.794
  123    HZ1  LYS  12          1HZ       LYS  12  -9.488  -2.130   8.191
  124    HZ2  LYS  12          2HZ       LYS  12  -8.023  -1.672   7.589
  125    HZ3  LYS  12          3HZ       LYS  12  -9.086  -0.531   8.128
  126    H    THR  13           H        THR  13 -10.447   3.600   2.587
  127    HA   THR  13           HA       THR  13  -9.345   4.867   0.221
  128    HB   THR  13           HB       THR  13 -11.060   5.948   2.511
  129    HG1  THR  13          1HG       THR  13 -12.722   5.808   0.888
  130   HG21  THR  13          1HG2      THR  13 -11.478   7.854   0.996
  131   HG22  THR  13          2HG2      THR  13  -9.745   7.708   1.381
  132   HG23  THR  13          3HG2      THR  13 -10.356   7.153  -0.195
  133    H    CYS  14           H        CYS  14  -7.530   6.038   0.114
  134    HA   CYS  14           HA       CYS  14  -5.832   6.054   2.359
  135    HB2  CYS  14          1HB       CYS  14  -5.646   7.413  -0.327
  136    HB3  CYS  14          2HB       CYS  14  -4.364   7.459   0.887
  137    HG   CYS  14           HG       CYS  14  -3.696   5.802  -1.046
  138    HA   PRO  15           HA       PRO  15  -7.109   9.894   4.031
  139    HB2  PRO  15          1HB       PRO  15  -5.144  10.440   5.800
  140    HB3  PRO  15          2HB       PRO  15  -6.236   9.082   6.102
  141    HG2  PRO  15          1HG       PRO  15  -3.473   9.063   4.843
  142    HG3  PRO  15          2HG       PRO  15  -4.139   7.984   6.076
  143    HD2  PRO  15          1HD       PRO  15  -4.057   7.291   3.403
  144    HD3  PRO  15          2HD       PRO  15  -5.311   6.683   4.491
  145    H    GLU  16           H        GLU  16  -6.838  12.178   3.985
  146    HA   GLU  16           HA       GLU  16  -5.537  13.057   1.743
  147    HB2  GLU  16          1HB       GLU  16  -7.289  14.284   2.933
  148    HB3  GLU  16          2HB       GLU  16  -6.196  14.526   4.317
  149    HG2  GLU  16          1HG       GLU  16  -4.716  15.975   2.845
  150    HG3  GLU  16          2HG       GLU  16  -5.859  15.584   1.541
  151    HE2  GLU  16           HE       GLU  16  -6.849  18.724   3.020
  152    H    GLY  17           H        GLY  17  -3.476  13.898   1.294
  153    HA2  GLY  17          1HA       GLY  17  -1.364  14.708   1.950
  154    HA3  GLY  17          2HA       GLY  17  -1.537  13.926   3.507
  155    H    LYS  18           H        LYS  18  -2.645  11.389   2.272
  156    HA   LYS  18           HA       LYS  18  -0.121  10.364   1.210
  157    HB2  LYS  18          1HB       LYS  18  -2.618   9.004   2.264
  158    HB3  LYS  18          2HB       LYS  18  -1.203   8.151   1.604
  159    HG2  LYS  18          1HG       LYS  18   0.184   9.225   3.410
  160    HG3  LYS  18          2HG       LYS  18  -1.326   9.849   4.116
  161    HD2  LYS  18          1HD       LYS  18  -2.129   7.667   4.591
  162    HD3  LYS  18          2HD       LYS  18  -0.903   6.907   3.550
  163    HE2  LYS  18          1HE       LYS  18   0.853   7.799   5.114
  164    HE3  LYS  18          2HE       LYS  18  -0.459   8.316   6.197
  165    HZ1  LYS  18          1HZ       LYS  18   0.422   6.172   6.826
  166    HZ2  LYS  18          2HZ       LYS  18  -1.150   6.020   6.349
  167    HZ3  LYS  18          3HZ       LYS  18   0.068   5.541   5.344
  168    H    ASN  19           H        ASN  19  -0.258   8.814  -0.661
  169    HA   ASN  19           HA       ASN  19  -2.383   9.542  -2.460
  170    HB2  ASN  19          1HB       ASN  19  -0.639  11.502  -2.715
  171    HB3  ASN  19          2HB       ASN  19   0.380  10.059  -2.934
  172   HD21  ASN  19          1HD2      ASN  19   0.036  10.221  -6.342
  173   HD22  ASN  19          2HD2      ASN  19   1.027  10.002  -4.938
  174    H    LEU  20           H        LEU  20   0.637   7.827  -1.602
  175    HA   LEU  20           HA       LEU  20   0.476   6.191  -4.002
  176    HB2  LEU  20          1HB       LEU  20   2.369   6.248  -1.731
  177    HB3  LEU  20          2HB       LEU  20   2.749   5.389  -3.241
  178    HG   LEU  20           HG       LEU  20   2.563   8.391  -2.796
  179   HD11  LEU  20          1HD1      LEU  20   4.939   8.341  -3.601
  180   HD12  LEU  20          2HD1      LEU  20   4.725   7.323  -2.157
  181   HD13  LEU  20          3HD1      LEU  20   4.830   6.573  -3.769
  182   HD21  LEU  20          1HD2      LEU  20   3.052   8.640  -5.206
  183   HD22  LEU  20          2HD2      LEU  20   2.901   6.877  -5.401
  184   HD23  LEU  20          3HD2      LEU  20   1.491   7.841  -4.901
  185    H    CYS  21           H        CYS  21   0.406   3.858  -3.907
  186    HA   CYS  21           HA       CYS  21  -0.555   2.870  -1.322
  187    HB2  CYS  21          1HB       CYS  21  -1.172   1.969  -4.132
  188    HB3  CYS  21          2HB       CYS  21  -1.537   0.988  -2.710
  189    HG   CYS  21           HG       CYS  21  -3.751   2.083  -3.622
  190    H    TYR  22           H        TYR  22   0.719   1.312  -0.326
  191    HA   TYR  22           HA       TYR  22   2.958   0.271  -1.931
  192    HB2  TYR  22          1HB       TYR  22   4.351   0.429  -0.046
  193    HB3  TYR  22          2HB       TYR  22   3.534   2.000  -0.236
  194    HD1  TYR  22          1HD       TYR  22   3.744  -1.064   1.821
  195    HD2  TYR  22          2HD       TYR  22   1.978   2.798   1.434
  196    HE1  TYR  22          1HE       TYR  22   2.949  -1.201   4.164
  197    HE2  TYR  22          2HE       TYR  22   1.178   2.679   3.769
  198    HH   TYR  22           HH       TYR  22   1.090   1.440   5.679
  199    H    LYS  23           H        LYS  23   3.772  -1.873  -1.293
  200    HA   LYS  23           HA       LYS  23   2.006  -3.297   0.561
  201    HB2  LYS  23          1HB       LYS  23   2.282  -5.317  -0.804
  202    HB3  LYS  23          2HB       LYS  23   1.428  -4.025  -1.679
  203    HG2  LYS  23          1HG       LYS  23   3.460  -3.490  -2.926
  204    HG3  LYS  23          2HG       LYS  23   4.364  -4.723  -2.014
  205    HD2  LYS  23          1HD       LYS  23   3.561  -5.396  -4.341
  206    HD3  LYS  23          2HD       LYS  23   3.153  -6.501  -3.006
  207    HE2  LYS  23          1HE       LYS  23   0.911  -5.535  -2.869
  208    HE3  LYS  23          2HE       LYS  23   1.313  -4.384  -4.165
  209    HZ1  LYS  23          1HZ       LYS  23   0.083  -6.270  -5.000
  210    HZ2  LYS  23          2HZ       LYS  23   1.601  -6.253  -5.646
  211    HZ3  LYS  23          3HZ       LYS  23   1.228  -7.320  -4.445
  212    H    MET  24           H        MET  24   3.069  -4.929   1.837
  213    HA   MET  24           HA       MET  24   5.954  -4.484   1.873
  214    HB2  MET  24          1HB       MET  24   4.004  -5.152   4.088
  215    HB3  MET  24          2HB       MET  24   5.772  -5.103   4.291
  216    HG2  MET  24          1HG       MET  24   5.719  -2.704   3.584
  217    HG3  MET  24          2HG       MET  24   3.942  -2.792   3.583
  218    HE1  MET  24          1HE       MET  24   3.011  -3.165   7.308
  219    HE2  MET  24          2HE       MET  24   2.449  -2.758   5.668
  220    HE3  MET  24          3HE       MET  24   3.060  -4.393   6.020
  221    H    PHE  25           H        PHE  25   7.328  -6.256   1.766
  222    HA   PHE  25           HA       PHE  25   6.031  -8.885   1.907
  223    HB2  PHE  25          1HB       PHE  25   8.644  -7.866   0.650
  224    HB3  PHE  25          2HB       PHE  25   8.121  -9.553   0.589
  225    HD1  PHE  25          1HD       PHE  25   6.498 -10.260  -0.986
  226    HD2  PHE  25          2HD       PHE  25   7.393  -6.137  -0.594
  227    HE1  PHE  25          1HE       PHE  25   5.234  -9.783  -3.114
  228    HE2  PHE  25          2HE       PHE  25   6.140  -5.657  -2.715
  229    HZ   PHE  25           HZ       PHE  25   5.076  -7.484  -3.949
  230    H    MET  26           H        MET  26   7.501 -10.677   2.806
  231    HA   MET  26           HA       MET  26   9.495  -9.543   4.612
  232    HB2  MET  26          1HB       MET  26   7.920 -12.121   4.774
  233    HB3  MET  26          2HB       MET  26   9.262 -11.696   5.864
  234    HG2  MET  26          1HG       MET  26   8.008  -9.751   6.665
  235    HG3  MET  26          2HG       MET  26   6.671 -10.147   5.561
  236    HE1  MET  26          1HE       MET  26   5.151 -10.988   9.097
  237    HE2  MET  26          2HE       MET  26   6.267  -9.659   8.697
  238    HE3  MET  26          3HE       MET  26   4.940 -10.073   7.584
  239    H    MET  27           H        MET  27  11.604 -10.515   4.653
  240    HA   MET  27           HA       MET  27  12.583 -11.021   2.202
  241    HB2  MET  27          1HB       MET  27  13.530 -11.781   4.959
  242    HB3  MET  27          2HB       MET  27  14.510 -12.133   3.514
  243    HG2  MET  27          1HG       MET  27  13.591  -9.393   4.439
  244    HG3  MET  27          2HG       MET  27  15.234 -10.057   4.605
  245    HE1  MET  27          1HE       MET  27  16.509 -10.211   0.934
  246    HE2  MET  27          2HE       MET  27  16.933 -10.346   2.658
  247    HE3  MET  27          3HE       MET  27  15.811 -11.516   1.922
  248    H    SER  28           H        SER  28  11.183 -13.357   4.514
  249    HA   SER  28           HA       SER  28  11.896 -15.664   3.170
  250    HB2  SER  28          1HB       SER  28  10.904 -15.657   5.387
  251    HB3  SER  28          2HB       SER  28   9.397 -14.966   4.743
  252    HG   SER  28           HG       SER  28   9.274 -17.232   5.053
  253    H    ASP  29           H        ASP  29   8.580 -14.160   3.121
  254    HA   ASP  29           HA       ASP  29   8.157 -15.478   0.610
  255    HB2  ASP  29          1HB       ASP  29   6.417 -15.523   2.502
  256    HB3  ASP  29          2HB       ASP  29   6.377 -13.765   2.217
  257    HD2  ASP  29           HD       ASP  29   3.690 -15.328   0.326
  258    H    LEU  30           H        LEU  30   9.604 -14.090  -0.720
  259    HA   LEU  30           HA       LEU  30   8.987 -11.300  -0.939
  260    HB2  LEU  30          1HB       LEU  30  10.729 -13.308  -2.079
  261    HB3  LEU  30          2HB       LEU  30  10.496 -11.935  -3.184
  262    HG   LEU  30           HG       LEU  30  11.872 -10.599  -1.997
  263   HD11  LEU  30          1HD1      LEU  30  11.824 -10.447   0.507
  264   HD12  LEU  30          2HD1      LEU  30  10.183 -10.368  -0.177
  265   HD13  LEU  30          3HD1      LEU  30  10.770 -11.879   0.559
  266   HD21  LEU  30          1HD2      LEU  30  13.597 -11.758  -0.661
  267   HD22  LEU  30          2HD2      LEU  30  12.575 -13.216  -0.639
  268   HD23  LEU  30          3HD2      LEU  30  13.221 -12.605  -2.181
  269    H    THR  31           H        THR  31   7.650 -14.268  -2.112
  270    HA   THR  31           HA       THR  31   6.949 -13.340  -4.717
  271    HB   THR  31           HB       THR  31   5.889 -15.667  -3.042
  272    HG1  THR  31          1HG       THR  31   7.358 -16.866  -4.390
  273   HG21  THR  31          1HG2      THR  31   5.121 -16.581  -5.203
  274   HG22  THR  31          2HG2      THR  31   4.345 -15.017  -4.857
  275   HG23  THR  31          3HG2      THR  31   5.683 -15.107  -6.026
  276    H    ILE  32           H        ILE  32   5.255 -13.581  -1.550
  277    HA   ILE  32           HA       ILE  32   3.073 -12.056  -2.789
  278    HB   ILE  32           HB       ILE  32   2.905 -14.383  -0.817
  279   HG12  ILE  32          1HG1      ILE  32   3.131 -15.020  -3.130
  280   HG13  ILE  32          2HG1      ILE  32   1.538 -15.442  -2.460
  281   HG21  ILE  32          1HG2      ILE  32   0.471 -13.956  -0.780
  282   HG22  ILE  32          2HG2      ILE  32   1.374 -12.565  -0.137
  283   HG23  ILE  32          3HG2      ILE  32   0.710 -12.508  -1.786
  284   HD11  ILE  32          1HD1      ILE  32   1.337 -14.581  -4.760
  285   HD12  ILE  32          2HD1      ILE  32   0.545 -13.493  -3.596
  286   HD13  ILE  32          3HD1      ILE  32   2.138 -13.073  -4.266
  287    HA   PRO  33           HA       PRO  33   4.023  -9.392   0.522
  288    HB2  PRO  33          1HB       PRO  33   2.186  -7.439   0.074
  289    HB3  PRO  33          2HB       PRO  33   3.606  -7.583  -0.972
  290    HG2  PRO  33          1HG       PRO  33   0.803  -8.672  -1.399
  291    HG3  PRO  33          2HG       PRO  33   1.853  -7.827  -2.544
  292    HD2  PRO  33          1HD       PRO  33   1.633 -10.564  -2.547
  293    HD3  PRO  33          2HD       PRO  33   3.144  -9.763  -2.993
  294    H    VAL  34           H        VAL  34   3.023  -8.398   2.501
  295    HA   VAL  34           HA       VAL  34   1.229 -10.543   3.404
  296    HB   VAL  34           HB       VAL  34   2.288 -10.275   5.619
  297   HG11  VAL  34          1HG1      VAL  34   4.558 -11.088   5.069
  298   HG12  VAL  34          2HG1      VAL  34   3.335 -11.846   4.022
  299   HG13  VAL  34          3HG1      VAL  34   4.353 -10.528   3.393
  300   HG21  VAL  34          1HG2      VAL  34   4.215  -8.806   5.940
  301   HG22  VAL  34          2HG2      VAL  34   3.997  -8.164   4.295
  302   HG23  VAL  34          3HG2      VAL  34   2.741  -7.897   5.529
  303    H    LYS  35           H        LYS  35   1.949  -7.055   3.349
  304    HA   LYS  35           HA       LYS  35  -0.782  -6.559   4.151
  305    HB2  LYS  35          1HB       LYS  35   1.650  -5.755   5.734
  306    HB3  LYS  35          2HB       LYS  35   0.212  -4.707   5.706
  307    HG2  LYS  35          1HG       LYS  35  -1.088  -6.824   6.425
  308    HG3  LYS  35          2HG       LYS  35   0.509  -7.494   6.835
  309    HD2  LYS  35          1HD       LYS  35  -0.225  -6.553   8.853
  310    HD3  LYS  35          2HD       LYS  35   0.855  -5.313   8.175
  311    HE2  LYS  35          1HE       LYS  35  -1.010  -4.026   7.373
  312    HE3  LYS  35          2HE       LYS  35  -2.151  -5.323   7.798
  313    HZ1  LYS  35          1HZ       LYS  35  -2.160  -3.559   9.429
  314    HZ2  LYS  35          2HZ       LYS  35  -1.605  -4.957  10.109
  315    HZ3  LYS  35          3HZ       LYS  35  -0.547  -3.754   9.714
  316    H    ARG  36           H        ARG  36  -1.545  -4.501   3.428
  317    HA   ARG  36           HA       ARG  36   0.463  -2.918   2.059
  318    HB2  ARG  36          1HB       ARG  36  -2.321  -3.556   0.976
  319    HB3  ARG  36          2HB       ARG  36  -1.135  -2.499   0.191
  320    HG2  ARG  36          1HG       ARG  36  -0.728  -4.476  -0.941
  321    HG3  ARG  36          2HG       ARG  36   0.413  -4.675   0.400
  322    HD2  ARG  36          1HD       ARG  36  -0.758  -6.741   0.279
  323    HD3  ARG  36          2HD       ARG  36  -1.524  -5.891   1.628
  324    HE   ARG  36           HE       ARG  36  -2.974  -5.179  -0.681
  325   HH11  ARG  36          1HH1      ARG  36  -5.233  -7.825  -0.747
  326   HH12  ARG  36          2HH1      ARG  36  -4.883  -6.200  -1.295
  327   HH21  ARG  36          1HH2      ARG  36  -3.726  -8.944   0.621
  328   HH22  ARG  36          2HH2      ARG  36  -2.255  -8.161   1.093
  329    H    GLY  37           H        GLY  37  -0.609  -0.634   1.463
  330    HA2  GLY  37          1HA       GLY  37  -2.878   0.291   2.792
  331    HA3  GLY  37          2HA       GLY  37  -1.514   0.544   3.865
  332    H    CYS  38           H        CYS  38  -2.172   2.893   3.464
  333    HA   CYS  38           HA       CYS  38  -1.251   3.827   0.858
  334    HB2  CYS  38          1HB       CYS  38  -2.872   5.004   3.237
  335    HB3  CYS  38          2HB       CYS  38  -2.626   5.872   1.701
  336    HG   CYS  38           HG       CYS  38  -5.079   5.115   1.909
  337    H    ILE  39           H        ILE  39   0.341   5.584   0.783
  338    HA   ILE  39           HA       ILE  39   1.133   6.783   3.256
  339    HB   ILE  39           HB       ILE  39   2.598   4.688   3.103
  340   HG12  ILE  39          1HG1      ILE  39   4.255   7.158   2.826
  341   HG13  ILE  39          2HG1      ILE  39   3.131   6.949   4.188
  342   HG21  ILE  39          1HG2      ILE  39   4.425   4.737   1.439
  343   HG22  ILE  39          2HG2      ILE  39   2.837   4.657   0.642
  344   HG23  ILE  39          3HG2      ILE  39   3.722   6.199   0.708
  345   HD11  ILE  39          1HD1      ILE  39   5.411   6.246   4.801
  346   HD12  ILE  39          2HD1      ILE  39   4.286   4.867   4.824
  347   HD13  ILE  39          3HD1      ILE  39   5.411   5.076   3.462
  348    H    ASP  40           H        ASP  40   2.702   8.618   2.827
  349    HA   ASP  40           HA       ASP  40   1.895   9.814   0.347
  350    HB2  ASP  40          1HB       ASP  40   2.927  11.918   1.380
  351    HB3  ASP  40          2HB       ASP  40   1.625  11.033   2.213
  352    HD2  ASP  40           HD       ASP  40   4.429  11.847   4.490
  353    H    VAL  41           H        VAL  41   4.904   8.971   2.203
  354    HA   VAL  41           HA       VAL  41   6.415   9.275  -0.300
  355    HB   VAL  41           HB       VAL  41   7.360   9.541   2.596
  356   HG11  VAL  41          1HG1      VAL  41   9.519  10.208   1.593
  357   HG12  VAL  41          2HG1      VAL  41   9.080   8.550   1.122
  358   HG13  VAL  41          3HG1      VAL  41   8.864   9.888  -0.031
  359   HG21  VAL  41          1HG2      VAL  41   7.765  11.884   2.038
  360   HG22  VAL  41          2HG2      VAL  41   7.047  11.625   0.430
  361   HG23  VAL  41          3HG2      VAL  41   6.045  11.450   1.891
  362    H    CYS  42           H        CYS  42   7.501   7.502  -1.073
  363    HA   CYS  42           HA       CYS  42   6.641   5.037  -0.019
  364    HB2  CYS  42          1HB       CYS  42   6.968   5.449  -2.404
  365    HB3  CYS  42          2HB       CYS  42   8.707   5.621  -2.152
  366    HG   CYS  42           HG       CYS  42   8.205   3.334  -3.355
  367    HA   PRO  43           HA       PRO  43   9.961   4.703   2.824
  368    HB2  PRO  43          1HB       PRO  43   9.305   2.338   4.010
  369    HB3  PRO  43          2HB       PRO  43   8.398   3.811   4.380
  370    HG2  PRO  43          1HG       PRO  43   7.742   1.614   2.394
  371    HG3  PRO  43          2HG       PRO  43   6.671   2.438   3.537
  372    HD2  PRO  43          1HD       PRO  43   6.771   3.149   0.881
  373    HD3  PRO  43          2HD       PRO  43   6.428   4.338   2.145
  374    H    LYS  44           H        LYS  44  12.043   3.981   2.885
  375    HA   LYS  44           HA       LYS  44  12.805   2.503   0.592
  376    HB2  LYS  44          1HB       LYS  44  14.268   3.300   3.125
  377    HB3  LYS  44          2HB       LYS  44  15.045   2.522   1.726
  378    HG2  LYS  44          1HG       LYS  44  14.444   4.444   0.315
  379    HG3  LYS  44          2HG       LYS  44  13.649   5.220   1.705
  380    HD2  LYS  44          1HD       LYS  44  15.780   5.315   2.901
  381    HD3  LYS  44          2HD       LYS  44  16.589   4.476   1.557
  382    HE2  LYS  44          1HE       LYS  44  16.036   6.338   0.054
  383    HE3  LYS  44          2HE       LYS  44  15.218   7.178   1.392
  384    HZ1  LYS  44          1HZ       LYS  44  17.452   7.996   1.061
  385    HZ2  LYS  44          2HZ       LYS  44  17.329   7.270   2.538
  386    HZ3  LYS  44          3HZ       LYS  44  18.086   6.491   1.297
  387    H    ASN  45           H        ASN  45  14.126   0.450   0.703
  388    HA   ASN  45           HA       ASN  45  12.447  -1.433   1.937
  389    HB2  ASN  45          1HB       ASN  45  15.043  -2.019   0.336
  390    HB3  ASN  45          2HB       ASN  45  13.817  -2.994   1.182
  391   HD21  ASN  45          1HD2      ASN  45  13.154  -2.345  -2.539
  392   HD22  ASN  45          2HD2      ASN  45  14.644  -2.630  -1.701
  393    H    SER  46           H        SER  46  12.965  -2.877   3.711
  394    HA   SER  46           HA       SER  46  15.309  -2.033   5.221
  395    HB2  SER  46          1HB       SER  46  14.139  -2.842   7.199
  396    HB3  SER  46          2HB       SER  46  13.112  -1.699   6.305
  397    HG   SER  46           HG       SER  46  12.010  -3.490   5.440
  398    H    LEU  47           H        LEU  47  15.921  -4.072   6.844
  399    HA   LEU  47           HA       LEU  47  16.932  -5.987   4.980
  400    HB2  LEU  47          1HB       LEU  47  16.990  -5.665   7.913
  401    HB3  LEU  47          2HB       LEU  47  17.980  -6.937   7.161
  402    HG   LEU  47           HG       LEU  47  18.276  -3.934   6.765
  403   HD11  LEU  47          1HD1      LEU  47  20.486  -4.273   7.903
  404   HD12  LEU  47          2HD1      LEU  47  19.137  -4.752   8.958
  405   HD13  LEU  47          3HD1      LEU  47  20.095  -5.995   8.118
  406   HD21  LEU  47          1HD2      LEU  47  20.273  -4.503   5.427
  407   HD22  LEU  47          2HD2      LEU  47  19.870  -6.230   5.593
  408   HD23  LEU  47          3HD2      LEU  47  18.769  -5.139   4.720
  409    H    LEU  48           H        LEU  48  14.162  -5.706   7.105
  410    HA   LEU  48           HA       LEU  48  13.897  -8.609   7.249
  411    HB2  LEU  48          1HB       LEU  48  12.512  -6.308   8.484
  412    HB3  LEU  48          2HB       LEU  48  12.017  -7.962   8.913
  413    HG   LEU  48           HG       LEU  48  14.701  -6.648   9.486
  414   HD11  LEU  48          1HD1      LEU  48  14.023  -6.958  11.881
  415   HD12  LEU  48          2HD1      LEU  48  12.858  -5.938  11.007
  416   HD13  LEU  48          3HD1      LEU  48  12.475  -7.645  11.339
  417   HD21  LEU  48          1HD2      LEU  48  15.272  -8.743  10.664
  418   HD22  LEU  48          2HD2      LEU  48  13.747  -9.461  10.091
  419   HD23  LEU  48          3HD2      LEU  48  15.003  -8.986   8.922
  420    H    VAL  49           H        VAL  49  12.132  -5.626   6.217
  421    HA   VAL  49           HA       VAL  49  10.384  -7.390   4.648
  422    HB   VAL  49           HB       VAL  49   8.573  -5.681   5.038
  423   HG11  VAL  49          1HG1      VAL  49   8.048  -6.386   7.348
  424   HG12  VAL  49          2HG1      VAL  49   8.656  -7.752   6.385
  425   HG13  VAL  49          3HG1      VAL  49   9.723  -6.946   7.559
  426   HG21  VAL  49          1HG2      VAL  49   8.811  -4.089   6.875
  427   HG22  VAL  49          2HG2      VAL  49  10.514  -4.566   7.068
  428   HG23  VAL  49          3HG2      VAL  49   9.975  -3.777   5.567
  429    H    LYS  50           H        LYS  50   9.732  -6.579   2.589
  430    HA   LYS  50           HA       LYS  50  11.432  -4.371   1.680
  431    HB2  LYS  50          1HB       LYS  50  11.797  -6.501   0.554
  432    HB3  LYS  50          2HB       LYS  50  10.057  -6.636   0.205
  433    HG2  LYS  50          1HG       LYS  50  10.207  -4.630  -1.235
  434    HG3  LYS  50          2HG       LYS  50  11.954  -4.544  -0.912
  435    HD2  LYS  50          1HD       LYS  50  12.267  -6.754  -1.930
  436    HD3  LYS  50          2HD       LYS  50  10.516  -6.875  -2.226
  437    HE2  LYS  50          1HE       LYS  50  10.646  -4.856  -3.657
  438    HE3  LYS  50          2HE       LYS  50  12.405  -4.813  -3.404
  439    HZ1  LYS  50          1HZ       LYS  50  11.831  -5.886  -5.473
  440    HZ2  LYS  50          2HZ       LYS  50  12.544  -6.970  -4.454
  441    HZ3  LYS  50          3HZ       LYS  50  10.911  -7.009  -4.688
  442    H    TYR  51           H        TYR  51  10.528  -2.660   0.440
  443    HA   TYR  51           HA       TYR  51   7.606  -2.476   0.749
  444    HB2  TYR  51          1HB       TYR  51   9.749  -0.353   0.872
  445    HB3  TYR  51          2HB       TYR  51   7.998  -0.031   0.843
  446    HD1  TYR  51          1HD       TYR  51  10.815  -1.239   2.870
  447    HD2  TYR  51          2HD       TYR  51   6.604  -0.563   2.788
  448    HE1  TYR  51          1HE       TYR  51  10.733  -1.492   5.333
  449    HE2  TYR  51          2HE       TYR  51   6.506  -0.813   5.246
  450    HH   TYR  51           HH       TYR  51   7.681  -1.202   7.157
  451    H    VAL  52           H        VAL  52   6.458  -2.348  -1.118
  452    HA   VAL  52           HA       VAL  52   7.798  -1.025  -3.372
  453    HB   VAL  52           HB       VAL  52   5.781  -3.316  -3.497
  454   HG11  VAL  52          1HG1      VAL  52   6.207  -3.239  -5.932
  455   HG12  VAL  52          2HG1      VAL  52   5.535  -1.696  -5.349
  456   HG13  VAL  52          3HG1      VAL  52   7.275  -1.835  -5.700
  457   HG21  VAL  52          1HG2      VAL  52   7.607  -4.628  -4.451
  458   HG22  VAL  52          2HG2      VAL  52   8.727  -3.274  -4.167
  459   HG23  VAL  52          3HG2      VAL  52   7.960  -4.101  -2.789
  460    H    CYS  53           H        CYS  53   6.737   0.742  -4.158
  461    HA   CYS  53           HA       CYS  53   4.004   1.114  -3.162
  462    HB2  CYS  53          1HB       CYS  53   5.914   3.346  -3.810
  463    HB3  CYS  53          2HB       CYS  53   4.381   3.432  -2.939
  464    HG   CYS  53           HG       CYS  53   6.368   3.955  -1.292
  465    H    CYS  54           H        CYS  54   2.617   2.455  -4.676
  466    HA   CYS  54           HA       CYS  54   3.669   2.969  -7.281
  467    HB2  CYS  54          1HB       CYS  54   1.736   1.671  -8.362
  468    HB3  CYS  54          2HB       CYS  54   3.199   0.802  -7.892
  469    HG   CYS  54           HG       CYS  54   1.092  -0.724  -7.493
  470    H    ASN  55           H        ASN  55   2.030   4.309  -8.546
  471    HA   ASN  55           HA       ASN  55   0.870   5.915  -6.423
  472    HB2  ASN  55          1HB       ASN  55   1.558   7.940  -7.799
  473    HB3  ASN  55          2HB       ASN  55   2.688   6.607  -7.463
  474   HD21  ASN  55          1HD2      ASN  55   2.973   7.814 -10.999
  475   HD22  ASN  55          2HD2      ASN  55   2.965   8.609  -9.460
  476    H    THR  56           H        THR  56  -0.579   3.700  -7.775
  477    HA   THR  56           HA       THR  56  -2.762   5.306  -8.892
  478    HB   THR  56           HB       THR  56  -3.215   3.449 -10.513
  479    HG1  THR  56          1HG       THR  56  -1.489   1.922 -10.837
  480   HG21  THR  56          1HG2      THR  56  -1.386   3.961 -12.092
  481   HG22  THR  56          2HG2      THR  56  -1.947   5.433 -11.261
  482   HG23  THR  56          3HG2      THR  56  -0.429   4.651 -10.760
  483    H    ASP  57           H        ASP  57  -4.813   3.773  -9.071
  484    HA   ASP  57           HA       ASP  57  -5.235   3.298  -6.319
  485    HB2  ASP  57          1HB       ASP  57  -7.119   3.122  -8.736
  486    HB3  ASP  57          2HB       ASP  57  -7.466   2.710  -7.038
  487    HD2  ASP  57           HD       ASP  57  -7.533   6.455  -8.073
  488    H    ARG  58           H        ARG  58  -5.399   1.262  -5.276
  489    HA   ARG  58           HA       ARG  58  -5.405  -0.879  -4.966
  490    HB2  ARG  58          1HB       ARG  58  -7.006  -0.964  -7.492
  491    HB3  ARG  58          2HB       ARG  58  -6.853  -2.282  -6.306
  492    HG2  ARG  58          1HG       ARG  58  -8.198  -1.244  -4.763
  493    HG3  ARG  58          2HG       ARG  58  -7.782   0.389  -5.338
  494    HD2  ARG  58          1HD       ARG  58  -9.450  -1.495  -6.950
  495    HD3  ARG  58          2HD       ARG  58 -10.140  -0.443  -5.691
  496    HE   ARG  58           HE       ARG  58  -8.809   1.336  -7.465
  497   HH11  ARG  58          1HH1      ARG  58 -11.272  -1.102  -7.855
  498   HH12  ARG  58          2HH1      ARG  58 -11.970  -0.193  -9.180
  499   HH21  ARG  58          1HH2      ARG  58  -9.592   2.384  -8.988
  500   HH22  ARG  58          2HH2      ARG  58 -11.013   1.794  -9.828
  501    H    CYS  59           H        CYS  59  -3.115   0.235  -6.450
  502    HA   CYS  59           HA       CYS  59  -2.581  -1.571  -8.610
  503    HB2  CYS  59          1HB       CYS  59  -0.530  -0.021  -8.674
  504    HB3  CYS  59          2HB       CYS  59  -1.991   0.955  -8.385
  505    HG   CYS  59           HG       CYS  59   0.005   1.935  -7.083
  506    H    ASN  60           H        ASN  60  -2.025  -1.293  -5.144
  507    HA   ASN  60           HA       ASN  60  -0.047  -3.394  -5.250
  508    HB2  ASN  60          1HB       ASN  60   0.077  -3.061  -2.783
  509    HB3  ASN  60          2HB       ASN  60   0.301  -1.529  -3.640
  510   HD21  ASN  60          1HD2      ASN  60  -0.270  -0.899  -1.339
  511   HD22  ASN  60          2HD2      ASN  60  -1.936  -0.578  -0.996
  Start of MODEL   14
    1    H1   MET   0          1H        MET   0  -8.088  10.187   0.420
    2    H2   MET   0          2H        MET   0  -9.176  10.793  -0.416
    3    H    MET   0           H        MET   0  -9.051   9.279  -0.326
    4    H3   MET   0          3H        MET   0  -9.059   9.302  -0.304
    5    HA   MET   0           HA       MET   0  -7.912  10.904  -2.278
    6    HB2  MET   0          1HB       MET   0  -5.860   9.414  -0.625
    7    HB3  MET   0          2HB       MET   0  -5.541  10.323  -2.121
    8    HG2  MET   0          1HG       MET   0  -6.708  11.621   0.346
    9    HG3  MET   0          2HG       MET   0  -4.952  11.455   0.107
   10    HE1  MET   0          1HE       MET   0  -7.724  14.565  -1.695
   11    HE2  MET   0          2HE       MET   0  -8.292  12.893  -1.463
   12    HE3  MET   0          3HE       MET   0  -7.715  13.838  -0.069
   13    H    LEU   1           H        LEU   1  -5.697   8.673  -2.733
   14    HA   LEU   1           HA       LEU   1  -7.302   7.177  -4.494
   15    HB2  LEU   1          1HB       LEU   1  -4.583   7.298  -3.514
   16    HB3  LEU   1          2HB       LEU   1  -4.936   5.743  -4.303
   17    HG   LEU   1           HG       LEU   1  -5.859   7.387  -6.210
   18   HD11  LEU   1          1HD1      LEU   1  -4.307   9.343  -6.445
   19   HD12  LEU   1          2HD1      LEU   1  -5.264   9.454  -4.949
   20   HD13  LEU   1          3HD1      LEU   1  -3.566   8.923  -4.883
   21   HD21  LEU   1          1HD2      LEU   1  -3.696   7.107  -7.369
   22   HD22  LEU   1          2HD2      LEU   1  -2.948   6.639  -5.822
   23   HD23  LEU   1          3HD2      LEU   1  -4.226   5.626  -6.537
   24    H    LYS   2           H        LYS   2  -6.765   4.560  -4.394
   25    HA   LYS   2           HA       LYS   2  -7.694   3.767  -1.720
   26    HB2  LYS   2          1HB       LYS   2  -8.390   2.368  -4.300
   27    HB3  LYS   2          2HB       LYS   2  -9.155   2.198  -2.704
   28    HG2  LYS   2          1HG       LYS   2  -9.286   4.713  -4.397
   29    HG3  LYS   2          2HG       LYS   2 -10.533   3.443  -4.404
   30    HD2  LYS   2          1HD       LYS   2 -11.012   3.803  -2.071
   31    HD3  LYS   2          2HD       LYS   2  -9.628   4.908  -1.908
   32    HE2  LYS   2          1HE       LYS   2 -11.733   6.152  -2.046
   33    HE3  LYS   2          2HE       LYS   2 -10.687   6.491  -3.443
   34    HZ1  LYS   2          1HZ       LYS   2 -12.966   6.135  -4.106
   35    HZ2  LYS   2          2HZ       LYS   2 -12.006   4.945  -4.724
   36    HZ3  LYS   2          3HZ       LYS   2 -12.976   4.631  -3.428
   37    H    CYS   3           H        CYS   3  -6.691   2.008  -0.772
   38    HA   CYS   3           HA       CYS   3  -4.677   0.689  -2.445
   39    HB2  CYS   3          1HB       CYS   3  -4.594   1.171   0.535
   40    HB3  CYS   3          2HB       CYS   3  -3.381   0.297  -0.406
   41    HG   CYS   3           HG       CYS   3  -2.420   2.634   0.330
   42    H    ASN   4           H        ASN   4  -4.416  -1.654  -2.022
   43    HA   ASN   4           HA       ASN   4  -6.987  -2.785  -1.638
   44    HB2  ASN   4          1HB       ASN   4  -4.363  -4.278  -2.371
   45    HB3  ASN   4          2HB       ASN   4  -6.046  -4.753  -2.031
   46   HD21  ASN   4          1HD2      ASN   4  -5.113  -3.883  -5.703
   47   HD22  ASN   4          2HD2      ASN   4  -4.089  -4.520  -4.460
   48    H    LYS   5           H        LYS   5  -7.502  -4.449   0.002
   49    HA   LYS   5           HA       LYS   5  -5.564  -4.695   2.172
   50    HB2  LYS   5          1HB       LYS   5  -8.493  -3.967   2.457
   51    HB3  LYS   5          2HB       LYS   5  -7.410  -4.407   3.798
   52    HG2  LYS   5          1HG       LYS   5  -6.943  -2.035   1.967
   53    HG3  LYS   5          2HG       LYS   5  -7.826  -1.928   3.508
   54    HD2  LYS   5          1HD       LYS   5  -5.859  -2.739   4.717
   55    HD3  LYS   5          2HD       LYS   5  -4.973  -2.917   3.184
   56    HE2  LYS   5          1HE       LYS   5  -4.866  -0.595   2.836
   57    HE3  LYS   5          2HE       LYS   5  -6.151  -0.269   4.022
   58    HZ1  LYS   5          1HZ       LYS   5  -3.982   0.289   4.887
   59    HZ2  LYS   5          2HZ       LYS   5  -4.635  -0.952   5.756
   60    HZ3  LYS   5          3HZ       LYS   5  -3.443  -1.253   4.655
   61    H    LEU   6           H        LEU   6  -9.029  -5.648   2.009
   62    HA   LEU   6           HA       LEU   6  -8.193  -8.392   2.383
   63    HB2  LEU   6          1HB       LEU   6  -9.856  -7.466   3.701
   64    HB3  LEU   6          2HB       LEU   6 -10.945  -7.018   2.368
   65    HG   LEU   6           HG       LEU   6 -11.048  -9.499   1.796
   66   HD11  LEU   6          1HD1      LEU   6 -10.514 -11.068   3.681
   67   HD12  LEU   6          2HD1      LEU   6  -9.061 -10.199   3.132
   68   HD13  LEU   6          3HD1      LEU   6  -9.890  -9.696   4.626
   69   HD21  LEU   6          1HD2      LEU   6 -12.752  -9.976   3.521
   70   HD22  LEU   6          2HD2      LEU   6 -12.170  -8.577   4.457
   71   HD23  LEU   6          3HD2      LEU   6 -12.894  -8.334   2.850
   72    H    VAL   7           H        VAL   7  -8.398 -10.044   0.893
   73    HA   VAL   7           HA       VAL   7  -8.583  -9.330  -1.825
   74    HB   VAL   7           HB       VAL   7  -8.604 -11.800  -2.212
   75   HG11  VAL   7          1HG1      VAL   7  -6.440 -12.304  -1.126
   76   HG12  VAL   7          2HG1      VAL   7  -6.454 -10.653  -1.791
   77   HG13  VAL   7          3HG1      VAL   7  -6.659 -10.910  -0.042
   78   HG21  VAL   7          1HG2      VAL   7  -8.527 -13.340  -0.318
   79   HG22  VAL   7          2HG2      VAL   7  -8.821 -11.984   0.796
   80   HG23  VAL   7          3HG2      VAL   7 -10.064 -12.447  -0.391
   81    HA   PRO   8           HA       PRO   8  -9.042 -10.452  -3.439
   82    HB2  PRO   8          1HB       PRO   8 -10.145 -10.181  -5.881
   83    HB3  PRO   8          2HB       PRO   8 -10.404 -11.682  -4.982
   84    HG2  PRO   8          1HG       PRO   8 -12.219  -9.266  -5.226
   85    HG3  PRO   8          2HG       PRO   8 -12.635 -10.983  -5.297
   86    HD2  PRO   8          1HD       PRO   8 -12.921  -9.440  -2.994
   87    HD3  PRO   8          2HD       PRO   8 -12.693 -11.193  -2.957
   88    H    ILE   9           H        ILE   9 -11.387  -7.856  -3.642
   89    HA   ILE   9           HA       ILE   9  -9.243  -6.221  -4.811
   90    HB   ILE   9           HB       ILE   9 -12.208  -6.196  -5.384
   91   HG12  ILE   9          1HG1      ILE   9 -11.069  -8.072  -6.414
   92   HG13  ILE   9          2HG1      ILE   9 -11.544  -6.886  -7.643
   93   HG21  ILE   9          1HG2      ILE   9 -10.028  -4.447  -6.554
   94   HG22  ILE   9          2HG2      ILE   9 -11.754  -4.438  -6.987
   95   HG23  ILE   9          3HG2      ILE   9 -11.242  -3.928  -5.361
   96   HD11  ILE   9          1HD1      ILE   9  -9.275  -6.061  -7.818
   97   HD12  ILE   9          2HD1      ILE   9  -8.770  -6.984  -6.383
   98   HD13  ILE   9          3HD1      ILE   9  -9.190  -7.838  -7.887
   99    H    ALA  10           H        ALA  10 -11.340  -6.755  -2.149
  100    HA   ALA  10           HA       ALA  10 -12.434  -4.379  -1.528
  101    HB1  ALA  10          1HB       ALA  10 -12.890  -5.452   0.401
  102    HB2  ALA  10          2HB       ALA  10 -11.949  -6.812  -0.255
  103    HB3  ALA  10          3HB       ALA  10 -11.165  -5.617   0.808
  104    H    TYR  11           H        TYR  11 -11.808  -2.379  -0.709
  105    HA   TYR  11           HA       TYR  11  -8.927  -1.990  -0.351
  106    HB2  TYR  11          1HB       TYR  11  -9.041  -0.018  -1.811
  107    HB3  TYR  11          2HB       TYR  11  -9.285  -1.563  -2.662
  108    HD1  TYR  11          1HD       TYR  11 -10.898   1.563  -1.552
  109    HD2  TYR  11          2HD       TYR  11 -11.433  -2.103  -3.665
  110    HE1  TYR  11          1HE       TYR  11 -13.021   2.425  -2.493
  111    HE2  TYR  11          2HE       TYR  11 -13.554  -1.258  -4.614
  112    HH   TYR  11           HH       TYR  11 -15.022   0.480  -4.715
  113    H    LYS  12           H        LYS  12  -8.402   0.135   0.644
  114    HA   LYS  12           HA       LYS  12 -10.722   1.289   2.026
  115    HB2  LYS  12          1HB       LYS  12  -7.945   0.626   3.011
  116    HB3  LYS  12          2HB       LYS  12  -8.947   1.864   3.805
  117    HG2  LYS  12          1HG       LYS  12 -10.698   0.145   4.202
  118    HG3  LYS  12          2HG       LYS  12  -9.622  -1.080   3.488
  119    HD2  LYS  12          1HD       LYS  12  -7.955  -0.665   5.230
  120    HD3  LYS  12          2HD       LYS  12  -8.977   0.616   5.924
  121    HE2  LYS  12          1HE       LYS  12 -10.752  -1.068   6.337
  122    HE3  LYS  12          2HE       LYS  12  -9.663  -2.333   5.723
  123    HZ1  LYS  12          1HZ       LYS  12  -9.621  -2.211   8.120
  124    HZ2  LYS  12          2HZ       LYS  12  -8.145  -1.801   7.508
  125    HZ3  LYS  12          3HZ       LYS  12  -9.156  -0.629   8.077
  126    H    THR  13           H        THR  13 -10.432   3.613   2.611
  127    HA   THR  13           HA       THR  13  -9.327   4.878   0.240
  128    HB   THR  13           HB       THR  13 -11.032   5.967   2.536
  129    HG1  THR  13          1HG       THR  13 -12.694   5.853   0.912
  130   HG21  THR  13          1HG2      THR  13 -11.427   7.884   1.030
  131   HG22  THR  13          2HG2      THR  13  -9.697   7.718   1.414
  132   HG23  THR  13          3HG2      THR  13 -10.314   7.176  -0.164
  133    H    CYS  14           H        CYS  14  -7.491   6.014   0.140
  134    HA   CYS  14           HA       CYS  14  -5.809   6.036   2.398
  135    HB2  CYS  14          1HB       CYS  14  -5.595   7.366  -0.301
  136    HB3  CYS  14          2HB       CYS  14  -4.323   7.425   0.921
  137    HG   CYS  14           HG       CYS  14  -3.644   5.742  -0.985
  138    HA   PRO  15           HA       PRO  15  -7.079   9.889   4.034
  139    HB2  PRO  15          1HB       PRO  15  -5.114  10.449   5.800
  140    HB3  PRO  15          2HB       PRO  15  -6.203   9.092   6.111
  141    HG2  PRO  15          1HG       PRO  15  -3.441   9.069   4.851
  142    HG3  PRO  15          2HG       PRO  15  -4.104   7.996   6.090
  143    HD2  PRO  15          1HD       PRO  15  -4.023   7.287   3.422
  144    HD3  PRO  15          2HD       PRO  15  -5.277   6.685   4.513
  145    H    GLU  16           H        GLU  16  -6.816  12.172   3.977
  146    HA   GLU  16           HA       GLU  16  -5.512  13.051   1.735
  147    HB2  GLU  16          1HB       GLU  16  -7.267  14.279   2.916
  148    HB3  GLU  16          2HB       GLU  16  -6.178  14.525   4.303
  149    HG2  GLU  16          1HG       GLU  16  -4.695  15.972   2.831
  150    HG3  GLU  16          2HG       GLU  16  -5.835  15.575   1.525
  151    HE2  GLU  16           HE       GLU  16  -6.831  18.720   2.989
  152    H    GLY  17           H        GLY  17  -3.454  13.908   1.292
  153    HA2  GLY  17          1HA       GLY  17  -1.343  14.717   1.946
  154    HA3  GLY  17          2HA       GLY  17  -1.520  13.944   3.510
  155    H    LYS  18           H        LYS  18  -2.623  11.398   2.279
  156    HA   LYS  18           HA       LYS  18  -0.100  10.374   1.214
  157    HB2  LYS  18          1HB       LYS  18  -2.599   9.013   2.262
  158    HB3  LYS  18          2HB       LYS  18  -1.179   8.162   1.607
  159    HG2  LYS  18          1HG       LYS  18   0.198   9.243   3.419
  160    HG3  LYS  18          2HG       LYS  18  -1.318   9.852   4.123
  161    HD2  LYS  18          1HD       LYS  18  -2.112   7.659   4.574
  162    HD3  LYS  18          2HD       LYS  18  -0.861   6.916   3.549
  163    HE2  LYS  18          1HE       LYS  18   0.864   7.808   5.136
  164    HE3  LYS  18          2HE       LYS  18  -0.462   8.337   6.198
  165    HZ1  LYS  18          1HZ       LYS  18   0.408   6.197   6.857
  166    HZ2  LYS  18          2HZ       LYS  18  -1.158   6.043   6.361
  167    HZ3  LYS  18          3HZ       LYS  18   0.072   5.554   5.376
  168    H    ASN  19           H        ASN  19  -0.242   8.829  -0.662
  169    HA   ASN  19           HA       ASN  19  -2.379   9.545  -2.449
  170    HB2  ASN  19          1HB       ASN  19  -0.634  11.506  -2.722
  171    HB3  ASN  19          2HB       ASN  19   0.384  10.062  -2.944
  172   HD21  ASN  19          1HD2      ASN  19   0.014  10.216  -6.349
  173   HD22  ASN  19          2HD2      ASN  19   1.016  10.003  -4.952
  174    H    LEU  20           H        LEU  20   0.657   7.846  -1.611
  175    HA   LEU  20           HA       LEU  20   0.461   6.172  -3.981
  176    HB2  LEU  20          1HB       LEU  20   2.383   6.252  -1.740
  177    HB3  LEU  20          2HB       LEU  20   2.739   5.377  -3.247
  178    HG   LEU  20           HG       LEU  20   2.575   8.382  -2.821
  179   HD11  LEU  20          1HD1      LEU  20   4.934   8.315  -3.674
  180   HD12  LEU  20          2HD1      LEU  20   4.743   7.306  -2.221
  181   HD13  LEU  20          3HD1      LEU  20   4.811   6.547  -3.830
  182   HD21  LEU  20          1HD2      LEU  20   3.015   8.616  -5.241
  183   HD22  LEU  20          2HD2      LEU  20   2.850   6.852  -5.424
  184   HD23  LEU  20          3HD2      LEU  20   1.456   7.828  -4.900
  185    H    CYS  21           H        CYS  21   0.419   3.831  -3.839
  186    HA   CYS  21           HA       CYS  21  -0.512   2.890  -1.225
  187    HB2  CYS  21          1HB       CYS  21  -1.162   1.936  -4.006
  188    HB3  CYS  21          2HB       CYS  21  -1.493   0.971  -2.566
  189    HG   CYS  21           HG       CYS  21  -3.733   2.029  -3.459
  190    H    TYR  22           H        TYR  22   0.731   1.289  -0.236
  191    HA   TYR  22           HA       TYR  22   2.990   0.277  -1.827
  192    HB2  TYR  22          1HB       TYR  22   4.383   0.453   0.053
  193    HB3  TYR  22          2HB       TYR  22   3.548   2.015  -0.131
  194    HD1  TYR  22          1HD       TYR  22   3.813  -1.045   1.922
  195    HD2  TYR  22          2HD       TYR  22   1.969   2.782   1.538
  196    HE1  TYR  22          1HE       TYR  22   3.023  -1.198   4.266
  197    HE2  TYR  22          2HE       TYR  22   1.174   2.646   3.874
  198    HH   TYR  22           HH       TYR  22   1.876  -0.182   5.942
  199    H    LYS  23           H        LYS  23   3.814  -1.863  -1.193
  200    HA   LYS  23           HA       LYS  23   2.063  -3.295   0.670
  201    HB2  LYS  23          1HB       LYS  23   2.328  -5.309  -0.697
  202    HB3  LYS  23          2HB       LYS  23   1.484  -4.015  -1.579
  203    HG2  LYS  23          1HG       LYS  23   3.539  -3.489  -2.807
  204    HG3  LYS  23          2HG       LYS  23   4.413  -4.748  -1.903
  205    HD2  LYS  23          1HD       LYS  23   3.620  -5.391  -4.235
  206    HD3  LYS  23          2HD       LYS  23   3.159  -6.491  -2.914
  207    HE2  LYS  23          1HE       LYS  23   0.943  -5.486  -2.809
  208    HE3  LYS  23          2HE       LYS  23   1.394  -4.307  -4.062
  209    HZ1  LYS  23          1HZ       LYS  23   0.136  -6.139  -4.974
  210    HZ2  LYS  23          2HZ       LYS  23   1.665  -6.139  -5.594
  211    HZ3  LYS  23          3HZ       LYS  23   1.247  -7.231  -4.431
  212    H    MET  24           H        MET  24   3.142  -4.934   1.927
  213    HA   MET  24           HA       MET  24   6.025  -4.478   1.949
  214    HB2  MET  24          1HB       MET  24   4.091  -5.157   4.176
  215    HB3  MET  24          2HB       MET  24   5.860  -5.105   4.368
  216    HG2  MET  24          1HG       MET  24   5.798  -2.704   3.669
  217    HG3  MET  24          2HG       MET  24   4.020  -2.795   3.677
  218    HE1  MET  24          1HE       MET  24   3.112  -3.179   7.406
  219    HE2  MET  24          2HE       MET  24   2.540  -2.768   5.770
  220    HE3  MET  24          3HE       MET  24   3.155  -4.403   6.114
  221    H    PHE  25           H        PHE  25   7.397  -6.247   1.806
  222    HA   PHE  25           HA       PHE  25   6.112  -8.877   1.973
  223    HB2  PHE  25          1HB       PHE  25   8.710  -7.856   0.689
  224    HB3  PHE  25          2HB       PHE  25   8.193  -9.544   0.640
  225    HD1  PHE  25          1HD       PHE  25   6.560 -10.263  -0.919
  226    HD2  PHE  25          2HD       PHE  25   7.436  -6.135  -0.544
  227    HE1  PHE  25          1HE       PHE  25   5.277  -9.799  -3.039
  228    HE2  PHE  25          2HE       PHE  25   6.157  -5.666  -2.656
  229    HZ   PHE  25           HZ       PHE  25   5.095  -7.503  -3.876
  230    H    MET  26           H        MET  26   7.581 -10.662   2.877
  231    HA   MET  26           HA       MET  26   9.602  -9.520   4.650
  232    HB2  MET  26          1HB       MET  26   8.038 -12.107   4.830
  233    HB3  MET  26          2HB       MET  26   9.391 -11.676   5.905
  234    HG2  MET  26          1HG       MET  26   8.133  -9.736   6.722
  235    HG3  MET  26          2HG       MET  26   6.786 -10.142   5.632
  236    HE1  MET  26          1HE       MET  26   5.320 -10.990   9.192
  237    HE2  MET  26          2HE       MET  26   6.427  -9.657   8.778
  238    HE3  MET  26          3HE       MET  26   5.085 -10.073   7.685
  239    H    MET  27           H        MET  27  11.714 -10.480   4.667
  240    HA   MET  27           HA       MET  27  12.664 -10.978   2.203
  241    HB2  MET  27          1HB       MET  27  13.649 -11.737   4.947
  242    HB3  MET  27          2HB       MET  27  14.614 -12.086   3.492
  243    HG2  MET  27          1HG       MET  27  13.697  -9.348   4.427
  244    HG3  MET  27          2HG       MET  27  15.344 -10.007   4.572
  245    HE1  MET  27          1HE       MET  27  16.570 -10.158   0.883
  246    HE2  MET  27          2HE       MET  27  17.018 -10.292   2.602
  247    HE3  MET  27          3HE       MET  27  15.889 -11.465   1.881
  248    H    SER  28           H        SER  28  11.303 -13.325   4.526
  249    HA   SER  28           HA       SER  28  12.012 -15.627   3.172
  250    HB2  SER  28          1HB       SER  28  11.042 -15.628   5.398
  251    HB3  SER  28          2HB       SER  28   9.525 -14.941   4.770
  252    HG   SER  28           HG       SER  28   9.415 -17.209   5.076
  253    H    ASP  29           H        ASP  29   8.688 -14.139   3.160
  254    HA   ASP  29           HA       ASP  29   8.244 -15.457   0.654
  255    HB2  ASP  29          1HB       ASP  29   6.527 -15.504   2.566
  256    HB3  ASP  29          2HB       ASP  29   6.477 -13.747   2.280
  257    HD2  ASP  29           HD       ASP  29   3.772 -15.313   0.421
  258    H    LEU  30           H        LEU  30   9.682 -14.060  -0.683
  259    HA   LEU  30           HA       LEU  30   9.044 -11.275  -0.908
  260    HB2  LEU  30          1HB       LEU  30  10.793 -13.275  -2.053
  261    HB3  LEU  30          2HB       LEU  30  10.541 -11.905  -3.160
  262    HG   LEU  30           HG       LEU  30  11.913 -10.555  -1.985
  263   HD11  LEU  30          1HD1      LEU  30  11.885 -10.400   0.520
  264   HD12  LEU  30          2HD1      LEU  30  10.238 -10.337  -0.151
  265   HD13  LEU  30          3HD1      LEU  30  10.843 -11.841   0.582
  266   HD21  LEU  30          1HD2      LEU  30  13.659 -11.698  -0.662
  267   HD22  LEU  30          2HD2      LEU  30  12.650 -13.164  -0.629
  268   HD23  LEU  30          3HD2      LEU  30  13.279 -12.549  -2.177
  269    H    THR  31           H        THR  31   7.719 -14.256  -2.061
  270    HA   THR  31           HA       THR  31   6.998 -13.344  -4.666
  271    HB   THR  31           HB       THR  31   5.956 -15.667  -2.973
  272    HG1  THR  31          1HG       THR  31   7.420 -16.866  -4.326
  273   HG21  THR  31          1HG2      THR  31   5.176 -16.593  -5.125
  274   HG22  THR  31          2HG2      THR  31   4.397 -15.030  -4.781
  275   HG23  THR  31          3HG2      THR  31   5.727 -15.121  -5.959
  276    H    ILE  32           H        ILE  32   5.319 -13.580  -1.489
  277    HA   ILE  32           HA       ILE  32   3.129 -12.061  -2.724
  278    HB   ILE  32           HB       ILE  32   2.973 -14.386  -0.749
  279   HG12  ILE  32          1HG1      ILE  32   3.192 -15.024  -3.062
  280   HG13  ILE  32          2HG1      ILE  32   1.600 -15.446  -2.387
  281   HG21  ILE  32          1HG2      ILE  32   0.540 -13.962  -0.702
  282   HG22  ILE  32          2HG2      ILE  32   1.443 -12.570  -0.064
  283   HG23  ILE  32          3HG2      ILE  32   0.771 -12.514  -1.710
  284   HD11  ILE  32          1HD1      ILE  32   1.392 -14.587  -4.686
  285   HD12  ILE  32          2HD1      ILE  32   0.603 -13.499  -3.520
  286   HD13  ILE  32          3HD1      ILE  32   2.193 -13.078  -4.196
  287    HA   PRO  33           HA       PRO  33   4.085  -9.386   0.578
  288    HB2  PRO  33          1HB       PRO  33   2.233  -7.445   0.145
  289    HB3  PRO  33          2HB       PRO  33   3.646  -7.580  -0.912
  290    HG2  PRO  33          1HG       PRO  33   0.847  -8.689  -1.318
  291    HG3  PRO  33          2HG       PRO  33   1.882  -7.837  -2.471
  292    HD2  PRO  33          1HD       PRO  33   1.684 -10.575  -2.474
  293    HD3  PRO  33          2HD       PRO  33   3.186  -9.761  -2.929
  294    H    VAL  34           H        VAL  34   3.099  -8.404   2.567
  295    HA   VAL  34           HA       VAL  34   1.315 -10.552   3.482
  296    HB   VAL  34           HB       VAL  34   2.385 -10.287   5.688
  297   HG11  VAL  34          1HG1      VAL  34   4.657 -11.082   5.126
  298   HG12  VAL  34          2HG1      VAL  34   3.435 -11.843   4.080
  299   HG13  VAL  34          3HG1      VAL  34   4.442 -10.516   3.453
  300   HG21  VAL  34          1HG2      VAL  34   4.302  -8.806   6.008
  301   HG22  VAL  34          2HG2      VAL  34   4.074  -8.158   4.366
  302   HG23  VAL  34          3HG2      VAL  34   2.821  -7.905   5.606
  303    H    LYS  35           H        LYS  35   2.022  -7.060   3.414
  304    HA   LYS  35           HA       LYS  35  -0.707  -6.576   4.234
  305    HB2  LYS  35          1HB       LYS  35   1.735  -5.739   5.787
  306    HB3  LYS  35          2HB       LYS  35   0.279  -4.715   5.775
  307    HG2  LYS  35          1HG       LYS  35  -0.975  -6.856   6.514
  308    HG3  LYS  35          2HG       LYS  35   0.639  -7.493   6.909
  309    HD2  LYS  35          1HD       LYS  35  -0.098  -6.558   8.931
  310    HD3  LYS  35          2HD       LYS  35   0.960  -5.306   8.240
  311    HE2  LYS  35          1HE       LYS  35  -0.927  -4.046   7.449
  312    HE3  LYS  35          2HE       LYS  35  -2.048  -5.356   7.883
  313    HZ1  LYS  35          1HZ       LYS  35  -2.070  -3.591   9.511
  314    HZ2  LYS  35          2HZ       LYS  35  -1.493  -4.979  10.191
  315    HZ3  LYS  35          3HZ       LYS  35  -0.452  -3.763   9.788
  316    H    ARG  36           H        ARG  36  -1.485  -4.522   3.510
  317    HA   ARG  36           HA       ARG  36   0.505  -2.932   2.122
  318    HB2  ARG  36          1HB       ARG  36  -2.286  -3.571   1.057
  319    HB3  ARG  36          2HB       ARG  36  -1.094  -2.531   0.255
  320    HG2  ARG  36          1HG       ARG  36  -0.717  -4.525  -0.858
  321    HG3  ARG  36          2HG       ARG  36   0.437  -4.716   0.474
  322    HD2  ARG  36          1HD       ARG  36  -0.753  -6.776   0.376
  323    HD3  ARG  36          2HD       ARG  36  -1.485  -5.912   1.736
  324    HE   ARG  36           HE       ARG  36  -2.909  -5.267  -0.663
  325   HH11  ARG  36          1HH1      ARG  36  -5.386  -7.687  -0.318
  326   HH12  ARG  36          2HH1      ARG  36  -4.908  -6.200  -1.108
  327   HH21  ARG  36          1HH2      ARG  36  -3.959  -8.709   1.201
  328   HH22  ARG  36          2HH2      ARG  36  -2.420  -7.994   1.545
  329    H    GLY  37           H        GLY  37  -0.573  -0.654   1.536
  330    HA2  GLY  37          1HA       GLY  37  -2.812   0.274   2.927
  331    HA3  GLY  37          2HA       GLY  37  -1.411   0.530   3.949
  332    H    CYS  38           H        CYS  38  -2.122   2.877   3.545
  333    HA   CYS  38           HA       CYS  38  -1.235   3.800   0.921
  334    HB2  CYS  38          1HB       CYS  38  -2.843   4.972   3.311
  335    HB3  CYS  38          2HB       CYS  38  -2.606   5.849   1.779
  336    HG   CYS  38           HG       CYS  38  -5.057   5.081   1.994
  337    H    ILE  39           H        ILE  39   0.344   5.565   0.821
  338    HA   ILE  39           HA       ILE  39   1.167   6.777   3.277
  339    HB   ILE  39           HB       ILE  39   2.632   4.687   3.123
  340   HG12  ILE  39          1HG1      ILE  39   4.285   7.154   2.801
  341   HG13  ILE  39          2HG1      ILE  39   3.178   6.959   4.179
  342   HG21  ILE  39          1HG2      ILE  39   4.438   4.721   1.435
  343   HG22  ILE  39          2HG2      ILE  39   2.839   4.633   0.660
  344   HG23  ILE  39          3HG2      ILE  39   3.724   6.175   0.699
  345   HD11  ILE  39          1HD1      ILE  39   5.466   6.263   4.770
  346   HD12  ILE  39          2HD1      ILE  39   4.341   4.884   4.821
  347   HD13  ILE  39          3HD1      ILE  39   5.449   5.080   3.443
  348    H    ASP  40           H        ASP  40   2.729   8.612   2.817
  349    HA   ASP  40           HA       ASP  40   1.894   9.791   0.339
  350    HB2  ASP  40          1HB       ASP  40   2.936  11.902   1.344
  351    HB3  ASP  40          2HB       ASP  40   1.644  11.023   2.199
  352    HD2  ASP  40           HD       ASP  40   4.470  11.855   4.440
  353    H    VAL  41           H        VAL  41   4.926   8.970   2.171
  354    HA   VAL  41           HA       VAL  41   6.408   9.252  -0.352
  355    HB   VAL  41           HB       VAL  41   7.389   9.545   2.527
  356   HG11  VAL  41          1HG1      VAL  41   9.533  10.209   1.490
  357   HG12  VAL  41          2HG1      VAL  41   9.092   8.545   1.039
  358   HG13  VAL  41          3HG1      VAL  41   8.859   9.873  -0.122
  359   HG21  VAL  41          1HG2      VAL  41   7.782  11.885   1.943
  360   HG22  VAL  41          2HG2      VAL  41   7.044  11.609   0.347
  361   HG23  VAL  41          3HG2      VAL  41   6.062  11.445   1.823
  362    H    CYS  42           H        CYS  42   7.490   7.473  -1.123
  363    HA   CYS  42           HA       CYS  42   6.644   5.017  -0.035
  364    HB2  CYS  42          1HB       CYS  42   6.945   5.413  -2.431
  365    HB3  CYS  42          2HB       CYS  42   8.688   5.581  -2.195
  366    HG   CYS  42           HG       CYS  42   8.170   3.287  -3.376
  367    HA   PRO  43           HA       PRO  43   9.991   4.710   2.775
  368    HB2  PRO  43          1HB       PRO  43   9.362   2.343   3.972
  369    HB3  PRO  43          2HB       PRO  43   8.451   3.812   4.348
  370    HG2  PRO  43          1HG       PRO  43   7.787   1.607   2.373
  371    HG3  PRO  43          2HG       PRO  43   6.723   2.428   3.524
  372    HD2  PRO  43          1HD       PRO  43   6.791   3.133   0.868
  373    HD3  PRO  43          2HD       PRO  43   6.458   4.324   2.131
  374    H    LYS  44           H        LYS  44  12.081   4.003   2.817
  375    HA   LYS  44           HA       LYS  44  12.831   2.520   0.525
  376    HB2  LYS  44          1HB       LYS  44  14.310   3.341   3.040
  377    HB3  LYS  44          2HB       LYS  44  15.081   2.562   1.637
  378    HG2  LYS  44          1HG       LYS  44  14.451   4.472   0.223
  379    HG3  LYS  44          2HG       LYS  44  13.665   5.250   1.618
  380    HD2  LYS  44          1HD       LYS  44  15.806   5.366   2.793
  381    HD3  LYS  44          2HD       LYS  44  16.609   4.527   1.445
  382    HE2  LYS  44          1HE       LYS  44  16.028   6.378  -0.060
  383    HE3  LYS  44          2HE       LYS  44  15.216   7.218   1.281
  384    HZ1  LYS  44          1HZ       LYS  44  17.440   8.051   0.925
  385    HZ2  LYS  44          2HZ       LYS  44  17.337   7.331   2.406
  386    HZ3  LYS  44          3HZ       LYS  44  18.089   6.552   1.161
  387    H    ASN  45           H        ASN  45  14.164   0.476   0.631
  388    HA   ASN  45           HA       ASN  45  12.507  -1.410   1.889
  389    HB2  ASN  45          1HB       ASN  45  15.085  -1.993   0.262
  390    HB3  ASN  45          2HB       ASN  45  13.868  -2.967   1.124
  391   HD21  ASN  45          1HD2      ASN  45  13.166  -2.331  -2.591
  392   HD22  ASN  45          2HD2      ASN  45  14.665  -2.611  -1.769
  393    H    SER  46           H        SER  46  13.047  -2.839   3.666
  394    HA   SER  46           HA       SER  46  15.408  -1.986   5.143
  395    HB2  SER  46          1HB       SER  46  14.263  -2.791   7.138
  396    HB3  SER  46          2HB       SER  46  13.223  -1.653   6.251
  397    HG   SER  46           HG       SER  46  12.115  -3.450   5.406
  398    H    LEU  47           H        LEU  47  16.048  -4.014   6.764
  399    HA   LEU  47           HA       LEU  47  17.034  -5.938   4.896
  400    HB2  LEU  47          1HB       LEU  47  17.137  -5.599   7.827
  401    HB3  LEU  47          2HB       LEU  47  18.120  -6.873   7.067
  402    HG   LEU  47           HG       LEU  47  18.401  -3.871   6.651
  403   HD11  LEU  47          1HD1      LEU  47  20.630  -4.198   7.754
  404   HD12  LEU  47          2HD1      LEU  47  19.298  -4.676   8.832
  405   HD13  LEU  47          3HD1      LEU  47  20.246  -5.920   7.983
  406   HD21  LEU  47          1HD2      LEU  47  20.377  -4.441   5.283
  407   HD22  LEU  47          2HD2      LEU  47  19.983  -6.168   5.464
  408   HD23  LEU  47          3HD2      LEU  47  18.864  -5.084   4.603
  409    H    LEU  48           H        LEU  48  14.293  -5.651   7.055
  410    HA   LEU  48           HA       LEU  48  14.041  -8.552   7.227
  411    HB2  LEU  48          1HB       LEU  48  12.664  -6.248   8.461
  412    HB3  LEU  48          2HB       LEU  48  12.180  -7.901   8.909
  413    HG   LEU  48           HG       LEU  48  14.867  -6.572   9.437
  414   HD11  LEU  48          1HD1      LEU  48  14.224  -6.869  11.842
  415   HD12  LEU  48          2HD1      LEU  48  13.042  -5.859  10.978
  416   HD13  LEU  48          3HD1      LEU  48  12.671  -7.564  11.326
  417   HD21  LEU  48          1HD2      LEU  48  15.464  -8.656  10.620
  418   HD22  LEU  48          2HD2      LEU  48  13.934  -9.385  10.073
  419   HD23  LEU  48          3HD2      LEU  48  15.171  -8.913   8.884
  420    H    VAL  49           H        VAL  49  12.246  -5.584   6.199
  421    HA   VAL  49           HA       VAL  49  10.494  -7.365   4.655
  422    HB   VAL  49           HB       VAL  49   8.679  -5.659   5.056
  423   HG11  VAL  49          1HG1      VAL  49   8.183  -6.348   7.378
  424   HG12  VAL  49          2HG1      VAL  49   8.785  -7.720   6.417
  425   HG13  VAL  49          3HG1      VAL  49   9.863  -6.901   7.573
  426   HG21  VAL  49          1HG2      VAL  49   8.932  -4.052   6.879
  427   HG22  VAL  49          2HG2      VAL  49  10.638  -4.523   7.056
  428   HG23  VAL  49          3HG2      VAL  49  10.080  -3.746   5.554
  429    H    LYS  50           H        LYS  50   9.818  -6.568   2.598
  430    HA   LYS  50           HA       LYS  50  11.499  -4.357   1.660
  431    HB2  LYS  50          1HB       LYS  50  11.856  -6.493   0.539
  432    HB3  LYS  50          2HB       LYS  50  10.112  -6.633   0.210
  433    HG2  LYS  50          1HG       LYS  50  10.241  -4.632  -1.239
  434    HG3  LYS  50          2HG       LYS  50  11.992  -4.539  -0.936
  435    HD2  LYS  50          1HD       LYS  50  12.298  -6.753  -1.949
  436    HD3  LYS  50          2HD       LYS  50  10.544  -6.878  -2.225
  437    HE2  LYS  50          1HE       LYS  50  10.652  -4.869  -3.667
  438    HE3  LYS  50          2HE       LYS  50  12.414  -4.814  -3.430
  439    HZ1  LYS  50          1HZ       LYS  50  11.827  -5.899  -5.490
  440    HZ2  LYS  50          2HZ       LYS  50  12.556  -6.973  -4.472
  441    HZ3  LYS  50          3HZ       LYS  50  10.923  -7.024  -4.692
  442    H    TYR  51           H        TYR  51  10.576  -2.655   0.427
  443    HA   TYR  51           HA       TYR  51   7.658  -2.478   0.766
  444    HB2  TYR  51          1HB       TYR  51   9.795  -0.351   0.860
  445    HB3  TYR  51          2HB       TYR  51   8.043  -0.033   0.847
  446    HD1  TYR  51          1HD       TYR  51  10.883  -1.216   2.852
  447    HD2  TYR  51          2HD       TYR  51   6.669  -0.571   2.806
  448    HE1  TYR  51          1HE       TYR  51  10.827  -1.460   5.317
  449    HE2  TYR  51          2HE       TYR  51   6.595  -0.811   5.266
  450    HH   TYR  51           HH       TYR  51   7.791  -1.186   7.168
  451    H    VAL  52           H        VAL  52   6.485  -2.359  -1.087
  452    HA   VAL  52           HA       VAL  52   7.796  -1.047  -3.366
  453    HB   VAL  52           HB       VAL  52   5.798  -3.359  -3.452
  454   HG11  VAL  52          1HG1      VAL  52   6.195  -3.292  -5.891
  455   HG12  VAL  52          2HG1      VAL  52   5.516  -1.753  -5.311
  456   HG13  VAL  52          3HG1      VAL  52   7.253  -1.877  -5.682
  457   HG21  VAL  52          1HG2      VAL  52   7.627  -4.659  -4.419
  458   HG22  VAL  52          2HG2      VAL  52   8.736  -3.292  -4.155
  459   HG23  VAL  52          3HG2      VAL  52   7.994  -4.118  -2.764
  460    H    CYS  53           H        CYS  53   6.709   0.696  -4.165
  461    HA   CYS  53           HA       CYS  53   3.986   1.058  -3.139
  462    HB2  CYS  53          1HB       CYS  53   5.879   3.298  -3.815
  463    HB3  CYS  53          2HB       CYS  53   4.350   3.383  -2.936
  464    HG   CYS  53           HG       CYS  53   6.344   3.926  -1.305
  465    H    CYS  54           H        CYS  54   2.592   2.418  -4.647
  466    HA   CYS  54           HA       CYS  54   3.614   2.888  -7.270
  467    HB2  CYS  54          1HB       CYS  54   1.661   1.595  -8.316
  468    HB3  CYS  54          2HB       CYS  54   3.115   0.712  -7.841
  469    HG   CYS  54           HG       CYS  54   0.990  -0.778  -7.407
  470    H    ASN  55           H        ASN  55   1.987   4.237  -8.525
  471    HA   ASN  55           HA       ASN  55   0.834   5.866  -6.417
  472    HB2  ASN  55          1HB       ASN  55   1.510   7.875  -7.824
  473    HB3  ASN  55          2HB       ASN  55   2.646   6.548  -7.480
  474   HD21  ASN  55          1HD2      ASN  55   2.901   7.710 -11.033
  475   HD22  ASN  55          2HD2      ASN  55   2.904   8.525  -9.503
  476    H    THR  56           H        THR  56  -0.616   3.632  -7.742
  477    HA   THR  56           HA       THR  56  -2.816   5.224  -8.853
  478    HB   THR  56           HB       THR  56  -3.276   3.355 -10.458
  479    HG1  THR  56          1HG       THR  56  -1.547   1.832 -10.787
  480   HG21  THR  56          1HG2      THR  56  -1.462   3.865 -12.055
  481   HG22  THR  56          2HG2      THR  56  -2.020   5.339 -11.228
  482   HG23  THR  56          3HG2      THR  56  -0.496   4.565 -10.736
  483    H    ASP  57           H        ASP  57  -4.857   3.656  -9.020
  484    HA   ASP  57           HA       ASP  57  -5.259   3.226  -6.252
  485    HB2  ASP  57          1HB       ASP  57  -7.163   3.025  -8.652
  486    HB3  ASP  57          2HB       ASP  57  -7.497   2.637  -6.946
  487    HD2  ASP  57           HD       ASP  57  -7.585   6.363  -8.029
  488    H    ARG  58           H        ARG  58  -5.488   1.198  -5.188
  489    HA   ARG  58           HA       ARG  58  -5.469  -0.939  -4.858
  490    HB2  ARG  58          1HB       ARG  58  -6.999  -1.019  -7.499
  491    HB3  ARG  58          2HB       ARG  58  -6.947  -2.351  -6.331
  492    HG2  ARG  58          1HG       ARG  58  -8.218  -1.168  -4.746
  493    HG3  ARG  58          2HG       ARG  58  -7.833   0.411  -5.455
  494    HD2  ARG  58          1HD       ARG  58  -9.113  -0.789  -7.557
  495    HD3  ARG  58          2HD       ARG  58  -9.945  -1.567  -6.201
  496    HE   ARG  58           HE       ARG  58  -9.779   1.243  -5.696
  497   HH11  ARG  58          1HH1      ARG  58 -12.875   2.088  -7.039
  498   HH12  ARG  58          2HH1      ARG  58 -11.556   2.588  -6.003
  499   HH21  ARG  58          1HH2      ARG  58 -12.801   0.029  -8.109
  500   HH22  ARG  58          2HH2      ARG  58 -11.435  -1.007  -7.875
  501    H    CYS  59           H        CYS  59  -3.173   0.170  -6.342
  502    HA   CYS  59           HA       CYS  59  -2.655  -1.623  -8.517
  503    HB2  CYS  59          1HB       CYS  59  -0.622  -0.049  -8.610
  504    HB3  CYS  59          2HB       CYS  59  -2.092   0.910  -8.306
  505    HG   CYS  59           HG       CYS  59  -0.093   1.917  -7.029
  506    H    ASN  60           H        ASN  60  -1.963  -1.273  -5.065
  507    HA   ASN  60           HA       ASN  60   0.101  -3.276  -5.205
  508    HB2  ASN  60          1HB       ASN  60   0.287  -2.893  -2.754
  509    HB3  ASN  60          2HB       ASN  60   0.357  -1.356  -3.630
  510   HD21  ASN  60          1HD2      ASN  60  -0.176  -0.867  -1.238
  511   HD22  ASN  60          2HD2      ASN  60  -1.851  -0.638  -0.862
  Start of MODEL   15
    1    H1   MET   0          1H        MET   0 -10.276  10.571   0.046
    2    H2   MET   0          2H        MET   0 -10.672  11.367  -1.161
    3    H    MET   0           H        MET   0 -10.825   9.853  -1.175
    4    H3   MET   0          3H        MET   0 -10.839   9.876  -1.158
    5    HA   MET   0           HA       MET   0  -8.624  11.286  -2.097
    6    HB2  MET   0          1HB       MET   0  -8.023   9.494   0.270
    7    HB3  MET   0          2HB       MET   0  -6.794  10.205  -0.804
    8    HG2  MET   0          1HG       MET   0  -8.742  11.779   0.908
    9    HG3  MET   0          2HG       MET   0  -7.054  11.428   1.348
   10    HE1  MET   0          1HE       MET   0  -5.021  13.448  -1.293
   11    HE2  MET   0          2HE       MET   0  -4.960  12.489   0.206
   12    HE3  MET   0          3HE       MET   0  -5.460  11.723  -1.322
   13    H    LEU   1           H        LEU   1  -6.634   9.179  -2.234
   14    HA   LEU   1           HA       LEU   1  -7.877   7.670  -4.311
   15    HB2  LEU   1          1HB       LEU   1  -5.239   7.596  -2.982
   16    HB3  LEU   1          2HB       LEU   1  -5.501   6.674  -4.480
   17    HG   LEU   1           HG       LEU   1  -5.595   9.702  -4.185
   18   HD11  LEU   1          1HD1      LEU   1  -3.548   9.646  -5.634
   19   HD12  LEU   1          2HD1      LEU   1  -3.285   8.768  -4.110
   20   HD13  LEU   1          3HD1      LEU   1  -3.599   7.869  -5.613
   21   HD21  LEU   1          1HD2      LEU   1  -5.828   9.730  -6.644
   22   HD22  LEU   1          2HD2      LEU   1  -5.928   7.952  -6.638
   23   HD23  LEU   1          3HD2      LEU   1  -7.189   8.918  -5.835
   24    H    LYS   2           H        LYS   2  -6.997   5.158  -4.318
   25    HA   LYS   2           HA       LYS   2  -7.874   4.059  -1.740
   26    HB2  LYS   2          1HB       LYS   2  -8.557   2.996  -4.494
   27    HB3  LYS   2          2HB       LYS   2  -9.113   2.358  -2.930
   28    HG2  LYS   2          1HG       LYS   2  -9.813   5.094  -4.046
   29    HG3  LYS   2          2HG       LYS   2 -10.861   3.659  -4.138
   30    HD2  LYS   2          1HD       LYS   2 -10.830   3.525  -1.653
   31    HD3  LYS   2          2HD       LYS   2  -9.879   5.028  -1.612
   32    HE2  LYS   2          1HE       LYS   2 -12.671   4.691  -2.751
   33    HE3  LYS   2          2HE       LYS   2 -12.249   5.486  -1.217
   34    HZ1  LYS   2          1HZ       LYS   2 -12.591   7.081  -2.979
   35    HZ2  LYS   2          2HZ       LYS   2 -11.021   7.122  -2.474
   36    HZ3  LYS   2          3HZ       LYS   2 -11.412   6.385  -3.898
   37    H    CYS   3           H        CYS   3  -6.701   2.301  -0.984
   38    HA   CYS   3           HA       CYS   3  -4.830   1.128  -2.909
   39    HB2  CYS   3          1HB       CYS   3  -4.370   1.588   0.041
   40    HB3  CYS   3          2HB       CYS   3  -3.294   0.687  -1.030
   41    HG   CYS   3           HG       CYS   3  -2.216   3.017  -0.446
   42    H    ASN   4           H        ASN   4  -4.331  -1.225  -2.344
   43    HA   ASN   4           HA       ASN   4  -6.784  -2.495  -1.679
   44    HB2  ASN   4          1HB       ASN   4  -4.120  -3.803  -2.594
   45    HB3  ASN   4          2HB       ASN   4  -5.661  -4.431  -1.962
   46   HD21  ASN   4          1HD2      ASN   4  -5.517  -4.160  -5.751
   47   HD22  ASN   4          2HD2      ASN   4  -4.343  -4.694  -4.594
   48    H    LYS   5           H        LYS   5  -6.856  -4.300   0.010
   49    HA   LYS   5           HA       LYS   5  -4.824  -4.028   2.086
   50    HB2  LYS   5          1HB       LYS   5  -6.657  -2.507   2.684
   51    HB3  LYS   5          2HB       LYS   5  -7.824  -3.835   2.493
   52    HG2  LYS   5          1HG       LYS   5  -6.741  -5.039   4.362
   53    HG3  LYS   5          2HG       LYS   5  -5.609  -3.681   4.565
   54    HD2  LYS   5          1HD       LYS   5  -7.340  -3.410   6.200
   55    HD3  LYS   5          2HD       LYS   5  -7.601  -2.185   4.935
   56    HE2  LYS   5          1HE       LYS   5  -9.342  -3.520   3.922
   57    HE3  LYS   5          2HE       LYS   5  -9.012  -4.867   5.035
   58    HZ1  LYS   5          1HZ       LYS   5 -10.925  -3.592   5.726
   59    HZ2  LYS   5          2HZ       LYS   5  -9.722  -3.459   6.847
   60    HZ3  LYS   5          3HZ       LYS   5 -10.028  -2.209   5.815
   61    H    LEU   6           H        LEU   6  -8.057  -5.618   2.118
   62    HA   LEU   6           HA       LEU   6  -6.635  -8.123   2.584
   63    HB2  LEU   6          1HB       LEU   6  -8.151  -7.386   4.177
   64    HB3  LEU   6          2HB       LEU   6  -9.548  -7.268   3.081
   65    HG   LEU   6           HG       LEU   6  -9.263  -9.771   2.675
   66   HD11  LEU   6          1HD1      LEU   6  -8.082 -11.032   4.494
   67   HD12  LEU   6          2HD1      LEU   6  -6.961  -9.967   3.613
   68   HD13  LEU   6          3HD1      LEU   6  -7.573  -9.487   5.213
   69   HD21  LEU   6          1HD2      LEU   6 -10.481 -10.387   4.735
   70   HD22  LEU   6          2HD2      LEU   6 -10.019  -8.825   5.454
   71   HD23  LEU   6          3HD2      LEU   6 -11.069  -8.868   4.018
   72    H    VAL   7           H        VAL   7  -6.802  -9.891   1.231
   73    HA   VAL   7           HA       VAL   7  -7.666  -9.488  -1.405
   74    HB   VAL   7           HB       VAL   7  -7.386 -11.963  -1.618
   75   HG11  VAL   7          1HG1      VAL   7  -4.997 -12.059  -0.990
   76   HG12  VAL   7          2HG1      VAL   7  -5.399 -10.497  -1.743
   77   HG13  VAL   7          3HG1      VAL   7  -5.205 -10.611   0.023
   78   HG21  VAL   7          1HG2      VAL   7  -6.692 -13.289   0.313
   79   HG22  VAL   7          2HG2      VAL   7  -6.960 -11.884   1.373
   80   HG23  VAL   7          3HG2      VAL   7  -8.331 -12.626   0.512
   81    HA   PRO   8           HA       PRO   8  -8.267 -10.813  -2.813
   82    HB2  PRO   8          1HB       PRO   8  -9.869 -10.896  -4.976
   83    HB3  PRO   8          2HB       PRO   8  -9.717 -12.335  -3.959
   84    HG2  PRO   8          1HG       PRO   8 -11.878 -10.208  -3.947
   85    HG3  PRO   8          2HG       PRO   8 -12.044 -11.964  -3.829
   86    HD2  PRO   8          1HD       PRO   8 -12.079 -10.280  -1.611
   87    HD3  PRO   8          2HD       PRO   8 -11.588 -11.977  -1.522
   88    H    ILE   9           H        ILE   9 -10.944  -8.556  -2.657
   89    HA   ILE   9           HA       ILE   9  -9.346  -6.783  -4.374
   90    HB   ILE   9           HB       ILE   9 -12.338  -7.199  -4.295
   91   HG12  ILE   9          1HG1      ILE   9 -11.169  -9.000  -5.418
   92   HG13  ILE   9          2HG1      ILE   9 -12.055  -8.011  -6.591
   93   HG21  ILE   9          1HG2      ILE   9 -12.518  -5.540  -6.019
   94   HG22  ILE   9          2HG2      ILE   9 -11.668  -4.821  -4.630
   95   HG23  ILE   9          3HG2      ILE   9 -10.753  -5.328  -6.070
   96   HD11  ILE   9          1HD1      ILE   9 -10.019  -6.917  -7.311
   97   HD12  ILE   9          2HD1      ILE   9  -9.099  -7.621  -5.960
   98   HD13  ILE   9          3HD1      ILE   9  -9.686  -8.665  -7.274
   99    H    ALA  10           H        ALA  10 -10.806  -7.317  -1.303
  100    HA   ALA  10           HA       ALA  10 -11.991  -4.988  -0.629
  101    HB1  ALA  10          1HB       ALA  10 -11.974  -5.931   1.426
  102    HB2  ALA  10          2HB       ALA  10 -11.105  -7.284   0.663
  103    HB3  ALA  10          3HB       ALA  10 -10.196  -5.987   1.476
  104    H    TYR  11           H        TYR  11 -11.398  -2.890  -0.109
  105    HA   TYR  11           HA       TYR  11  -8.531  -2.294  -0.306
  106    HB2  TYR  11          1HB       TYR  11  -9.008  -0.444  -1.776
  107    HB3  TYR  11          2HB       TYR  11  -9.509  -1.993  -2.498
  108    HD1  TYR  11          1HD       TYR  11 -10.635   1.258  -1.250
  109    HD2  TYR  11          2HD       TYR  11 -11.911  -2.536  -2.717
  110    HE1  TYR  11          1HE       TYR  11 -12.907   2.175  -1.622
  111    HE2  TYR  11          2HE       TYR  11 -14.183  -1.639  -3.095
  112    HH   TYR  11           HH       TYR  11 -15.019   1.751  -2.341
  113    H    LYS  12           H        LYS  12  -8.081   0.051   0.366
  114    HA   LYS  12           HA       LYS  12  -9.983   0.824   2.463
  115    HB2  LYS  12          1HB       LYS  12  -7.775   1.691   3.564
  116    HB3  LYS  12          2HB       LYS  12  -8.271  -0.009   3.749
  117    HG2  LYS  12          1HG       LYS  12  -6.747  -0.561   1.812
  118    HG3  LYS  12          2HG       LYS  12  -6.142   1.111   1.900
  119    HD2  LYS  12          1HD       LYS  12  -6.101  -0.842   4.222
  120    HD3  LYS  12          2HD       LYS  12  -4.730  -0.582   3.118
  121    HE2  LYS  12          1HE       LYS  12  -4.673   1.792   3.737
  122    HE3  LYS  12          2HE       LYS  12  -6.055   1.546   4.828
  123    HZ1  LYS  12          1HZ       LYS  12  -3.969   1.521   6.017
  124    HZ2  LYS  12          2HZ       LYS  12  -4.691   0.040   6.110
  125    HZ3  LYS  12          3HZ       LYS  12  -3.410   0.269   5.098
  126    H    THR  13           H        THR  13 -10.143   3.101   2.887
  127    HA   THR  13           HA       THR  13  -9.478   4.701   0.563
  128    HB   THR  13           HB       THR  13 -10.905   5.386   3.183
  129    HG1  THR  13          1HG       THR  13 -12.776   5.275   1.805
  130   HG21  THR  13          1HG2      THR  13 -11.675   7.398   1.976
  131   HG22  THR  13          2HG2      THR  13  -9.899   7.363   2.093
  132   HG23  THR  13          3HG2      THR  13 -10.699   6.925   0.564
  133    H    CYS  14           H        CYS  14  -7.779   6.023   0.337
  134    HA   CYS  14           HA       CYS  14  -5.751   5.824   2.279
  135    HB2  CYS  14          1HB       CYS  14  -6.029   7.467  -0.233
  136    HB3  CYS  14          2HB       CYS  14  -4.582   7.496   0.779
  137    HG   CYS  14           HG       CYS  14  -4.123   6.070  -1.387
  138    HA   PRO  15           HA       PRO  15  -6.734   9.441   4.574
  139    HB2  PRO  15          1HB       PRO  15  -4.440   9.940   5.907
  140    HB3  PRO  15          2HB       PRO  15  -5.392   8.507   6.320
  141    HG2  PRO  15          1HG       PRO  15  -2.989   8.730   4.475
  142    HG3  PRO  15          2HG       PRO  15  -3.313   7.531   5.734
  143    HD2  PRO  15          1HD       PRO  15  -3.824   7.030   3.070
  144    HD3  PRO  15          2HD       PRO  15  -4.784   6.293   4.359
  145    H    GLU  16           H        GLU  16  -6.531  11.733   4.685
  146    HA   GLU  16           HA       GLU  16  -5.837  12.821   2.262
  147    HB2  GLU  16          1HB       GLU  16  -7.330  13.859   3.900
  148    HB3  GLU  16          2HB       GLU  16  -5.961  14.094   5.014
  149    HG2  GLU  16          1HG       GLU  16  -4.936  15.716   3.348
  150    HG3  GLU  16          2HG       GLU  16  -6.330  15.325   2.315
  151    HE2  GLU  16           HE       GLU  16  -7.097  18.308   4.202
  152    H    GLY  17           H        GLY  17  -3.953  13.678   1.383
  153    HA2  GLY  17          1HA       GLY  17  -1.868  14.722   1.549
  154    HA3  GLY  17          2HA       GLY  17  -1.655  14.075   3.164
  155    H    LYS  18           H        LYS  18  -2.773  11.358   2.096
  156    HA   LYS  18           HA       LYS  18  -0.199  10.439   1.092
  157    HB2  LYS  18          1HB       LYS  18  -2.675   9.083   2.183
  158    HB3  LYS  18          2HB       LYS  18  -1.343   8.180   1.424
  159    HG2  LYS  18          1HG       LYS  18  -1.205   8.173   3.900
  160    HG3  LYS  18          2HG       LYS  18   0.206   8.942   3.134
  161    HD2  LYS  18          1HD       LYS  18  -1.845  10.915   3.599
  162    HD3  LYS  18          2HD       LYS  18  -1.519  10.027   5.107
  163    HE2  LYS  18          1HE       LYS  18   0.976  10.406   4.535
  164    HE3  LYS  18          2HE       LYS  18   0.377  11.643   3.406
  165    HZ1  LYS  18          1HZ       LYS  18   0.919  12.582   5.549
  166    HZ2  LYS  18          2HZ       LYS  18  -0.699  12.724   5.263
  167    HZ3  LYS  18          3HZ       LYS  18  -0.144  11.576   6.309
  168    H    ASN  19           H        ASN  19  -0.089   9.003  -0.798
  169    HA   ASN  19           HA       ASN  19  -2.243   9.594  -2.653
  170    HB2  ASN  19          1HB       ASN  19  -0.354  11.406  -3.002
  171    HB3  ASN  19          2HB       ASN  19   0.560   9.881  -3.108
  172   HD21  ASN  19          1HD2      ASN  19  -1.400  11.408  -6.301
  173   HD22  ASN  19          2HD2      ASN  19  -1.441  12.147  -4.735
  174    H    LEU  20           H        LEU  20   0.836   7.848  -1.864
  175    HA   LEU  20           HA       LEU  20   0.549   6.219  -4.234
  176    HB2  LEU  20          1HB       LEU  20   2.502   6.185  -2.017
  177    HB3  LEU  20          2HB       LEU  20   2.837   5.402  -3.579
  178    HG   LEU  20           HG       LEU  20   2.599   8.388  -3.045
  179   HD11  LEU  20          1HD1      LEU  20   5.013   8.421  -3.730
  180   HD12  LEU  20          2HD1      LEU  20   4.758   7.381  -2.308
  181   HD13  LEU  20          3HD1      LEU  20   4.967   6.652  -3.917
  182   HD21  LEU  20          1HD2      LEU  20   3.199   8.676  -5.424
  183   HD22  LEU  20          2HD2      LEU  20   3.112   6.912  -5.641
  184   HD23  LEU  20          3HD2      LEU  20   1.651   7.827  -5.205
  185    H    CYS  21           H        CYS  21   0.550   3.866  -4.183
  186    HA   CYS  21           HA       CYS  21  -0.547   2.850  -1.665
  187    HB2  CYS  21          1HB       CYS  21  -0.992   1.960  -4.511
  188    HB3  CYS  21          2HB       CYS  21  -1.490   1.011  -3.105
  189    HG   CYS  21           HG       CYS  21  -3.596   2.154  -4.193
  190    H    TYR  22           H        TYR  22   0.655   1.271  -0.613
  191    HA   TYR  22           HA       TYR  22   2.977   0.234  -2.096
  192    HB2  TYR  22          1HB       TYR  22   4.288   0.423  -0.158
  193    HB3  TYR  22          2HB       TYR  22   3.470   1.987  -0.396
  194    HD1  TYR  22          1HD       TYR  22   3.615  -1.056   1.697
  195    HD2  TYR  22          2HD       TYR  22   1.842   2.789   1.201
  196    HE1  TYR  22          1HE       TYR  22   2.726  -1.177   4.005
  197    HE2  TYR  22          2HE       TYR  22   0.946   2.685   3.502
  198    HH   TYR  22           HH       TYR  22   0.789   1.463   5.418
  199    H    LYS  23           H        LYS  23   3.760  -1.902  -1.408
  200    HA   LYS  23           HA       LYS  23   1.943  -3.300   0.414
  201    HB2  LYS  23          1HB       LYS  23   2.209  -5.333  -0.926
  202    HB3  LYS  23          2HB       LYS  23   1.402  -4.036  -1.841
  203    HG2  LYS  23          1HG       LYS  23   3.507  -3.545  -3.014
  204    HG3  LYS  23          2HG       LYS  23   4.324  -4.831  -2.092
  205    HD2  LYS  23          1HD       LYS  23   3.544  -5.419  -4.461
  206    HD3  LYS  23          2HD       LYS  23   3.086  -6.537  -3.153
  207    HE2  LYS  23          1HE       LYS  23   0.873  -5.498  -3.020
  208    HE3  LYS  23          2HE       LYS  23   1.325  -4.349  -4.299
  209    HZ1  LYS  23          1HZ       LYS  23   0.046  -6.185  -5.167
  210    HZ2  LYS  23          2HZ       LYS  23   1.571  -6.211  -5.797
  211    HZ3  LYS  23          3HZ       LYS  23   1.150  -7.277  -4.611
  212    H    MET  24           H        MET  24   2.974  -4.964   1.691
  213    HA   MET  24           HA       MET  24   5.848  -4.482   1.828
  214    HB2  MET  24          1HB       MET  24   3.817  -5.216   3.945
  215    HB3  MET  24          2HB       MET  24   5.574  -5.201   4.225
  216    HG2  MET  24          1HG       MET  24   5.664  -2.818   3.772
  217    HG3  MET  24          2HG       MET  24   3.932  -2.803   3.362
  218    HE1  MET  24          1HE       MET  24   5.515  -3.698   7.628
  219    HE2  MET  24          2HE       MET  24   5.603  -4.857   6.279
  220    HE3  MET  24          3HE       MET  24   6.577  -3.367   6.239
  221    H    PHE  25           H        PHE  25   7.276  -6.235   1.844
  222    HA   PHE  25           HA       PHE  25   6.007  -8.883   1.774
  223    HB2  PHE  25          1HB       PHE  25   8.592  -7.897   0.499
  224    HB3  PHE  25          2HB       PHE  25   8.043  -9.588   0.503
  225    HD1  PHE  25          1HD       PHE  25   7.403  -6.209  -0.789
  226    HD2  PHE  25          2HD       PHE  25   6.318 -10.339  -0.936
  227    HE1  PHE  25          1HE       PHE  25   6.126  -5.797  -2.866
  228    HE2  PHE  25          2HE       PHE  25   5.042  -9.932  -3.014
  229    HZ   PHE  25           HZ       PHE  25   4.946  -7.659  -3.978
  230    H    MET  26           H        MET  26   7.353 -10.688   2.735
  231    HA   MET  26           HA       MET  26   9.375  -9.642   4.563
  232    HB2  MET  26          1HB       MET  26   7.694 -12.154   4.694
  233    HB3  MET  26          2HB       MET  26   9.050 -11.801   5.791
  234    HG2  MET  26          1HG       MET  26   7.877  -9.802   6.601
  235    HG3  MET  26          2HG       MET  26   6.523 -10.147   5.500
  236    HE1  MET  26          1HE       MET  26   5.017 -10.933   9.065
  237    HE2  MET  26          2HE       MET  26   6.194  -9.658   8.662
  238    HE3  MET  26          3HE       MET  26   4.830  -9.991   7.566
  239    H    MET  27           H        MET  27  11.452 -10.655   4.585
  240    HA   MET  27           HA       MET  27  12.407 -11.197   2.134
  241    HB2  MET  27          1HB       MET  27  13.348 -11.971   4.889
  242    HB3  MET  27          2HB       MET  27  14.312 -12.354   3.443
  243    HG2  MET  27          1HG       MET  27  13.462  -9.584   4.347
  244    HG3  MET  27          2HG       MET  27  15.086 -10.288   4.531
  245    HE1  MET  27          1HE       MET  27  16.382 -10.510   0.870
  246    HE2  MET  27          2HE       MET  27  16.791 -10.640   2.599
  247    HE3  MET  27          3HE       MET  27  15.643 -11.788   1.866
  248    H    SER  28           H        SER  28  10.991 -13.493   4.481
  249    HA   SER  28           HA       SER  28  11.720 -15.812   3.135
  250    HB2  SER  28          1HB       SER  28  10.870 -15.801   5.413
  251    HB3  SER  28          2HB       SER  28   9.304 -15.168   4.856
  252    HG   SER  28           HG       SER  28   9.277 -17.433   5.200
  253    H    ASP  29           H        ASP  29   8.540 -14.019   3.146
  254    HA   ASP  29           HA       ASP  29   7.842 -15.514   0.778
  255    HB2  ASP  29          1HB       ASP  29   6.231 -15.399   2.775
  256    HB3  ASP  29          2HB       ASP  29   6.257 -13.653   2.424
  257    HD2  ASP  29           HD       ASP  29   3.379 -15.159   0.775
  258    H    LEU  30           H        LEU  30   9.300 -14.233  -0.667
  259    HA   LEU  30           HA       LEU  30   8.756 -11.436  -0.982
  260    HB2  LEU  30          1HB       LEU  30  10.394 -13.540  -2.116
  261    HB3  LEU  30          2HB       LEU  30  10.177 -12.178  -3.238
  262    HG   LEU  30           HG       LEU  30  11.640 -10.875  -2.120
  263   HD11  LEU  30          1HD1      LEU  30  11.680 -10.678   0.380
  264   HD12  LEU  30          2HD1      LEU  30  10.022 -10.549  -0.251
  265   HD13  LEU  30          3HD1      LEU  30  10.576 -12.068   0.492
  266   HD21  LEU  30          1HD2      LEU  30  13.364 -12.076  -0.820
  267   HD22  LEU  30          2HD2      LEU  30  12.289 -13.494  -0.738
  268   HD23  LEU  30          3HD2      LEU  30  12.906 -12.934  -2.311
  269    H    THR  31           H        THR  31   7.292 -14.407  -1.967
  270    HA   THR  31           HA       THR  31   6.562 -13.586  -4.603
  271    HB   THR  31           HB       THR  31   5.481 -15.805  -2.797
  272    HG1  THR  31          1HG       THR  31   6.890 -17.103  -4.119
  273   HG21  THR  31          1HG2      THR  31   4.644 -16.799  -4.898
  274   HG22  THR  31          2HG2      THR  31   3.913 -15.201  -4.610
  275   HG23  THR  31          3HG2      THR  31   5.223 -15.380  -5.801
  276    H    ILE  32           H        ILE  32   4.926 -13.645  -1.396
  277    HA   ILE  32           HA       ILE  32   2.752 -12.131  -2.663
  278    HB   ILE  32           HB       ILE  32   2.581 -14.363  -0.584
  279   HG12  ILE  32          1HG1      ILE  32   2.742 -15.115  -2.863
  280   HG13  ILE  32          2HG1      ILE  32   1.148 -15.459  -2.153
  281   HG21  ILE  32          1HG2      ILE  32   0.157 -13.885  -0.515
  282   HG22  ILE  32          2HG2      ILE  32   1.101 -12.486   0.046
  283   HG23  ILE  32          3HG2      ILE  32   0.401 -12.488  -1.590
  284   HD11  ILE  32          1HD1      ILE  32   0.935 -14.700  -4.487
  285   HD12  ILE  32          2HD1      ILE  32   0.193 -13.537  -3.364
  286   HD13  ILE  32          3HD1      ILE  32   1.786 -13.194  -4.075
  287    HA   PRO  33           HA       PRO  33   3.831  -9.350   0.512
  288    HB2  PRO  33          1HB       PRO  33   2.093  -7.337  -0.042
  289    HB3  PRO  33          2HB       PRO  33   3.505  -7.601  -1.075
  290    HG2  PRO  33          1HG       PRO  33   0.653  -8.572  -1.456
  291    HG3  PRO  33          2HG       PRO  33   1.745  -7.841  -2.640
  292    HD2  PRO  33          1HD       PRO  33   1.389 -10.564  -2.494
  293    HD3  PRO  33          2HD       PRO  33   2.934  -9.860  -2.987
  294    H    VAL  34           H        VAL  34   2.900  -8.252   2.455
  295    HA   VAL  34           HA       VAL  34   0.920 -10.207   3.405
  296    HB   VAL  34           HB       VAL  34   2.078 -10.055   5.608
  297   HG11  VAL  34          1HG1      VAL  34   4.128 -11.290   4.985
  298   HG12  VAL  34          2HG1      VAL  34   2.734 -11.835   4.022
  299   HG13  VAL  34          3HG1      VAL  34   3.945 -10.746   3.300
  300   HG21  VAL  34          1HG2      VAL  34   4.255  -8.962   5.789
  301   HG22  VAL  34          2HG2      VAL  34   4.076  -8.334   4.132
  302   HG23  VAL  34          3HG2      VAL  34   2.956  -7.807   5.412
  303    H    LYS  35           H        LYS  35   1.891  -6.863   3.057
  304    HA   LYS  35           HA       LYS  35  -0.579  -6.085   4.378
  305    HB2  LYS  35          1HB       LYS  35   2.192  -5.081   5.054
  306    HB3  LYS  35          2HB       LYS  35   0.717  -4.152   5.410
  307    HG2  LYS  35          1HG       LYS  35  -0.088  -6.147   6.746
  308    HG3  LYS  35          2HG       LYS  35   1.540  -6.839   6.548
  309    HD2  LYS  35          1HD       LYS  35   1.685  -5.771   8.618
  310    HD3  LYS  35          2HD       LYS  35   2.373  -4.570   7.497
  311    HE2  LYS  35          1HE       LYS  35   0.293  -3.344   7.442
  312    HE3  LYS  35          2HE       LYS  35  -0.523  -4.604   8.396
  313    HZ1  LYS  35          1HZ       LYS  35   0.098  -2.722   9.753
  314    HZ2  LYS  35          2HZ       LYS  35   0.930  -4.064  10.232
  315    HZ3  LYS  35          3HZ       LYS  35   1.687  -2.897   9.347
  316    H    ARG  36           H        ARG  36  -1.575  -4.327   3.389
  317    HA   ARG  36           HA       ARG  36   0.083  -2.816   1.565
  318    HB2  ARG  36          1HB       ARG  36  -2.574  -3.946   0.783
  319    HB3  ARG  36          2HB       ARG  36  -1.603  -2.786  -0.155
  320    HG2  ARG  36          1HG       ARG  36  -0.981  -4.728  -1.198
  321    HG3  ARG  36          2HG       ARG  36   0.246  -4.672   0.091
  322    HD2  ARG  36          1HD       ARG  36  -0.702  -6.882  -0.227
  323    HD3  ARG  36          2HD       ARG  36  -1.007  -6.228   1.400
  324    HE   ARG  36           HE       ARG  36  -3.410  -6.337   0.863
  325   HH11  ARG  36          1HH1      ARG  36  -1.549  -6.739  -2.058
  326   HH12  ARG  36          2HH1      ARG  36  -2.995  -7.229  -2.919
  327   HH21  ARG  36          1HH2      ARG  36  -5.076  -6.890  -0.110
  328   HH22  ARG  36          2HH2      ARG  36  -5.007  -7.316  -1.809
  329    H    GLY  37           H        GLY  37  -0.765  -0.612   1.160
  330    HA2  GLY  37          1HA       GLY  37  -3.115   0.381   2.344
  331    HA3  GLY  37          2HA       GLY  37  -1.794   0.571   3.478
  332    H    CYS  38           H        CYS  38  -2.269   2.948   3.110
  333    HA   CYS  38           HA       CYS  38  -1.275   3.853   0.512
  334    HB2  CYS  38          1HB       CYS  38  -3.016   5.087   2.778
  335    HB3  CYS  38          2HB       CYS  38  -2.731   5.878   1.209
  336    HG   CYS  38           HG       CYS  38  -5.179   5.089   1.376
  337    H    ILE  39           H        ILE  39   0.311   5.613   0.505
  338    HA   ILE  39           HA       ILE  39   0.929   6.888   2.983
  339    HB   ILE  39           HB       ILE  39   2.393   4.788   3.024
  340   HG12  ILE  39          1HG1      ILE  39   4.051   7.266   2.787
  341   HG13  ILE  39          2HG1      ILE  39   2.850   7.062   4.083
  342   HG21  ILE  39          1HG2      ILE  39   4.345   4.770   1.508
  343   HG22  ILE  39          2HG2      ILE  39   2.824   4.661   0.593
  344   HG23  ILE  39          3HG2      ILE  39   3.707   6.203   0.669
  345   HD11  ILE  39          1HD1      ILE  39   5.101   6.412   4.845
  346   HD12  ILE  39          2HD1      ILE  39   4.001   5.013   4.827
  347   HD13  ILE  39          3HD1      ILE  39   5.202   5.218   3.530
  348    H    ASP  40           H        ASP  40   2.522   8.709   2.609
  349    HA   ASP  40           HA       ASP  40   1.931   9.810   0.028
  350    HB2  ASP  40          1HB       ASP  40   2.907  11.942   1.052
  351    HB3  ASP  40          2HB       ASP  40   1.539  11.104   1.823
  352    HD2  ASP  40           HD       ASP  40   4.187  11.985   4.259
  353    H    VAL  41           H        VAL  41   4.774   8.979   2.131
  354    HA   VAL  41           HA       VAL  41   6.483   9.219  -0.249
  355    HB   VAL  41           HB       VAL  41   7.204   9.496   2.708
  356   HG11  VAL  41          1HG1      VAL  41   9.448  10.113   1.870
  357   HG12  VAL  41          2HG1      VAL  41   9.014   8.458   1.381
  358   HG13  VAL  41          3HG1      VAL  41   8.915   9.788   0.203
  359   HG21  VAL  41          1HG2      VAL  41   7.697  11.827   2.161
  360   HG22  VAL  41          2HG2      VAL  41   7.102  11.563   0.505
  361   HG23  VAL  41          3HG2      VAL  41   5.987  11.424   1.886
  362    H    CYS  42           H        CYS  42   7.538   7.402  -0.945
  363    HA   CYS  42           HA       CYS  42   6.562   4.975   0.101
  364    HB2  CYS  42          1HB       CYS  42   7.018   5.347  -2.273
  365    HB3  CYS  42          2HB       CYS  42   8.746   5.471  -1.932
  366    HG   CYS  42           HG       CYS  42   8.239   3.183  -3.132
  367    HA   PRO  43           HA       PRO  43   9.704   4.571   3.136
  368    HB2  PRO  43          1HB       PRO  43   9.015   2.126   4.151
  369    HB3  PRO  43          2HB       PRO  43   8.101   3.580   4.575
  370    HG2  PRO  43          1HG       PRO  43   7.514   1.515   2.431
  371    HG3  PRO  43          2HG       PRO  43   6.403   2.272   3.580
  372    HD2  PRO  43          1HD       PRO  43   6.581   3.149   0.993
  373    HD3  PRO  43          2HD       PRO  43   6.245   4.274   2.314
  374    H    LYS  44           H        LYS  44  11.795   3.897   3.261
  375    HA   LYS  44           HA       LYS  44  12.693   2.547   0.937
  376    HB2  LYS  44          1HB       LYS  44  14.029   3.279   3.558
  377    HB3  LYS  44          2HB       LYS  44  14.885   2.587   2.159
  378    HG2  LYS  44          1HG       LYS  44  14.270   4.550   0.808
  379    HG3  LYS  44          2HG       LYS  44  13.408   5.241   2.204
  380    HD2  LYS  44          1HD       LYS  44  15.498   5.336   3.476
  381    HD3  LYS  44          2HD       LYS  44  16.373   4.592   2.115
  382    HE2  LYS  44          1HE       LYS  44  15.801   6.512   0.694
  383    HE3  LYS  44          2HE       LYS  44  14.922   7.256   2.049
  384    HZ1  LYS  44          1HZ       LYS  44  17.136   8.157   1.824
  385    HZ2  LYS  44          2HZ       LYS  44  16.995   7.351   3.257
  386    HZ3  LYS  44          3HZ       LYS  44  17.811   6.662   2.001
  387    H    ASN  45           H        ASN  45  14.031   0.522   0.979
  388    HA   ASN  45           HA       ASN  45  12.374  -1.445   2.114
  389    HB2  ASN  45          1HB       ASN  45  14.981  -1.911   0.490
  390    HB3  ASN  45          2HB       ASN  45  13.771  -2.945   1.290
  391   HD21  ASN  45          1HD2      ASN  45  13.095  -2.143  -2.397
  392   HD22  ASN  45          2HD2      ASN  45  14.589  -2.439  -1.573
  393    H    SER  46           H        SER  46  12.916  -2.961   3.821
  394    HA   SER  46           HA       SER  46  15.277  -2.185   5.341
  395    HB2  SER  46          1HB       SER  46  14.129  -3.061   7.300
  396    HB3  SER  46          2HB       SER  46  13.096  -1.879   6.465
  397    HG   SER  46           HG       SER  46  11.972  -3.631   5.548
  398    H    LEU  47           H        LEU  47  15.895  -4.294   6.868
  399    HA   LEU  47           HA       LEU  47  16.847  -6.154   4.919
  400    HB2  LEU  47          1HB       LEU  47  16.952  -5.937   7.863
  401    HB3  LEU  47          2HB       LEU  47  17.911  -7.198   7.054
  402    HG   LEU  47           HG       LEU  47  18.251  -4.189   6.757
  403   HD11  LEU  47          1HD1      LEU  47  20.470  -4.600   7.852
  404   HD12  LEU  47          2HD1      LEU  47  19.126  -5.094   8.908
  405   HD13  LEU  47          3HD1      LEU  47  20.052  -6.322   8.014
  406   HD21  LEU  47          1HD2      LEU  47  20.222  -4.743   5.374
  407   HD22  LEU  47          2HD2      LEU  47  19.792  -6.468   5.486
  408   HD23  LEU  47          3HD2      LEU  47  18.698  -5.329   4.665
  409    H    LEU  48           H        LEU  48  14.127  -5.918   7.127
  410    HA   LEU  48           HA       LEU  48  13.826  -8.817   7.166
  411    HB2  LEU  48          1HB       LEU  48  12.484  -6.544   8.494
  412    HB3  LEU  48          2HB       LEU  48  11.978  -8.206   8.877
  413    HG   LEU  48           HG       LEU  48  14.685  -6.938   9.448
  414   HD11  LEU  48          1HD1      LEU  48  14.041  -7.312  11.844
  415   HD12  LEU  48          2HD1      LEU  48  12.874  -6.253  11.019
  416   HD13  LEU  48          3HD1      LEU  48  12.475  -7.963  11.306
  417   HD21  LEU  48          1HD2      LEU  48  15.250  -9.073  10.556
  418   HD22  LEU  48          2HD2      LEU  48  13.707  -9.757   9.985
  419   HD23  LEU  48          3HD2      LEU  48  14.950  -9.263   8.812
  420    H    VAL  49           H        VAL  49  12.073  -5.785   6.263
  421    HA   VAL  49           HA       VAL  49  10.301  -7.480   4.642
  422    HB   VAL  49           HB       VAL  49   8.513  -5.759   5.086
  423   HG11  VAL  49          1HG1      VAL  49   7.992  -6.509   7.383
  424   HG12  VAL  49          2HG1      VAL  49   8.576  -7.861   6.385
  425   HG13  VAL  49          3HG1      VAL  49   9.660  -7.095   7.571
  426   HG21  VAL  49          1HG2      VAL  49   8.780  -4.210   6.957
  427   HG22  VAL  49          2HG2      VAL  49  10.479  -4.715   7.130
  428   HG23  VAL  49          3HG2      VAL  49   9.942  -3.885   5.650
  429    H    LYS  50           H        LYS  50   9.672  -6.614   2.603
  430    HA   LYS  50           HA       LYS  50  11.380  -4.386   1.759
  431    HB2  LYS  50          1HB       LYS  50  11.753  -6.493   0.589
  432    HB3  LYS  50          2HB       LYS  50  10.018  -6.607   0.209
  433    HG2  LYS  50          1HG       LYS  50  10.199  -4.567  -1.175
  434    HG3  LYS  50          2HG       LYS  50  11.941  -4.490  -0.816
  435    HD2  LYS  50          1HD       LYS  50  12.272  -6.674  -1.887
  436    HD3  LYS  50          2HD       LYS  50  10.528  -6.780  -2.223
  437    HE2  LYS  50          1HE       LYS  50  10.696  -4.716  -3.588
  438    HE3  LYS  50          2HE       LYS  50  12.451  -4.699  -3.304
  439    HZ1  LYS  50          1HZ       LYS  50  11.901  -5.706  -5.414
  440    HZ2  LYS  50          2HZ       LYS  50  12.587  -6.825  -4.415
  441    HZ3  LYS  50          3HZ       LYS  50  10.959  -6.841  -4.678
  442    H    TYR  51           H        TYR  51  10.483  -2.649   0.555
  443    HA   TYR  51           HA       TYR  51   7.553  -2.496   0.799
  444    HB2  TYR  51          1HB       TYR  51   9.666  -0.350   1.017
  445    HB3  TYR  51          2HB       TYR  51   7.910  -0.055   0.969
  446    HD1  TYR  51          1HD       TYR  51  10.713  -1.282   3.008
  447    HD2  TYR  51          2HD       TYR  51   6.498  -0.647   2.880
  448    HE1  TYR  51          1HE       TYR  51  10.600  -1.598   5.462
  449    HE2  TYR  51          2HE       TYR  51   6.367  -0.960   5.329
  450    HH   TYR  51           HH       TYR  51   9.265  -1.651   7.300
  451    H    VAL  52           H        VAL  52   6.465  -2.370  -1.101
  452    HA   VAL  52           HA       VAL  52   7.873  -1.068  -3.328
  453    HB   VAL  52           HB       VAL  52   5.859  -3.361  -3.472
  454   HG11  VAL  52          1HG1      VAL  52   6.358  -3.327  -5.893
  455   HG12  VAL  52          2HG1      VAL  52   5.668  -1.776  -5.359
  456   HG13  VAL  52          3HG1      VAL  52   7.418  -1.918  -5.656
  457   HG21  VAL  52          1HG2      VAL  52   7.716  -4.688  -4.348
  458   HG22  VAL  52          2HG2      VAL  52   8.825  -3.327  -4.054
  459   HG23  VAL  52          3HG2      VAL  52   8.019  -4.130  -2.685
  460    H    CYS  53           H        CYS  53   6.855   0.702  -4.147
  461    HA   CYS  53           HA       CYS  53   4.072   1.068  -3.301
  462    HB2  CYS  53          1HB       CYS  53   6.044   3.293  -3.784
  463    HB3  CYS  53          2HB       CYS  53   4.438   3.400  -3.058
  464    HG   CYS  53           HG       CYS  53   6.272   3.889  -1.232
  465    H    CYS  54           H        CYS  54   2.801   2.477  -4.879
  466    HA   CYS  54           HA       CYS  54   3.998   2.959  -7.424
  467    HB2  CYS  54          1HB       CYS  54   2.121   1.678  -8.611
  468    HB3  CYS  54          2HB       CYS  54   3.538   0.790  -8.046
  469    HG   CYS  54           HG       CYS  54   1.390  -0.705  -7.769
  470    H    ASN  55           H        ASN  55   2.361   4.259  -8.817
  471    HA   ASN  55           HA       ASN  55   1.323   5.982  -6.723
  472    HB2  ASN  55          1HB       ASN  55   2.147   7.928  -8.133
  473    HB3  ASN  55          2HB       ASN  55   3.185   6.522  -7.788
  474   HD21  ASN  55          1HD2      ASN  55   3.517   7.659 -11.343
  475   HD22  ASN  55          2HD2      ASN  55   3.579   8.474  -9.816
  476    H    THR  56           H        THR  56  -0.276   3.841  -8.039
  477    HA   THR  56           HA       THR  56  -2.394   5.615  -9.022
  478    HB   THR  56           HB       THR  56  -3.091   3.810 -10.615
  479    HG1  THR  56          1HG       THR  56  -1.522   2.146 -11.042
  480   HG21  THR  56          1HG2      THR  56  -1.323   4.175 -12.301
  481   HG22  THR  56          2HG2      THR  56  -1.706   5.684 -11.439
  482   HG23  THR  56          3HG2      THR  56  -0.233   4.776 -11.030
  483    H    ASP  57           H        ASP  57  -4.558   4.225  -9.082
  484    HA   ASP  57           HA       ASP  57  -4.898   3.758  -6.332
  485    HB2  ASP  57          1HB       ASP  57  -6.840   3.609  -8.702
  486    HB3  ASP  57          2HB       ASP  57  -7.162   3.163  -7.008
  487    HD2  ASP  57           HD       ASP  57  -7.200   6.935  -7.963
  488    H    ARG  58           H        ARG  58  -5.077   1.744  -5.247
  489    HA   ARG  58           HA       ARG  58  -5.059  -0.396  -4.907
  490    HB2  ARG  58          1HB       ARG  58  -6.867  -0.445  -7.288
  491    HB3  ARG  58          2HB       ARG  58  -6.626  -1.789  -6.147
  492    HG2  ARG  58          1HG       ARG  58  -7.787  -0.746  -4.452
  493    HG3  ARG  58          2HG       ARG  58  -7.442   0.885  -5.076
  494    HD2  ARG  58          1HD       ARG  58  -9.260  -1.020  -6.489
  495    HD3  ARG  58          2HD       ARG  58  -9.818   0.047  -5.179
  496    HE   ARG  58           HE       ARG  58  -8.691   1.813  -7.093
  497   HH11  ARG  58          1HH1      ARG  58 -11.142  -0.663  -7.235
  498   HH12  ARG  58          2HH1      ARG  58 -11.971   0.220  -8.502
  499   HH21  ARG  58          1HH2      ARG  58  -9.624   2.833  -8.549
  500   HH22  ARG  58          2HH2      ARG  58 -11.105   2.214  -9.253
  501    H    CYS  59           H        CYS  59  -2.846   0.619  -6.538
  502    HA   CYS  59           HA       CYS  59  -2.512  -1.160  -8.747
  503    HB2  CYS  59          1HB       CYS  59  -0.383   0.264  -8.873
  504    HB3  CYS  59          2HB       CYS  59  -1.758   1.319  -8.462
  505    HG   CYS  59           HG       CYS  59   0.369   2.116  -7.246
  506    H    ASN  60           H        ASN  60  -1.807  -1.054  -5.305
  507    HA   ASN  60           HA       ASN  60   0.121  -3.166  -5.507
  508    HB2  ASN  60          1HB       ASN  60   0.001  -3.103  -2.984
  509    HB3  ASN  60          2HB       ASN  60   0.385  -1.526  -3.691
  510   HD21  ASN  60          1HD2      ASN  60  -0.372  -0.968  -1.453
  511   HD22  ASN  60          2HD2      ASN  60  -2.050  -0.604  -1.232
  Start of MODEL   16
    1    H1   MET   0          1H        MET   0  -8.311  11.816  -2.925
    2    H2   MET   0          2H        MET   0  -6.823  11.799  -3.114
    3    H    MET   0           H        MET   0  -7.695  10.845  -3.918
    4    H3   MET   0          3H        MET   0  -7.692  10.877  -3.918
    5    HA   MET   0           HA       MET   0  -6.465  10.284  -1.482
    6    HB2  MET   0          1HB       MET   0  -9.489  10.308  -1.383
    7    HB3  MET   0          2HB       MET   0  -8.462   9.490  -0.180
    8    HG2  MET   0          1HG       MET   0  -7.499  11.591   0.509
    9    HG3  MET   0          2HG       MET   0  -8.341  12.455  -0.799
   10    HE1  MET   0          1HE       MET   0 -10.319  10.725   3.012
   11    HE2  MET   0          2HE       MET   0  -9.529   9.687   1.800
   12    HE3  MET   0          3HE       MET   0  -8.565  10.855   2.737
   13    H    LEU   1           H        LEU   1  -5.491   8.554  -2.586
   14    HA   LEU   1           HA       LEU   1  -6.990   7.119  -4.513
   15    HB2  LEU   1          1HB       LEU   1  -4.339   7.212  -3.356
   16    HB3  LEU   1          2HB       LEU   1  -4.650   5.664  -4.175
   17    HG   LEU   1           HG       LEU   1  -5.387   7.204  -6.174
   18   HD11  LEU   1          1HD1      LEU   1  -4.033   9.313  -6.277
   19   HD12  LEU   1          2HD1      LEU   1  -5.171   9.340  -4.909
   20   HD13  LEU   1          3HD1      LEU   1  -3.447   8.999  -4.627
   21   HD21  LEU   1          1HD2      LEU   1  -3.081   7.145  -7.060
   22   HD22  LEU   1          2HD2      LEU   1  -2.480   6.782  -5.423
   23   HD23  LEU   1          3HD2      LEU   1  -3.547   5.626  -6.256
   24    H    LYS   2           H        LYS   2  -6.552   4.511  -4.423
   25    HA   LYS   2           HA       LYS   2  -7.459   3.667  -1.760
   26    HB2  LYS   2          1HB       LYS   2  -8.231   2.432  -4.413
   27    HB3  LYS   2          2HB       LYS   2  -8.886   2.047  -2.804
   28    HG2  LYS   2          1HG       LYS   2  -9.247   4.685  -4.267
   29    HG3  LYS   2          2HG       LYS   2 -10.460   3.385  -4.179
   30    HD2  LYS   2          1HD       LYS   2 -10.441   3.588  -1.698
   31    HD3  LYS   2          2HD       LYS   2  -9.314   4.958  -1.848
   32    HE2  LYS   2          1HE       LYS   2 -12.093   4.832  -3.058
   33    HE3  LYS   2          2HE       LYS   2 -11.674   5.669  -1.546
   34    HZ1  LYS   2          1HZ       LYS   2 -11.728   7.179  -3.412
   35    HZ2  LYS   2          2HZ       LYS   2 -10.196   7.078  -2.811
   36    HZ3  LYS   2          3HZ       LYS   2 -10.584   6.302  -4.214
   37    H    CYS   3           H        CYS   3  -6.497   1.820  -0.901
   38    HA   CYS   3           HA       CYS   3  -4.619   0.461  -2.695
   39    HB2  CYS   3          1HB       CYS   3  -4.655   0.930   0.383
   40    HB3  CYS   3          2HB       CYS   3  -3.305   0.178  -0.503
   41    HG   CYS   3           HG       CYS   3  -2.606   2.495   0.382
   42    H    ASN   4           H        ASN   4  -4.581  -1.885  -2.495
   43    HA   ASN   4           HA       ASN   4  -7.094  -2.901  -1.581
   44    HB2  ASN   4          1HB       ASN   4  -4.924  -4.611  -2.983
   45    HB3  ASN   4          2HB       ASN   4  -6.617  -4.771  -2.453
   46   HD21  ASN   4          1HD2      ASN   4  -5.768  -3.335  -6.055
   47   HD22  ASN   4          2HD2      ASN   4  -4.653  -4.164  -5.020
   48    H    LYS   5           H        LYS   5  -7.338  -4.374   0.201
   49    HA   LYS   5           HA       LYS   5  -4.875  -5.252   1.509
   50    HB2  LYS   5          1HB       LYS   5  -7.314  -4.062   2.866
   51    HB3  LYS   5          2HB       LYS   5  -5.950  -4.844   3.701
   52    HG2  LYS   5          1HG       LYS   5  -4.457  -3.072   2.649
   53    HG3  LYS   5          2HG       LYS   5  -5.950  -2.233   2.160
   54    HD2  LYS   5          1HD       LYS   5  -6.649  -2.297   4.597
   55    HD3  LYS   5          2HD       LYS   5  -5.004  -2.860   4.972
   56    HE2  LYS   5          1HE       LYS   5  -4.130  -0.814   3.794
   57    HE3  LYS   5          2HE       LYS   5  -5.809  -0.236   3.686
   58    HZ1  LYS   5          1HZ       LYS   5  -4.674   0.679   5.595
   59    HZ2  LYS   5          2HZ       LYS   5  -5.913  -0.292   6.087
   60    HZ3  LYS   5          3HZ       LYS   5  -4.356  -0.829   6.185
   61    H    LEU   6           H        LEU   6  -8.323  -5.535   2.509
   62    HA   LEU   6           HA       LEU   6  -8.110  -8.299   2.862
   63    HB2  LEU   6          1HB       LEU   6  -9.610  -6.950   3.981
   64    HB3  LEU   6          2HB       LEU   6 -10.548  -6.447   2.553
   65    HG   LEU   6           HG       LEU   6 -11.136  -8.895   2.226
   66   HD11  LEU   6          1HD1      LEU   6 -10.948 -10.354   4.259
   67   HD12  LEU   6          2HD1      LEU   6  -9.346  -9.840   3.682
   68   HD13  LEU   6          3HD1      LEU   6 -10.079  -9.048   5.097
   69   HD21  LEU   6          1HD2      LEU   6 -12.925  -8.866   3.929
   70   HD22  LEU   6          2HD2      LEU   6 -12.092  -7.526   4.755
   71   HD23  LEU   6          3HD2      LEU   6 -12.731  -7.298   3.109
   72    H    VAL   7           H        VAL   7  -8.260  -9.996   1.480
   73    HA   VAL   7           HA       VAL   7  -8.357  -9.467  -1.293
   74    HB   VAL   7           HB       VAL   7  -8.332 -11.956  -1.506
   75   HG11  VAL   7          1HG1      VAL   7  -6.184 -12.344  -0.345
   76   HG12  VAL   7          2HG1      VAL   7  -6.210 -10.745  -1.126
   77   HG13  VAL   7          3HG1      VAL   7  -6.448 -10.881   0.633
   78   HG21  VAL   7          1HG2      VAL   7  -8.270 -13.358   0.494
   79   HG22  VAL   7          2HG2      VAL   7  -8.609 -11.931   1.502
   80   HG23  VAL   7          3HG2      VAL   7  -9.819 -12.500   0.327
   81    HA   PRO   8           HA       PRO   8  -8.755 -10.775  -2.815
   82    HB2  PRO   8          1HB       PRO   8  -9.792 -10.780  -5.296
   83    HB3  PRO   8          2HB       PRO   8 -10.058 -12.182  -4.251
   84    HG2  PRO   8          1HG       PRO   8 -11.895  -9.833  -4.799
   85    HG3  PRO   8          2HG       PRO   8 -12.289 -11.555  -4.695
   86    HD2  PRO   8          1HD       PRO   8 -12.653  -9.776  -2.579
   87    HD3  PRO   8          2HD       PRO   8 -12.411 -11.513  -2.350
   88    H    ILE   9           H        ILE   9 -11.128  -8.255  -3.331
   89    HA   ILE   9           HA       ILE   9  -8.976  -6.689  -4.572
   90    HB   ILE   9           HB       ILE   9 -11.990  -6.586  -5.081
   91   HG12  ILE   9          1HG1      ILE   9 -11.033  -8.565  -6.005
   92   HG13  ILE   9          2HG1      ILE   9 -11.479  -7.413  -7.287
   93   HG21  ILE   9          1HG2      ILE   9 -11.397  -5.000  -6.882
   94   HG22  ILE   9          2HG2      ILE   9 -10.899  -4.378  -5.291
   95   HG23  ILE   9          3HG2      ILE   9  -9.689  -5.080  -6.390
   96   HD11  ILE   9          1HD1      ILE   9  -9.322  -8.499  -7.777
   97   HD12  ILE   9          2HD1      ILE   9  -9.116  -6.751  -7.514
   98   HD13  ILE   9          3HD1      ILE   9  -8.671  -7.902  -6.234
   99    H    ALA  10           H        ALA  10 -11.258  -7.003  -1.973
  100    HA   ALA  10           HA       ALA  10 -12.297  -4.565  -1.590
  101    HB1  ALA  10          1HB       ALA  10 -12.928  -5.525   0.345
  102    HB2  ALA  10          2HB       ALA  10 -11.895  -6.909  -0.086
  103    HB3  ALA  10          3HB       ALA  10 -11.248  -5.595   0.926
  104    H    TYR  11           H        TYR  11 -11.670  -2.525  -0.878
  105    HA   TYR  11           HA       TYR  11  -8.786  -2.190  -0.437
  106    HB2  TYR  11          1HB       TYR  11  -8.830  -0.254  -1.926
  107    HB3  TYR  11          2HB       TYR  11  -9.167  -1.789  -2.764
  108    HD1  TYR  11          1HD       TYR  11 -10.591   1.427  -1.660
  109    HD2  TYR  11          2HD       TYR  11 -11.362  -2.227  -3.718
  110    HE1  TYR  11          1HE       TYR  11 -12.681   2.392  -2.574
  111    HE2  TYR  11          2HE       TYR  11 -13.451  -1.280  -4.640
  112    HH   TYR  11           HH       TYR  11 -14.825   0.534  -4.736
  113    H    LYS  12           H        LYS  12  -8.222  -0.077   0.549
  114    HA   LYS  12           HA       LYS  12 -10.505   1.040   2.023
  115    HB2  LYS  12          1HB       LYS  12  -7.660   0.499   2.916
  116    HB3  LYS  12          2HB       LYS  12  -8.807   1.516   3.821
  117    HG2  LYS  12          1HG       LYS  12 -10.346  -0.546   3.834
  118    HG3  LYS  12          2HG       LYS  12  -8.910  -1.466   3.327
  119    HD2  LYS  12          1HD       LYS  12  -7.698  -0.694   5.319
  120    HD3  LYS  12          2HD       LYS  12  -9.119   0.252   5.822
  121    HE2  LYS  12          1HE       LYS  12 -10.438  -1.847   5.930
  122    HE3  LYS  12          2HE       LYS  12  -8.969  -2.763   5.520
  123    HZ1  LYS  12          1HZ       LYS  12  -9.364  -2.730   7.888
  124    HZ2  LYS  12          2HZ       LYS  12  -7.964  -1.931   7.537
  125    HZ3  LYS  12          3HZ       LYS  12  -9.327  -1.082   7.917
  126    H    THR  13           H        THR  13 -10.235   3.346   2.647
  127    HA   THR  13           HA       THR  13  -9.193   4.676   0.282
  128    HB   THR  13           HB       THR  13 -10.865   5.707   2.625
  129    HG1  THR  13          1HG       THR  13 -12.572   5.561   1.049
  130   HG21  THR  13          1HG2      THR  13 -11.344   7.617   1.134
  131   HG22  THR  13          2HG2      THR  13  -9.600   7.487   1.468
  132   HG23  THR  13          3HG2      THR  13 -10.251   6.935  -0.093
  133    H    CYS  14           H        CYS  14  -7.376   5.840   0.174
  134    HA   CYS  14           HA       CYS  14  -5.675   5.926   2.412
  135    HB2  CYS  14          1HB       CYS  14  -5.551   7.283  -0.279
  136    HB3  CYS  14          2HB       CYS  14  -4.269   7.391   0.930
  137    HG   CYS  14           HG       CYS  14  -3.538   5.754  -0.997
  138    HA   PRO  15           HA       PRO  15  -7.140   9.669   4.117
  139    HB2  PRO  15          1HB       PRO  15  -5.195  10.302   5.888
  140    HB3  PRO  15          2HB       PRO  15  -6.216   8.887   6.177
  141    HG2  PRO  15          1HG       PRO  15  -3.463   9.021   4.899
  142    HG3  PRO  15          2HG       PRO  15  -4.060   7.903   6.131
  143    HD2  PRO  15          1HD       PRO  15  -3.964   7.214   3.467
  144    HD3  PRO  15          2HD       PRO  15  -5.197   6.560   4.551
  145    H    GLU  16           H        GLU  16  -7.015  11.963   4.097
  146    HA   GLU  16           HA       GLU  16  -5.732  12.952   1.880
  147    HB2  GLU  16          1HB       GLU  16  -7.596  14.042   3.026
  148    HB3  GLU  16          2HB       GLU  16  -6.565  14.340   4.446
  149    HG2  GLU  16          1HG       GLU  16  -5.144  15.906   3.035
  150    HG3  GLU  16          2HG       GLU  16  -6.221  15.455   1.694
  151    HE2  GLU  16           HE       GLU  16  -7.464  18.502   3.178
  152    H    GLY  17           H        GLY  17  -3.715  13.897   1.486
  153    HA2  GLY  17          1HA       GLY  17  -1.680  14.850   2.164
  154    HA3  GLY  17          2HA       GLY  17  -1.864  14.139   3.755
  155    H    LYS  18           H        LYS  18  -2.798  11.492   2.451
  156    HA   LYS  18           HA       LYS  18  -0.169  10.618   1.500
  157    HB2  LYS  18          1HB       LYS  18  -2.592   9.122   2.534
  158    HB3  LYS  18          2HB       LYS  18  -1.149   8.335   1.852
  159    HG2  LYS  18          1HG       LYS  18   0.202   9.494   3.655
  160    HG3  LYS  18          2HG       LYS  18  -1.344   9.978   4.394
  161    HD2  LYS  18          1HD       LYS  18  -1.962   7.740   4.840
  162    HD3  LYS  18          2HD       LYS  18  -0.721   7.093   3.740
  163    HE2  LYS  18          1HE       LYS  18   1.030   8.015   5.263
  164    HE3  LYS  18          2HE       LYS  18  -0.260   8.492   6.391
  165    HZ1  LYS  18          1HZ       LYS  18   0.711   6.379   6.992
  166    HZ2  LYS  18          2HZ       LYS  18  -0.871   6.175   6.571
  167    HZ3  LYS  18          3HZ       LYS  18   0.325   5.734   5.524
  168    H    ASN  19           H        ASN  19  -0.106   9.169  -0.406
  169    HA   ASN  19           HA       ASN  19  -2.278   9.841  -2.214
  170    HB2  ASN  19          1HB       ASN  19  -0.287  11.572  -2.549
  171    HB3  ASN  19          2HB       ASN  19   0.516   9.997  -2.764
  172   HD21  ASN  19          1HD2      ASN  19  -1.514  11.781  -5.779
  173   HD22  ASN  19          2HD2      ASN  19  -1.431  12.450  -4.183
  174    H    LEU  20           H        LEU  20   0.792   8.008  -1.561
  175    HA   LEU  20           HA       LEU  20   0.295   6.354  -3.888
  176    HB2  LEU  20          1HB       LEU  20   2.437   6.318  -1.856
  177    HB3  LEU  20          2HB       LEU  20   2.624   5.535  -3.442
  178    HG   LEU  20           HG       LEU  20   2.486   8.520  -2.868
  179   HD11  LEU  20          1HD1      LEU  20   4.810   8.518  -3.812
  180   HD12  LEU  20          2HD1      LEU  20   4.692   7.464  -2.383
  181   HD13  LEU  20          3HD1      LEU  20   4.710   6.753  -4.014
  182   HD21  LEU  20          1HD2      LEU  20   2.828   8.830  -5.295
  183   HD22  LEU  20          2HD2      LEU  20   2.683   7.069  -5.522
  184   HD23  LEU  20          3HD2      LEU  20   1.296   8.006  -4.917
  185    H    CYS  21           H        CYS  21   0.345   3.981  -3.764
  186    HA   CYS  21           HA       CYS  21  -0.477   3.023  -1.123
  187    HB2  CYS  21          1HB       CYS  21  -1.015   1.952  -3.888
  188    HB3  CYS  21          2HB       CYS  21  -1.328   1.025  -2.417
  189    HG   CYS  21           HG       CYS  21  -3.599   1.921  -3.401
  190    H    TYR  22           H        TYR  22   0.792   1.426  -0.122
  191    HA   TYR  22           HA       TYR  22   3.067   0.429  -1.705
  192    HB2  TYR  22          1HB       TYR  22   4.436   0.535   0.204
  193    HB3  TYR  22          2HB       TYR  22   3.645   2.120   0.024
  194    HD1  TYR  22          1HD       TYR  22   3.726  -0.999   2.021
  195    HD2  TYR  22          2HD       TYR  22   2.132   2.944   1.704
  196    HE1  TYR  22          1HE       TYR  22   2.895  -1.157   4.350
  197    HE2  TYR  22          2HE       TYR  22   1.297   2.804   4.027
  198    HH   TYR  22           HH       TYR  22   1.131   1.526   5.904
  199    H    LYS  23           H        LYS  23   3.808  -1.740  -1.182
  200    HA   LYS  23           HA       LYS  23   2.029  -3.216   0.616
  201    HB2  LYS  23          1HB       LYS  23   2.207  -5.153  -0.884
  202    HB3  LYS  23          2HB       LYS  23   1.374  -3.779  -1.650
  203    HG2  LYS  23          1HG       LYS  23   3.319  -3.250  -2.972
  204    HG3  LYS  23          2HG       LYS  23   4.299  -4.449  -2.096
  205    HD2  LYS  23          1HD       LYS  23   3.533  -5.218  -4.355
  206    HD3  LYS  23          2HD       LYS  23   3.024  -6.271  -3.014
  207    HE2  LYS  23          1HE       LYS  23   0.810  -5.254  -3.014
  208    HE3  LYS  23          2HE       LYS  23   1.308  -4.119  -4.290
  209    HZ1  LYS  23          1HZ       LYS  23   0.071  -5.975  -5.182
  210    HZ2  LYS  23          2HZ       LYS  23   1.619  -6.001  -5.751
  211    HZ3  LYS  23          3HZ       LYS  23   1.157  -7.053  -4.567
  212    H    MET  24           H        MET  24   3.059  -4.982   1.747
  213    HA   MET  24           HA       MET  24   5.931  -4.478   1.876
  214    HB2  MET  24          1HB       MET  24   3.915  -5.243   3.999
  215    HB3  MET  24          2HB       MET  24   5.674  -5.229   4.269
  216    HG2  MET  24          1HG       MET  24   5.754  -2.836   3.833
  217    HG3  MET  24          2HG       MET  24   4.016  -2.824   3.454
  218    HE1  MET  24          1HE       MET  24   5.722  -3.689   7.679
  219    HE2  MET  24          2HE       MET  24   5.832  -4.840   6.324
  220    HE3  MET  24          3HE       MET  24   6.733  -3.305   6.264
  221    H    PHE  25           H        PHE  25   7.356  -6.215   1.781
  222    HA   PHE  25           HA       PHE  25   6.103  -8.872   1.730
  223    HB2  PHE  25          1HB       PHE  25   8.664  -7.724   0.480
  224    HB3  PHE  25          2HB       PHE  25   8.175  -9.416   0.329
  225    HD1  PHE  25          1HD       PHE  25   6.450 -10.053  -1.193
  226    HD2  PHE  25          2HD       PHE  25   7.425  -5.962  -0.681
  227    HE1  PHE  25          1HE       PHE  25   5.129  -9.480  -3.265
  228    HE2  PHE  25          2HE       PHE  25   6.111  -5.385  -2.740
  229    HZ   PHE  25           HZ       PHE  25   4.979  -7.148  -4.005
  230    H    MET  26           H        MET  26   7.654 -10.679   2.442
  231    HA   MET  26           HA       MET  26   9.497  -9.647   4.458
  232    HB2  MET  26          1HB       MET  26   7.818 -12.163   4.441
  233    HB3  MET  26          2HB       MET  26   9.106 -11.836   5.626
  234    HG2  MET  26          1HG       MET  26   7.881  -9.826   6.373
  235    HG3  MET  26          2HG       MET  26   6.582 -10.203   5.218
  236    HE1  MET  26          1HE       MET  26   7.613 -12.678   8.996
  237    HE2  MET  26          2HE       MET  26   8.730 -12.533   7.616
  238    HE3  MET  26          3HE       MET  26   8.326 -11.098   8.590
  239    H    MET  27           H        MET  27  11.570 -10.650   4.619
  240    HA   MET  27           HA       MET  27  12.688 -11.586   2.324
  241    HB2  MET  27          1HB       MET  27  13.385 -11.957   5.236
  242    HB3  MET  27          2HB       MET  27  14.438 -12.555   3.931
  243    HG2  MET  27          1HG       MET  27  13.614  -9.670   4.385
  244    HG3  MET  27          2HG       MET  27  15.196 -10.378   4.790
  245    HE1  MET  27          1HE       MET  27  16.728 -11.158   1.291
  246    HE2  MET  27          2HE       MET  27  17.011 -11.077   3.047
  247    HE3  MET  27          3HE       MET  27  15.858 -12.261   2.385
  248    H    SER  28           H        SER  28  10.754 -13.323   4.721
  249    HA   SER  28           HA       SER  28  11.387 -15.889   3.798
  250    HB2  SER  28          1HB       SER  28  10.255 -15.485   5.914
  251    HB3  SER  28          2HB       SER  28   8.870 -14.760   5.065
  252    HG   SER  28           HG       SER  28   8.508 -16.944   5.652
  253    H    ASP  29           H        ASP  29   8.384 -13.896   3.227
  254    HA   ASP  29           HA       ASP  29   8.028 -15.459   0.806
  255    HB2  ASP  29          1HB       ASP  29   6.161 -15.496   2.549
  256    HB3  ASP  29          2HB       ASP  29   6.162 -13.733   2.299
  257    HD2  ASP  29           HD       ASP  29   3.598 -15.297   0.206
  258    H    LEU  30           H        LEU  30   9.382 -14.195  -0.633
  259    HA   LEU  30           HA       LEU  30   8.959 -11.362  -0.829
  260    HB2  LEU  30          1HB       LEU  30  10.651 -13.394  -2.221
  261    HB3  LEU  30          2HB       LEU  30  10.449 -11.775  -2.913
  262    HG   LEU  30           HG       LEU  30  12.428 -11.614  -1.716
  263   HD11  LEU  30          1HD1      LEU  30  10.965 -10.743   0.666
  264   HD12  LEU  30          2HD1      LEU  30  11.973  -9.817  -0.473
  265   HD13  LEU  30          3HD1      LEU  30  10.266 -10.139  -0.857
  266   HD21  LEU  30          1HD2      LEU  30  13.037 -12.736   0.205
  267   HD22  LEU  30          2HD2      LEU  30  11.360 -12.884   0.784
  268   HD23  LEU  30          3HD2      LEU  30  11.927 -13.899  -0.562
  269    H    THR  31           H        THR  31   7.582 -14.308  -2.162
  270    HA   THR  31           HA       THR  31   6.957 -13.253  -4.717
  271    HB   THR  31           HB       THR  31   5.775 -15.606  -3.162
  272    HG1  THR  31          1HG       THR  31   7.251 -16.799  -4.508
  273   HG21  THR  31          1HG2      THR  31   5.050 -16.423  -5.377
  274   HG22  THR  31          2HG2      THR  31   4.306 -14.850  -5.000
  275   HG23  THR  31          3HG2      THR  31   5.677 -14.937  -6.131
  276    H    ILE  32           H        ILE  32   5.169 -13.493  -1.609
  277    HA   ILE  32           HA       ILE  32   3.038 -11.939  -2.901
  278    HB   ILE  32           HB       ILE  32   2.799 -14.259  -0.928
  279   HG12  ILE  32          1HG1      ILE  32   3.069 -14.901  -3.238
  280   HG13  ILE  32          2HG1      ILE  32   1.460 -15.308  -2.598
  281   HG21  ILE  32          1HG2      ILE  32   0.369 -13.804  -0.946
  282   HG22  ILE  32          2HG2      ILE  32   1.274 -12.422  -0.286
  283   HG23  ILE  32          3HG2      ILE  32   0.646 -12.362  -1.949
  284   HD11  ILE  32          1HD1      ILE  32   1.310 -14.450  -4.903
  285   HD12  ILE  32          2HD1      ILE  32   0.504 -13.353  -3.755
  286   HD13  ILE  32          3HD1      ILE  32   2.113 -12.947  -4.395
  287    HA   PRO  33           HA       PRO  33   3.940  -9.267   0.416
  288    HB2  PRO  33          1HB       PRO  33   2.096  -7.323  -0.059
  289    HB3  PRO  33          2HB       PRO  33   3.533  -7.459  -1.081
  290    HG2  PRO  33          1HG       PRO  33   0.745  -8.564  -1.555
  291    HG3  PRO  33          2HG       PRO  33   1.811  -7.717  -2.684
  292    HD2  PRO  33          1HD       PRO  33   1.606 -10.455  -2.687
  293    HD3  PRO  33          2HD       PRO  33   3.123  -9.647  -3.104
  294    H    VAL  34           H        VAL  34   2.989  -8.355   2.422
  295    HA   VAL  34           HA       VAL  34   1.128 -10.472   3.254
  296    HB   VAL  34           HB       VAL  34   2.263 -10.383   5.454
  297   HG11  VAL  34          1HG1      VAL  34   4.446 -11.334   4.783
  298   HG12  VAL  34          2HG1      VAL  34   3.134 -11.947   3.748
  299   HG13  VAL  34          3HG1      VAL  34   4.226 -10.678   3.144
  300   HG21  VAL  34          1HG2      VAL  34   4.303  -9.077   5.770
  301   HG22  VAL  34          2HG2      VAL  34   4.079  -8.341   4.165
  302   HG23  VAL  34          3HG2      VAL  34   2.890  -8.044   5.456
  303    H    LYS  35           H        LYS  35   2.002  -7.033   3.318
  304    HA   LYS  35           HA       LYS  35  -0.677  -6.486   4.278
  305    HB2  LYS  35          1HB       LYS  35   1.881  -5.648   5.638
  306    HB3  LYS  35          2HB       LYS  35   0.412  -4.651   5.748
  307    HG2  LYS  35          1HG       LYS  35  -0.726  -6.850   6.559
  308    HG3  LYS  35          2HG       LYS  35   0.938  -7.401   6.868
  309    HD2  LYS  35          1HD       LYS  35   0.254  -6.473   8.918
  310    HD3  LYS  35          2HD       LYS  35   1.234  -5.196   8.161
  311    HE2  LYS  35          1HE       LYS  35  -0.736  -4.016   7.443
  312    HE3  LYS  35          2HE       LYS  35  -1.785  -5.356   7.960
  313    HZ1  LYS  35          1HZ       LYS  35  -1.784  -3.561   9.555
  314    HZ2  LYS  35          2HZ       LYS  35  -1.123  -4.915  10.227
  315    HZ3  LYS  35          3HZ       LYS  35  -0.150  -3.672   9.747
  316    H    ARG  36           H        ARG  36  -1.466  -4.433   3.578
  317    HA   ARG  36           HA       ARG  36   0.458  -2.878   2.064
  318    HB2  ARG  36          1HB       ARG  36  -2.362  -3.625   1.168
  319    HB3  ARG  36          2HB       ARG  36  -1.346  -2.430   0.340
  320    HG2  ARG  36          1HG       ARG  36  -0.814  -4.290  -0.911
  321    HG3  ARG  36          2HG       ARG  36   0.400  -4.485   0.366
  322    HD2  ARG  36          1HD       ARG  36  -0.636  -6.621   0.154
  323    HD3  ARG  36          2HD       ARG  36  -1.380  -5.914   1.597
  324    HE   ARG  36           HE       ARG  36  -3.088  -5.124  -0.400
  325   HH11  ARG  36          1HH1      ARG  36  -4.890  -8.021  -1.090
  326   HH12  ARG  36          2HH1      ARG  36  -4.858  -6.272  -1.184
  327   HH21  ARG  36          1HH2      ARG  36  -3.104  -9.169  -0.154
  328   HH22  ARG  36          2HH2      ARG  36  -1.740  -8.288   0.450
  329    H    GLY  37           H        GLY  37  -0.544  -0.579   1.570
  330    HA2  GLY  37          1HA       GLY  37  -2.703   0.399   3.076
  331    HA3  GLY  37          2HA       GLY  37  -1.237   0.614   4.013
  332    H    CYS  38           H        CYS  38  -1.886   2.980   3.664
  333    HA   CYS  38           HA       CYS  38  -1.079   3.874   0.995
  334    HB2  CYS  38          1HB       CYS  38  -2.779   5.030   3.329
  335    HB3  CYS  38          2HB       CYS  38  -2.537   5.891   1.789
  336    HG   CYS  38           HG       CYS  38  -4.963   5.039   1.959
  337    H    ILE  39           H        ILE  39   0.406   5.728   0.893
  338    HA   ILE  39           HA       ILE  39   1.214   6.962   3.339
  339    HB   ILE  39           HB       ILE  39   2.702   4.882   3.205
  340   HG12  ILE  39          1HG1      ILE  39   4.321   7.373   2.890
  341   HG13  ILE  39          2HG1      ILE  39   3.213   7.155   4.265
  342   HG21  ILE  39          1HG2      ILE  39   4.521   4.932   1.532
  343   HG22  ILE  39          2HG2      ILE  39   2.930   4.822   0.744
  344   HG23  ILE  39          3HG2      ILE  39   3.796   6.376   0.786
  345   HD11  ILE  39          1HD1      ILE  39   5.511   6.496   4.860
  346   HD12  ILE  39          2HD1      ILE  39   4.411   5.098   4.904
  347   HD13  ILE  39          3HD1      ILE  39   5.519   5.318   3.529
  348    H    ASP  40           H        ASP  40   2.748   8.815   2.871
  349    HA   ASP  40           HA       ASP  40   1.940   9.955   0.371
  350    HB2  ASP  40          1HB       ASP  40   2.981  12.077   1.347
  351    HB3  ASP  40          2HB       ASP  40   1.690  11.212   2.218
  352    HD2  ASP  40           HD       ASP  40   4.526  12.075   4.436
  353    H    VAL  41           H        VAL  41   4.957   9.130   2.219
  354    HA   VAL  41           HA       VAL  41   6.445   9.348  -0.308
  355    HB   VAL  41           HB       VAL  41   7.429   9.644   2.572
  356   HG11  VAL  41          1HG1      VAL  41   9.590  10.249   1.531
  357   HG12  VAL  41          2HG1      VAL  41   9.110   8.592   1.094
  358   HG13  VAL  41          3HG1      VAL  41   8.907   9.916  -0.078
  359   HG21  VAL  41          1HG2      VAL  41   7.877  11.970   1.969
  360   HG22  VAL  41          2HG2      VAL  41   7.133  11.699   0.375
  361   HG23  VAL  41          3HG2      VAL  41   6.147  11.569   1.852
  362    H    CYS  42           H        CYS  42   7.473   7.534  -1.062
  363    HA   CYS  42           HA       CYS  42   6.572   5.109   0.047
  364    HB2  CYS  42          1HB       CYS  42   6.880   5.466  -2.348
  365    HB3  CYS  42          2HB       CYS  42   8.625   5.610  -2.117
  366    HG   CYS  42           HG       CYS  42   8.070   3.310  -3.270
  367    HA   PRO  43           HA       PRO  43   9.880   4.737   2.884
  368    HB2  PRO  43          1HB       PRO  43   9.249   2.332   4.013
  369    HB3  PRO  43          2HB       PRO  43   8.332   3.791   4.417
  370    HG2  PRO  43          1HG       PRO  43   7.695   1.641   2.374
  371    HG3  PRO  43          2HG       PRO  43   6.617   2.423   3.537
  372    HD2  PRO  43          1HD       PRO  43   6.695   3.209   0.910
  373    HD3  PRO  43          2HD       PRO  43   6.370   4.369   2.204
  374    H    LYS  44           H        LYS  44  11.973   4.045   2.951
  375    HA   LYS  44           HA       LYS  44  12.778   2.617   0.641
  376    HB2  LYS  44          1HB       LYS  44  14.204   3.400   3.201
  377    HB3  LYS  44          2HB       LYS  44  15.007   2.656   1.797
  378    HG2  LYS  44          1HG       LYS  44  14.382   4.589   0.410
  379    HG3  LYS  44          2HG       LYS  44  13.570   5.332   1.808
  380    HD2  LYS  44          1HD       LYS  44  15.695   5.436   3.017
  381    HD3  LYS  44          2HD       LYS  44  16.523   4.634   1.659
  382    HE2  LYS  44          1HE       LYS  44  15.944   6.517   0.191
  383    HE3  LYS  44          2HE       LYS  44  15.110   7.318   1.543
  384    HZ1  LYS  44          1HZ       LYS  44  17.331   8.177   1.235
  385    HZ2  LYS  44          2HZ       LYS  44  17.215   7.421   2.696
  386    HZ3  LYS  44          3HZ       LYS  44  17.989   6.678   1.442
  387    H    ASN  45           H        ASN  45  14.105   0.577   0.714
  388    HA   ASN  45           HA       ASN  45  12.437  -1.335   1.929
  389    HB2  ASN  45          1HB       ASN  45  15.007  -1.888   0.272
  390    HB3  ASN  45          2HB       ASN  45  13.789  -2.879   1.112
  391   HD21  ASN  45          1HD2      ASN  45  13.076  -2.135  -2.582
  392   HD22  ASN  45          2HD2      ASN  45  14.578  -2.441  -1.775
  393    H    SER  46           H        SER  46  12.979  -2.804   3.672
  394    HA   SER  46           HA       SER  46  15.383  -2.042   5.125
  395    HB2  SER  46          1HB       SER  46  14.275  -2.929   7.107
  396    HB3  SER  46          2HB       SER  46  13.231  -1.738   6.299
  397    HG   SER  46           HG       SER  46  12.087  -3.486   5.389
  398    H    LEU  47           H        LEU  47  16.094  -4.116   6.614
  399    HA   LEU  47           HA       LEU  47  16.941  -6.027   4.670
  400    HB2  LEU  47          1HB       LEU  47  17.162  -5.762   7.602
  401    HB3  LEU  47          2HB       LEU  47  18.068  -7.053   6.780
  402    HG   LEU  47           HG       LEU  47  18.444  -4.055   6.407
  403   HD11  LEU  47          1HD1      LEU  47  20.694  -4.478   7.433
  404   HD12  LEU  47          2HD1      LEU  47  19.381  -4.926   8.547
  405   HD13  LEU  47          3HD1      LEU  47  20.257  -6.189   7.648
  406   HD21  LEU  47          1HD2      LEU  47  20.355  -4.673   4.968
  407   HD22  LEU  47          2HD2      LEU  47  19.904  -6.387   5.135
  408   HD23  LEU  47          3HD2      LEU  47  18.799  -5.251   4.328
  409    H    LEU  48           H        LEU  48  14.325  -5.726   7.000
  410    HA   LEU  48           HA       LEU  48  13.981  -8.610   7.115
  411    HB2  LEU  48          1HB       LEU  48  12.640  -6.276   8.334
  412    HB3  LEU  48          2HB       LEU  48  12.126  -7.917   8.788
  413    HG   LEU  48           HG       LEU  48  14.838  -6.640   9.313
  414   HD11  LEU  48          1HD1      LEU  48  14.179  -6.892  11.721
  415   HD12  LEU  48          2HD1      LEU  48  13.025  -5.864  10.839
  416   HD13  LEU  48          3HD1      LEU  48  12.610  -7.556  11.207
  417   HD21  LEU  48          1HD2      LEU  48  15.379  -8.724  10.526
  418   HD22  LEU  48          2HD2      LEU  48  13.834  -9.422   9.981
  419   HD23  LEU  48          3HD2      LEU  48  15.087  -8.995   8.792
  420    H    VAL  49           H        VAL  49  12.193  -5.618   6.124
  421    HA   VAL  49           HA       VAL  49  10.461  -7.376   4.530
  422    HB   VAL  49           HB       VAL  49   8.634  -5.688   4.954
  423   HG11  VAL  49          1HG1      VAL  49   8.122  -6.439   7.253
  424   HG12  VAL  49          2HG1      VAL  49   8.739  -7.783   6.263
  425   HG13  VAL  49          3HG1      VAL  49   9.803  -6.989   7.448
  426   HG21  VAL  49          1HG2      VAL  49   8.864  -4.127   6.819
  427   HG22  VAL  49          2HG2      VAL  49  10.572  -4.594   6.998
  428   HG23  VAL  49          3HG2      VAL  49  10.021  -3.783   5.513
  429    H    LYS  50           H        LYS  50   9.820  -6.560   2.477
  430    HA   LYS  50           HA       LYS  50  11.468  -4.300   1.605
  431    HB2  LYS  50          1HB       LYS  50  11.849  -6.408   0.435
  432    HB3  LYS  50          2HB       LYS  50  10.109  -6.550   0.090
  433    HG2  LYS  50          1HG       LYS  50  10.233  -4.518  -1.310
  434    HG3  LYS  50          2HG       LYS  50  11.980  -4.414  -0.987
  435    HD2  LYS  50          1HD       LYS  50  12.313  -6.608  -2.045
  436    HD3  LYS  50          2HD       LYS  50  10.565  -6.726  -2.356
  437    HE2  LYS  50          1HE       LYS  50  10.698  -4.676  -3.738
  438    HE3  LYS  50          2HE       LYS  50  12.456  -4.633  -3.472
  439    HZ1  LYS  50          1HZ       LYS  50  11.899  -5.659  -5.570
  440    HZ2  LYS  50          2HZ       LYS  50  12.609  -6.764  -4.571
  441    HZ3  LYS  50          3HZ       LYS  50  10.978  -6.803  -4.818
  442    H    TYR  51           H        TYR  51  10.532  -2.573   0.421
  443    HA   TYR  51           HA       TYR  51   7.607  -2.448   0.721
  444    HB2  TYR  51          1HB       TYR  51   9.712  -0.290   0.883
  445    HB3  TYR  51          2HB       TYR  51   7.956   0.002   0.854
  446    HD1  TYR  51          1HD       TYR  51  10.788  -1.169   2.874
  447    HD2  TYR  51          2HD       TYR  51   6.564  -0.604   2.784
  448    HE1  TYR  51          1HE       TYR  51  10.705  -1.461   5.333
  449    HE2  TYR  51          2HE       TYR  51   6.461  -0.892   5.236
  450    HH   TYR  51           HH       TYR  51   9.391  -1.516   7.184
  451    H    VAL  52           H        VAL  52   6.461  -2.315  -1.147
  452    HA   VAL  52           HA       VAL  52   7.784  -0.946  -3.384
  453    HB   VAL  52           HB       VAL  52   5.842  -3.300  -3.531
  454   HG11  VAL  52          1HG1      VAL  52   6.257  -3.187  -5.966
  455   HG12  VAL  52          2HG1      VAL  52   5.533  -1.676  -5.368
  456   HG13  VAL  52          3HG1      VAL  52   7.275  -1.748  -5.724
  457   HG21  VAL  52          1HG2      VAL  52   7.712  -4.537  -4.502
  458   HG22  VAL  52          2HG2      VAL  52   8.782  -3.146  -4.209
  459   HG23  VAL  52          3HG2      VAL  52   8.051  -4.013  -2.836
  460    H    CYS  53           H        CYS  53   6.689   0.806  -4.145
  461    HA   CYS  53           HA       CYS  53   3.945   1.100  -3.157
  462    HB2  CYS  53          1HB       CYS  53   5.828   3.360  -3.801
  463    HB3  CYS  53          2HB       CYS  53   4.270   3.444  -2.974
  464    HG   CYS  53           HG       CYS  53   6.204   4.002  -1.277
  465    H    CYS  54           H        CYS  54   2.546   2.473  -4.665
  466    HA   CYS  54           HA       CYS  54   3.564   2.864  -7.314
  467    HB2  CYS  54          1HB       CYS  54   1.546   1.610  -8.287
  468    HB3  CYS  54          2HB       CYS  54   2.983   0.696  -7.818
  469    HG   CYS  54           HG       CYS  54   0.823  -0.719  -7.298
  470    H    ASN  55           H        ASN  55   2.014   4.268  -8.567
  471    HA   ASN  55           HA       ASN  55   0.856   5.942  -6.497
  472    HB2  ASN  55          1HB       ASN  55   1.620   7.923  -7.899
  473    HB3  ASN  55          2HB       ASN  55   2.712   6.570  -7.520
  474   HD21  ASN  55          1HD2      ASN  55   3.095   7.696 -11.068
  475   HD22  ASN  55          2HD2      ASN  55   3.088   8.517  -9.543
  476    H    THR  56           H        THR  56  -0.583   3.715  -7.898
  477    HA   THR  56           HA       THR  56  -2.734   5.360  -9.035
  478    HB   THR  56           HB       THR  56  -3.206   3.502 -10.646
  479    HG1  THR  56          1HG       THR  56  -1.532   1.907 -10.913
  480   HG21  THR  56          1HG2      THR  56  -1.328   3.923 -12.194
  481   HG22  THR  56          2HG2      THR  56  -1.849   5.427 -11.395
  482   HG23  THR  56          3HG2      THR  56  -0.372   4.595 -10.852
  483    H    ASP  57           H        ASP  57  -4.821   3.895  -9.201
  484    HA   ASP  57           HA       ASP  57  -5.253   3.422  -6.446
  485    HB2  ASP  57          1HB       ASP  57  -7.142   3.372  -8.860
  486    HB3  ASP  57          2HB       ASP  57  -7.509   2.918  -7.176
  487    HD2  ASP  57           HD       ASP  57  -7.459   6.691  -8.089
  488    H    ARG  58           H        ARG  58  -5.486   1.382  -5.422
  489    HA   ARG  58           HA       ARG  58  -5.608  -0.759  -5.133
  490    HB2  ARG  58          1HB       ARG  58  -7.155  -0.662  -7.762
  491    HB3  ARG  58          2HB       ARG  58  -7.131  -2.069  -6.686
  492    HG2  ARG  58          1HG       ARG  58  -8.314  -0.931  -4.989
  493    HG3  ARG  58          2HG       ARG  58  -7.932   0.669  -5.649
  494    HD2  ARG  58          1HD       ARG  58  -9.636  -1.362  -7.141
  495    HD3  ARG  58          2HD       ARG  58 -10.341  -0.197  -6.011
  496    HE   ARG  58           HE       ARG  58  -8.763   1.344  -7.714
  497   HH11  ARG  58          1HH1      ARG  58 -10.914   1.730 -10.420
  498   HH12  ARG  58          2HH1      ARG  58  -9.512   2.353  -9.579
  499   HH21  ARG  58          1HH2      ARG  58 -12.016  -0.147  -9.616
  500   HH22  ARG  58          2HH2      ARG  58 -11.443  -0.926  -8.179
  501    H    CYS  59           H        CYS  59  -3.243   0.238  -6.542
  502    HA   CYS  59           HA       CYS  59  -2.717  -1.638  -8.654
  503    HB2  CYS  59          1HB       CYS  59  -0.552  -0.208  -8.608
  504    HB3  CYS  59          2HB       CYS  59  -1.995   0.832  -8.551
  505    HG   CYS  59           HG       CYS  59  -0.112   1.846  -7.114
  506    H    ASN  60           H        ASN  60  -2.122  -1.168  -5.176
  507    HA   ASN  60           HA       ASN  60  -0.570  -3.622  -5.190
  508    HB2  ASN  60          1HB       ASN  60  -0.068  -3.078  -2.827
  509    HB3  ASN  60          2HB       ASN  60   0.326  -1.695  -3.858
  510   HD21  ASN  60          1HD2      ASN  60  -0.005  -1.329  -1.207
  511   HD22  ASN  60          2HD2      ASN  60  -1.468  -0.470  -0.855
  Start of MODEL   17
    1    H1   MET   0          1H        MET   0  -8.194  10.503   0.107
    2    H2   MET   0          2H        MET   0  -9.107  11.098  -0.924
    3    H    MET   0           H        MET   0  -9.107   9.593  -0.695
    4    H3   MET   0          3H        MET   0  -9.115   9.618  -0.677
    5    HA   MET   0           HA       MET   0  -7.593  10.964  -2.587
    6    HB2  MET   0          1HB       MET   0  -5.933   9.545  -0.489
    7    HB3  MET   0          2HB       MET   0  -5.311  10.181  -2.031
    8    HG2  MET   0          1HG       MET   0  -6.609  11.874   0.123
    9    HG3  MET   0          2HG       MET   0  -4.852  11.637  -0.038
   10    HE1  MET   0          1HE       MET   0  -5.723  15.370  -1.280
   11    HE2  MET   0          2HE       MET   0  -6.682  14.441  -0.101
   12    HE3  MET   0          3HE       MET   0  -4.904  14.422  -0.016
   13    H    LEU   1           H        LEU   1  -5.509   8.683  -2.781
   14    HA   LEU   1           HA       LEU   1  -7.058   7.209  -4.595
   15    HB2  LEU   1          1HB       LEU   1  -4.400   7.285  -3.482
   16    HB3  LEU   1          2HB       LEU   1  -4.746   5.695  -4.201
   17    HG   LEU   1           HG       LEU   1  -5.422   7.002  -6.313
   18   HD11  LEU   1          1HD1      LEU   1  -4.294   9.229  -6.563
   19   HD12  LEU   1          2HD1      LEU   1  -5.488   9.253  -5.244
   20   HD13  LEU   1          3HD1      LEU   1  -3.752   9.126  -4.870
   21   HD21  LEU   1          1HD2      LEU   1  -3.085   7.115  -7.108
   22   HD22  LEU   1          2HD2      LEU   1  -2.524   6.965  -5.424
   23   HD23  LEU   1          3HD2      LEU   1  -3.425   5.632  -6.184
   24    H    LYS   2           H        LYS   2  -6.715   4.594  -4.470
   25    HA   LYS   2           HA       LYS   2  -7.672   3.833  -1.800
   26    HB2  LYS   2          1HB       LYS   2  -8.417   2.547  -4.435
   27    HB3  LYS   2          2HB       LYS   2  -9.117   2.227  -2.831
   28    HG2  LYS   2          1HG       LYS   2  -9.368   4.842  -4.357
   29    HG3  LYS   2          2HG       LYS   2 -10.612   3.570  -4.303
   30    HD2  LYS   2          1HD       LYS   2 -10.722   3.806  -1.841
   31    HD3  LYS   2          2HD       LYS   2  -9.515   5.112  -1.926
   32    HE2  LYS   2          1HE       LYS   2 -12.255   5.124  -3.230
   33    HE3  LYS   2          2HE       LYS   2 -11.801   6.000  -1.750
   34    HZ1  LYS   2          1HZ       LYS   2 -11.735   7.424  -3.683
   35    HZ2  LYS   2          2HZ       LYS   2 -10.218   7.252  -3.054
   36    HZ3  LYS   2          3HZ       LYS   2 -10.640   6.438  -4.426
   37    H    CYS   3           H        CYS   3  -6.717   2.054  -0.846
   38    HA   CYS   3           HA       CYS   3  -4.689   0.722  -2.493
   39    HB2  CYS   3          1HB       CYS   3  -4.601   1.265   0.478
   40    HB3  CYS   3          2HB       CYS   3  -3.386   0.381  -0.448
   41    HG   CYS   3           HG       CYS   3  -2.438   2.740   0.234
   42    H    ASN   4           H        ASN   4  -4.466  -1.606  -2.114
   43    HA   ASN   4           HA       ASN   4  -7.016  -2.735  -1.617
   44    HB2  ASN   4          1HB       ASN   4  -4.401  -4.162  -2.497
   45    HB3  ASN   4          2HB       ASN   4  -6.000  -4.732  -1.959
   46   HD21  ASN   4          1HD2      ASN   4  -5.654  -4.202  -5.723
   47   HD22  ASN   4          2HD2      ASN   4  -4.538  -4.845  -4.564
   48    H    LYS   5           H        LYS   5  -7.446  -4.433   0.029
   49    HA   LYS   5           HA       LYS   5  -5.453  -4.591   2.163
   50    HB2  LYS   5          1HB       LYS   5  -8.410  -3.994   2.485
   51    HB3  LYS   5          2HB       LYS   5  -7.294  -4.383   3.815
   52    HG2  LYS   5          1HG       LYS   5  -6.936  -2.001   1.973
   53    HG3  LYS   5          2HG       LYS   5  -7.825  -1.922   3.512
   54    HD2  LYS   5          1HD       LYS   5  -5.827  -2.642   4.728
   55    HD3  LYS   5          2HD       LYS   5  -4.934  -2.796   3.197
   56    HE2  LYS   5          1HE       LYS   5  -4.907  -0.477   2.836
   57    HE3  LYS   5          2HE       LYS   5  -6.221  -0.191   4.000
   58    HZ1  LYS   5          1HZ       LYS   5  -4.089   0.463   4.889
   59    HZ2  LYS   5          2HZ       LYS   5  -4.705  -0.793   5.763
   60    HZ3  LYS   5          3HZ       LYS   5  -3.486  -1.058   4.683
   61    H    LEU   6           H        LEU   6  -8.871  -5.707   2.066
   62    HA   LEU   6           HA       LEU   6  -7.902  -8.411   2.415
   63    HB2  LEU   6          1HB       LEU   6  -9.576  -7.584   3.772
   64    HB3  LEU   6          2HB       LEU   6 -10.708  -7.154   2.471
   65    HG   LEU   6           HG       LEU   6 -10.734  -9.626   1.857
   66   HD11  LEU   6          1HD1      LEU   6 -10.099 -11.208   3.696
   67   HD12  LEU   6          2HD1      LEU   6  -8.693 -10.275   3.132
   68   HD13  LEU   6          3HD1      LEU   6  -9.502  -9.832   4.653
   69   HD21  LEU   6          1HD2      LEU   6 -12.378 -10.197   3.610
   70   HD22  LEU   6          2HD2      LEU   6 -11.826  -8.796   4.560
   71   HD23  LEU   6          3HD2      LEU   6 -12.597  -8.549   2.975
   72    H    VAL   7           H        VAL   7  -7.928 -10.007   0.883
   73    HA   VAL   7           HA       VAL   7  -8.237  -9.302  -1.810
   74    HB   VAL   7           HB       VAL   7  -8.110 -11.771  -2.212
   75   HG11  VAL   7          1HG1      VAL   7  -5.893 -12.131  -1.179
   76   HG12  VAL   7          2HG1      VAL   7  -6.033 -10.484  -1.838
   77   HG13  VAL   7          3HG1      VAL   7  -6.180 -10.756  -0.085
   78   HG21  VAL   7          1HG2      VAL   7  -7.886 -13.305  -0.324
   79   HG22  VAL   7          2HG2      VAL   7  -8.244 -11.974   0.801
   80   HG23  VAL   7          3HG2      VAL   7  -9.481 -12.517  -0.359
   81    HA   PRO   8           HA       PRO   8  -8.645 -10.473  -3.427
   82    HB2  PRO   8          1HB       PRO   8  -9.797 -10.253  -5.853
   83    HB3  PRO   8          2HB       PRO   8  -9.949 -11.771  -4.956
   84    HG2  PRO   8          1HG       PRO   8 -11.915  -9.475  -5.171
   85    HG3  PRO   8          2HG       PRO   8 -12.224 -11.215  -5.221
   86    HD2  PRO   8          1HD       PRO   8 -12.559  -9.670  -2.924
   87    HD3  PRO   8          2HD       PRO   8 -12.229 -11.407  -2.880
   88    H    ILE   9           H        ILE   9 -11.119  -7.995  -3.594
   89    HA   ILE   9           HA       ILE   9  -9.084  -6.265  -4.819
   90    HB   ILE   9           HB       ILE   9 -12.120  -6.280  -5.197
   91   HG12  ILE   9          1HG1      ILE   9 -11.083  -8.107  -6.329
   92   HG13  ILE   9          2HG1      ILE   9 -11.658  -6.883  -7.484
   93   HG21  ILE   9          1HG2      ILE   9 -11.700  -4.511  -6.872
   94   HG22  ILE   9          2HG2      ILE   9 -11.172  -3.997  -5.253
   95   HG23  ILE   9          3HG2      ILE   9  -9.970  -4.525  -6.454
   96   HD11  ILE   9          1HD1      ILE   9  -9.462  -7.779  -8.153
   97   HD12  ILE   9          2HD1      ILE   9  -9.353  -6.049  -7.746
   98   HD13  ILE   9          3HD1      ILE   9  -8.780  -7.274  -6.591
   99    H    ALA  10           H        ALA  10 -11.239  -6.843  -2.156
  100    HA   ALA  10           HA       ALA  10 -12.338  -4.468  -1.570
  101    HB1  ALA  10          1HB       ALA  10 -11.851  -6.898  -0.262
  102    HB2  ALA  10          2HB       ALA  10 -11.162  -5.666   0.821
  103    HB3  ALA  10          3HB       ALA  10 -12.869  -5.559   0.326
  104    H    TYR  11           H        TYR  11 -11.733  -2.460  -0.751
  105    HA   TYR  11           HA       TYR  11  -8.865  -2.070  -0.312
  106    HB2  TYR  11          1HB       TYR  11  -8.911  -0.133  -1.807
  107    HB3  TYR  11          2HB       TYR  11  -9.174  -1.682  -2.645
  108    HD1  TYR  11          1HD       TYR  11 -10.737   1.491  -1.600
  109    HD2  TYR  11          2HD       TYR  11 -11.311  -2.183  -3.687
  110    HE1  TYR  11          1HE       TYR  11 -12.821   2.390  -2.594
  111    HE2  TYR  11          2HE       TYR  11 -13.392  -1.302  -4.688
  112    HH   TYR  11           HH       TYR  11 -14.819   0.467  -4.837
  113    H    LYS  12           H        LYS  12  -8.384   0.125   0.609
  114    HA   LYS  12           HA       LYS  12 -10.740   1.256   1.945
  115    HB2  LYS  12          1HB       LYS  12  -7.966   0.674   2.984
  116    HB3  LYS  12          2HB       LYS  12  -9.010   1.902   3.738
  117    HG2  LYS  12          1HG       LYS  12 -10.720   0.159   4.159
  118    HG3  LYS  12          2HG       LYS  12  -9.628  -1.059   3.459
  119    HD2  LYS  12          1HD       LYS  12  -7.967  -0.601   5.197
  120    HD3  LYS  12          2HD       LYS  12  -9.011   0.666   5.881
  121    HE2  LYS  12          1HE       LYS  12 -10.756  -1.040   6.310
  122    HE3  LYS  12          2HE       LYS  12  -9.653  -2.294   5.696
  123    HZ1  LYS  12          1HZ       LYS  12  -9.603  -2.162   8.093
  124    HZ2  LYS  12          2HZ       LYS  12  -8.135  -1.737   7.472
  125    HZ3  LYS  12          3HZ       LYS  12  -9.158  -0.575   8.042
  126    H    THR  13           H        THR  13 -10.510   3.592   2.479
  127    HA   THR  13           HA       THR  13  -9.327   4.867   0.157
  128    HB   THR  13           HB       THR  13 -11.043   5.976   2.435
  129    HG1  THR  13          1HG       THR  13 -12.699   5.870   0.805
  130   HG21  THR  13          1HG2      THR  13 -11.409   7.886   0.914
  131   HG22  THR  13          2HG2      THR  13  -9.682   7.702   1.307
  132   HG23  THR  13          3HG2      THR  13 -10.298   7.157  -0.271
  133    H    CYS  14           H        CYS  14  -7.504   6.037   0.101
  134    HA   CYS  14           HA       CYS  14  -5.841   6.006   2.374
  135    HB2  CYS  14          1HB       CYS  14  -5.617   7.407  -0.286
  136    HB3  CYS  14          2HB       CYS  14  -4.354   7.450   0.949
  137    HG   CYS  14           HG       CYS  14  -3.641   5.823  -0.992
  138    HA   PRO  15           HA       PRO  15  -7.145   9.801   4.110
  139    HB2  PRO  15          1HB       PRO  15  -5.174  10.351   5.877
  140    HB3  PRO  15          2HB       PRO  15  -6.243   8.971   6.163
  141    HG2  PRO  15          1HG       PRO  15  -3.490   9.016   4.876
  142    HG3  PRO  15          2HG       PRO  15  -4.124   7.911   6.104
  143    HD2  PRO  15          1HD       PRO  15  -4.061   7.243   3.429
  144    HD3  PRO  15          2HD       PRO  15  -5.305   6.615   4.518
  145    H    GLU  16           H        GLU  16  -6.927  12.089   4.096
  146    HA   GLU  16           HA       GLU  16  -5.593  13.058   1.908
  147    HB2  GLU  16          1HB       GLU  16  -7.384  14.228   3.080
  148    HB3  GLU  16          2HB       GLU  16  -6.343  14.423   4.511
  149    HG2  GLU  16          1HG       GLU  16  -4.827  15.942   3.149
  150    HG3  GLU  16          2HG       GLU  16  -5.926  15.597   1.794
  151    HE2  GLU  16           HE       GLU  16  -6.989  18.666   3.370
  152    H    GLY  17           H        GLY  17  -3.532  13.916   1.526
  153    HA2  GLY  17          1HA       GLY  17  -1.463  14.775   2.229
  154    HA3  GLY  17          2HA       GLY  17  -1.666  14.018   3.796
  155    H    LYS  18           H        LYS  18  -2.686  11.440   2.476
  156    HA   LYS  18           HA       LYS  18  -0.095  10.486   1.502
  157    HB2  LYS  18          1HB       LYS  18  -2.585   9.073   2.497
  158    HB3  LYS  18          2HB       LYS  18  -1.167   8.240   1.816
  159    HG2  LYS  18          1HG       LYS  18   0.215   9.298   3.644
  160    HG3  LYS  18          2HG       LYS  18  -1.306   9.866   4.372
  161    HD2  LYS  18          1HD       LYS  18  -2.051   7.670   4.811
  162    HD3  LYS  18          2HD       LYS  18  -0.856   6.954   3.704
  163    HE2  LYS  18          1HE       LYS  18   0.950   7.777   5.234
  164    HE3  LYS  18          2HE       LYS  18  -0.318   8.286   6.373
  165    HZ1  LYS  18          1HZ       LYS  18   0.556   6.120   6.928
  166    HZ2  LYS  18          2HZ       LYS  18  -1.033   5.997   6.503
  167    HZ3  LYS  18          3HZ       LYS  18   0.143   5.525   5.446
  168    H    ASN  19           H        ASN  19  -0.067   9.072  -0.420
  169    HA   ASN  19           HA       ASN  19  -2.270   9.718  -2.203
  170    HB2  ASN  19          1HB       ASN  19  -0.269  11.421  -2.623
  171    HB3  ASN  19          2HB       ASN  19   0.510   9.832  -2.822
  172   HD21  ASN  19          1HD2      ASN  19  -1.584  11.566  -5.823
  173   HD22  ASN  19          2HD2      ASN  19  -1.452  12.271  -4.247
  174    H    LEU  20           H        LEU  20   0.778   7.852  -1.535
  175    HA   LEU  20           HA       LEU  20   0.298   6.252  -3.897
  176    HB2  LEU  20          1HB       LEU  20   2.422   6.176  -1.845
  177    HB3  LEU  20          2HB       LEU  20   2.623   5.415  -3.440
  178    HG   LEU  20           HG       LEU  20   2.489   8.390  -2.820
  179   HD11  LEU  20          1HD1      LEU  20   4.812   8.395  -3.770
  180   HD12  LEU  20          2HD1      LEU  20   4.692   7.316  -2.360
  181   HD13  LEU  20          3HD1      LEU  20   4.702   6.635  -4.004
  182   HD21  LEU  20          1HD2      LEU  20   2.827   8.743  -5.241
  183   HD22  LEU  20          2HD2      LEU  20   2.674   6.988  -5.501
  184   HD23  LEU  20          3HD2      LEU  20   1.292   7.920  -4.875
  185    H    CYS  21           H        CYS  21   0.346   3.879  -3.838
  186    HA   CYS  21           HA       CYS  21  -0.586   2.872  -1.251
  187    HB2  CYS  21          1HB       CYS  21  -1.155   1.956  -4.065
  188    HB3  CYS  21          2HB       CYS  21  -1.520   0.971  -2.646
  189    HG   CYS  21           HG       CYS  21  -3.741   2.025  -3.585
  190    H    TYR  22           H        TYR  22   0.633   1.238  -0.274
  191    HA   TYR  22           HA       TYR  22   2.937   0.272  -1.833
  192    HB2  TYR  22          1HB       TYR  22   4.306   0.460   0.062
  193    HB3  TYR  22          2HB       TYR  22   3.452   2.012  -0.118
  194    HD1  TYR  22          1HD       TYR  22   3.759  -1.047   1.923
  195    HD2  TYR  22          2HD       TYR  22   1.828   2.735   1.533
  196    HE1  TYR  22          1HE       TYR  22   2.951  -1.229   4.258
  197    HE2  TYR  22          2HE       TYR  22   1.013   2.569   3.861
  198    HH   TYR  22           HH       TYR  22   0.962   1.321   5.765
  199    H    LYS  23           H        LYS  23   3.760  -1.867  -1.206
  200    HA   LYS  23           HA       LYS  23   2.034  -3.299   0.674
  201    HB2  LYS  23          1HB       LYS  23   2.305  -5.325  -0.701
  202    HB3  LYS  23          2HB       LYS  23   1.395  -4.045  -1.537
  203    HG2  LYS  23          1HG       LYS  23   3.341  -3.476  -2.879
  204    HG3  LYS  23          2HG       LYS  23   4.337  -4.648  -1.982
  205    HD2  LYS  23          1HD       LYS  23   3.534  -5.452  -4.231
  206    HD3  LYS  23          2HD       LYS  23   3.099  -6.500  -2.860
  207    HE2  LYS  23          1HE       LYS  23   0.859  -5.539  -2.801
  208    HE3  LYS  23          2HE       LYS  23   1.283  -4.420  -4.117
  209    HZ1  LYS  23          1HZ       LYS  23   0.069  -6.326  -4.928
  210    HZ2  LYS  23          2HZ       LYS  23   1.598  -6.325  -5.547
  211    HZ3  LYS  23          3HZ       LYS  23   1.203  -7.362  -4.327
  212    H    MET  24           H        MET  24   3.126  -4.809   2.011
  213    HA   MET  24           HA       MET  24   6.018  -4.463   1.898
  214    HB2  MET  24          1HB       MET  24   4.128  -5.080   4.179
  215    HB3  MET  24          2HB       MET  24   5.903  -5.122   4.325
  216    HG2  MET  24          1HG       MET  24   5.883  -2.699   3.550
  217    HG3  MET  24          2HG       MET  24   4.120  -2.735   3.792
  218    HE1  MET  24          1HE       MET  24   3.708  -3.144   7.613
  219    HE2  MET  24          2HE       MET  24   2.927  -2.715   6.070
  220    HE3  MET  24          3HE       MET  24   3.559  -4.361   6.322
  221    H    PHE  25           H        PHE  25   7.364  -6.268   1.771
  222    HA   PHE  25           HA       PHE  25   6.026  -8.869   2.013
  223    HB2  PHE  25          1HB       PHE  25   8.622  -7.940   0.659
  224    HB3  PHE  25          2HB       PHE  25   8.061  -9.613   0.657
  225    HD1  PHE  25          1HD       PHE  25   7.319  -6.211  -0.546
  226    HD2  PHE  25          2HD       PHE  25   6.434 -10.339  -0.908
  227    HE1  PHE  25          1HE       PHE  25   6.015  -5.747  -2.651
  228    HE2  PHE  25          2HE       PHE  25   5.134  -9.882  -3.006
  229    HZ   PHE  25           HZ       PHE  25   4.939  -7.592  -3.852
  230    H    MET  26           H        MET  26   7.474 -10.660   2.941
  231    HA   MET  26           HA       MET  26   9.549  -9.512   4.646
  232    HB2  MET  26          1HB       MET  26   7.998 -12.103   4.853
  233    HB3  MET  26          2HB       MET  26   9.373 -11.674   5.898
  234    HG2  MET  26          1HG       MET  26   8.129  -9.731   6.740
  235    HG3  MET  26          2HG       MET  26   6.755 -10.155   5.692
  236    HE1  MET  26          1HE       MET  26   5.416 -10.994   9.308
  237    HE2  MET  26          2HE       MET  26   6.505  -9.659   8.856
  238    HE3  MET  26          3HE       MET  26   5.126 -10.077   7.810
  239    H    MET  27           H        MET  27  11.660 -10.494   4.640
  240    HA   MET  27           HA       MET  27  12.560 -10.970   2.143
  241    HB2  MET  27          1HB       MET  27  13.604 -11.667   4.875
  242    HB3  MET  27          2HB       MET  27  14.536 -12.078   3.415
  243    HG2  MET  27          1HG       MET  27  13.657  -9.299   4.260
  244    HG3  MET  27          2HG       MET  27  15.301  -9.965   4.409
  245    HE1  MET  27          1HE       MET  27  16.485 -10.261   0.719
  246    HE2  MET  27          2HE       MET  27  16.951 -10.327   2.437
  247    HE3  MET  27          3HE       MET  27  15.814 -11.527   1.776
  248    H    SER  28           H        SER  28  11.285 -13.322   4.511
  249    HA   SER  28           HA       SER  28  12.057 -15.611   3.141
  250    HB2  SER  28          1HB       SER  28  11.234 -15.630   5.430
  251    HB3  SER  28          2HB       SER  28   9.645 -15.041   4.893
  252    HG   SER  28           HG       SER  28   9.685 -17.306   5.229
  253    H    ASP  29           H        ASP  29   8.781 -14.008   3.242
  254    HA   ASP  29           HA       ASP  29   8.133 -15.460   0.841
  255    HB2  ASP  29          1HB       ASP  29   6.528 -15.428   2.839
  256    HB3  ASP  29          2HB       ASP  29   6.509 -13.674   2.532
  257    HD2  ASP  29           HD       ASP  29   3.652 -15.186   0.866
  258    H    LEU  30           H        LEU  30   9.552 -14.115  -0.589
  259    HA   LEU  30           HA       LEU  30   8.910 -11.338  -0.887
  260    HB2  LEU  30          1HB       LEU  30  10.615 -13.378  -2.023
  261    HB3  LEU  30          2HB       LEU  30  10.323 -12.051  -3.170
  262    HG   LEU  30           HG       LEU  30  11.721 -10.647  -2.085
  263   HD11  LEU  30          1HD1      LEU  30  11.810 -10.438   0.414
  264   HD12  LEU  30          2HD1      LEU  30  10.132 -10.405  -0.179
  265   HD13  LEU  30          3HD1      LEU  30  10.788 -11.887   0.555
  266   HD21  LEU  30          1HD2      LEU  30  13.540 -11.744  -0.823
  267   HD22  LEU  30          2HD2      LEU  30  12.549 -13.219  -0.712
  268   HD23  LEU  30          3HD2      LEU  30  13.096 -12.632  -2.300
  269    H    THR  31           H        THR  31   7.543 -14.355  -1.888
  270    HA   THR  31           HA       THR  31   6.751 -13.546  -4.504
  271    HB   THR  31           HB       THR  31   5.737 -15.790  -2.691
  272    HG1  THR  31          1HG       THR  31   7.177 -17.056  -4.010
  273   HG21  THR  31          1HG2      THR  31   4.924 -16.809  -4.789
  274   HG22  THR  31          2HG2      THR  31   4.156 -15.229  -4.505
  275   HG23  THR  31          3HG2      THR  31   5.469 -15.378  -5.695
  276    H    ILE  32           H        ILE  32   5.163 -13.631  -1.277
  277    HA   ILE  32           HA       ILE  32   2.938 -12.174  -2.518
  278    HB   ILE  32           HB       ILE  32   2.842 -14.413  -0.445
  279   HG12  ILE  32          1HG1      ILE  32   2.981 -15.131  -2.746
  280   HG13  ILE  32          2HG1      ILE  32   1.425 -15.541  -1.989
  281   HG21  ILE  32          1HG2      ILE  32   0.411 -13.983  -0.330
  282   HG22  ILE  32          2HG2      ILE  32   1.338 -12.569   0.222
  283   HG23  ILE  32          3HG2      ILE  32   0.609 -12.576  -1.401
  284   HD11  ILE  32          1HD1      ILE  32   1.108 -14.769  -4.306
  285   HD12  ILE  32          2HD1      ILE  32   0.358 -13.645  -3.146
  286   HD13  ILE  32          3HD1      ILE  32   1.915 -13.235  -3.905
  287    HA   PRO  33           HA       PRO  33   3.989  -9.356   0.637
  288    HB2  PRO  33          1HB       PRO  33   2.150  -7.419   0.131
  289    HB3  PRO  33          2HB       PRO  33   3.557  -7.614  -0.924
  290    HG2  PRO  33          1HG       PRO  33   0.745  -8.706  -1.272
  291    HG3  PRO  33          2HG       PRO  33   1.788  -7.924  -2.466
  292    HD2  PRO  33          1HD       PRO  33   1.552 -10.657  -2.337
  293    HD3  PRO  33          2HD       PRO  33   3.063  -9.887  -2.835
  294    H    VAL  34           H        VAL  34   3.031  -8.279   2.595
  295    HA   VAL  34           HA       VAL  34   1.247 -10.382   3.610
  296    HB   VAL  34           HB       VAL  34   2.408 -10.107   5.776
  297   HG11  VAL  34          1HG1      VAL  34   4.616 -11.019   5.141
  298   HG12  VAL  34          2HG1      VAL  34   3.318 -11.749   4.167
  299   HG13  VAL  34          3HG1      VAL  34   4.355 -10.484   3.464
  300   HG21  VAL  34          1HG2      VAL  34   4.400  -8.708   5.977
  301   HG22  VAL  34          2HG2      VAL  34   4.131  -8.091   4.330
  302   HG23  VAL  34          3HG2      VAL  34   2.946  -7.750   5.614
  303    H    LYS  35           H        LYS  35   1.975  -6.929   3.344
  304    HA   LYS  35           HA       LYS  35  -0.647  -6.374   4.439
  305    HB2  LYS  35          1HB       LYS  35   1.962  -5.355   5.560
  306    HB3  LYS  35          2HB       LYS  35   0.452  -4.428   5.724
  307    HG2  LYS  35          1HG       LYS  35  -0.515  -6.597   6.760
  308    HG3  LYS  35          2HG       LYS  35   1.184  -7.094   6.937
  309    HD2  LYS  35          1HD       LYS  35   0.636  -6.078   8.998
  310    HD3  LYS  35          2HD       LYS  35   1.559  -4.847   8.103
  311    HE2  LYS  35          1HE       LYS  35  -0.444  -3.678   7.493
  312    HE3  LYS  35          2HE       LYS  35  -1.467  -4.992   8.119
  313    HZ1  LYS  35          1HZ       LYS  35  -1.356  -3.145   9.649
  314    HZ2  LYS  35          2HZ       LYS  35  -0.662  -4.481  10.324
  315    HZ3  LYS  35          3HZ       LYS  35   0.286  -3.262   9.743
  316    H    ARG  36           H        ARG  36  -1.560  -4.448   3.602
  317    HA   ARG  36           HA       ARG  36   0.208  -2.897   1.919
  318    HB2  ARG  36          1HB       ARG  36  -2.441  -3.920   0.976
  319    HB3  ARG  36          2HB       ARG  36  -1.387  -2.767   0.125
  320    HG2  ARG  36          1HG       ARG  36  -0.795  -4.701  -0.954
  321    HG3  ARG  36          2HG       ARG  36   0.382  -4.719   0.382
  322    HD2  ARG  36          1HD       ARG  36  -0.676  -6.885  -0.087
  323    HD3  ARG  36          2HD       ARG  36  -0.900  -6.301   1.579
  324    HE   ARG  36           HE       ARG  36  -3.324  -6.212   1.100
  325   HH11  ARG  36          1HH1      ARG  36  -1.548  -6.742  -1.853
  326   HH12  ARG  36          2HH1      ARG  36  -3.036  -7.154  -2.682
  327   HH21  ARG  36          1HH2      ARG  36  -5.039  -6.673   0.162
  328   HH22  ARG  36          2HH2      ARG  36  -5.028  -7.114  -1.534
  329    H    GLY  37           H        GLY  37  -0.619  -0.662   1.531
  330    HA2  GLY  37          1HA       GLY  37  -2.881   0.317   2.948
  331    HA3  GLY  37          2HA       GLY  37  -1.427   0.484   3.910
  332    H    CYS  38           H        CYS  38  -2.133   2.873   3.553
  333    HA   CYS  38           HA       CYS  38  -1.242   3.803   0.931
  334    HB2  CYS  38          1HB       CYS  38  -2.886   4.955   3.308
  335    HB3  CYS  38          2HB       CYS  38  -2.616   5.854   1.795
  336    HG   CYS  38           HG       CYS  38  -5.072   5.090   1.949
  337    H    ILE  39           H        ILE  39   0.344   5.558   0.852
  338    HA   ILE  39           HA       ILE  39   1.164   6.752   3.318
  339    HB   ILE  39           HB       ILE  39   2.611   4.648   3.153
  340   HG12  ILE  39          1HG1      ILE  39   4.296   7.095   2.855
  341   HG13  ILE  39          2HG1      ILE  39   3.172   6.916   4.222
  342   HG21  ILE  39          1HG2      ILE  39   4.423   4.680   1.473
  343   HG22  ILE  39          2HG2      ILE  39   2.827   4.612   0.691
  344   HG23  ILE  39          3HG2      ILE  39   3.726   6.146   0.746
  345   HD11  ILE  39          1HD1      ILE  39   5.443   6.183   4.835
  346   HD12  ILE  39          2HD1      ILE  39   4.297   4.822   4.873
  347   HD13  ILE  39          3HD1      ILE  39   5.421   5.002   3.506
  348    H    ASP  40           H        ASP  40   2.742   8.576   2.879
  349    HA   ASP  40           HA       ASP  40   1.907   9.789   0.417
  350    HB2  ASP  40          1HB       ASP  40   2.989  11.876   1.444
  351    HB3  ASP  40          2HB       ASP  40   1.677  11.010   2.281
  352    HD2  ASP  40           HD       ASP  40   4.513  11.765   4.541
  353    H    VAL  41           H        VAL  41   4.947   8.922   2.215
  354    HA   VAL  41           HA       VAL  41   6.417   9.254  -0.308
  355    HB   VAL  41           HB       VAL  41   7.408   9.486   2.573
  356   HG11  VAL  41          1HG1      VAL  41   9.550  10.170   1.543
  357   HG12  VAL  41          2HG1      VAL  41   9.106   8.516   1.060
  358   HG13  VAL  41          3HG1      VAL  41   8.869   9.869  -0.073
  359   HG21  VAL  41          1HG2      VAL  41   7.799  11.837   2.037
  360   HG22  VAL  41          2HG2      VAL  41   7.056  11.596   0.438
  361   HG23  VAL  41          3HG2      VAL  41   6.080  11.402   1.914
  362    H    CYS  42           H        CYS  42   7.479   7.488  -1.126
  363    HA   CYS  42           HA       CYS  42   6.657   5.009  -0.072
  364    HB2  CYS  42          1HB       CYS  42   6.925   5.448  -2.463
  365    HB3  CYS  42          2HB       CYS  42   8.670   5.620  -2.248
  366    HG   CYS  42           HG       CYS  42   8.147   3.343  -3.461
  367    HA   PRO  43           HA       PRO  43  10.046   4.690   2.704
  368    HB2  PRO  43          1HB       PRO  43   9.426   2.297   3.866
  369    HB3  PRO  43          2HB       PRO  43   8.554   3.772   4.305
  370    HG2  PRO  43          1HG       PRO  43   7.789   1.625   2.304
  371    HG3  PRO  43          2HG       PRO  43   6.776   2.440   3.502
  372    HD2  PRO  43          1HD       PRO  43   6.767   3.201   0.866
  373    HD3  PRO  43          2HD       PRO  43   6.514   4.377   2.161
  374    H    LYS  44           H        LYS  44  12.132   3.984   2.682
  375    HA   LYS  44           HA       LYS  44  12.819   2.481   0.375
  376    HB2  LYS  44          1HB       LYS  44  14.369   3.332   2.838
  377    HB3  LYS  44          2HB       LYS  44  15.099   2.533   1.425
  378    HG2  LYS  44          1HG       LYS  44  14.435   4.424   0.002
  379    HG3  LYS  44          2HG       LYS  44  13.686   5.222   1.406
  380    HD2  LYS  44          1HD       LYS  44  15.857   5.354   2.522
  381    HD3  LYS  44          2HD       LYS  44  16.624   4.492   1.167
  382    HE2  LYS  44          1HE       LYS  44  16.005   6.321  -0.352
  383    HE3  LYS  44          2HE       LYS  44  15.232   7.183   0.998
  384    HZ1  LYS  44          1HZ       LYS  44  17.447   8.005   0.570
  385    HZ2  LYS  44          2HZ       LYS  44  17.382   7.308   2.064
  386    HZ3  LYS  44          3HZ       LYS  44  18.098   6.510   0.811
  387    H    ASN  45           H        ASN  45  14.180   0.443   0.490
  388    HA   ASN  45           HA       ASN  45  12.539  -1.436   1.766
  389    HB2  ASN  45          1HB       ASN  45  15.130  -1.999   0.149
  390    HB3  ASN  45          2HB       ASN  45  13.956  -2.992   1.045
  391   HD21  ASN  45          1HD2      ASN  45  13.198  -2.459  -2.678
  392   HD22  ASN  45          2HD2      ASN  45  14.715  -2.664  -1.867
  393    H    SER  46           H        SER  46  13.065  -2.830   3.572
  394    HA   SER  46           HA       SER  46  15.442  -1.990   5.031
  395    HB2  SER  46          1HB       SER  46  14.311  -2.803   7.031
  396    HB3  SER  46          2HB       SER  46  13.265  -1.661   6.157
  397    HG   SER  46           HG       SER  46  12.165  -3.470   5.298
  398    H    LEU  47           H        LEU  47  16.110  -4.017   6.630
  399    HA   LEU  47           HA       LEU  47  17.057  -5.950   4.750
  400    HB2  LEU  47          1HB       LEU  47  17.215  -5.597   7.678
  401    HB3  LEU  47          2HB       LEU  47  18.178  -6.878   6.906
  402    HG   LEU  47           HG       LEU  47  18.462  -3.879   6.468
  403   HD11  LEU  47          1HD1      LEU  47  20.709  -4.207   7.536
  404   HD12  LEU  47          2HD1      LEU  47  19.395  -4.674   8.640
  405   HD13  LEU  47          3HD1      LEU  47  20.324  -5.926   7.782
  406   HD21  LEU  47          1HD2      LEU  47  20.415  -4.465   5.072
  407   HD22  LEU  47          2HD2      LEU  47  20.016  -6.189   5.269
  408   HD23  LEU  47          3HD2      LEU  47  18.886  -5.107   4.421
  409    H    LEU  48           H        LEU  48  14.339  -5.633   6.925
  410    HA   LEU  48           HA       LEU  48  14.091  -8.535   7.147
  411    HB2  LEU  48          1HB       LEU  48  12.747  -6.213   8.384
  412    HB3  LEU  48          2HB       LEU  48  12.270  -7.859   8.860
  413    HG   LEU  48           HG       LEU  48  14.969  -6.531   9.316
  414   HD11  LEU  48          1HD1      LEU  48  14.376  -6.802  11.739
  415   HD12  LEU  48          2HD1      LEU  48  13.178  -5.799  10.889
  416   HD13  LEU  48          3HD1      LEU  48  12.811  -7.501  11.262
  417   HD21  LEU  48          1HD2      LEU  48  15.589  -8.604  10.509
  418   HD22  LEU  48          2HD2      LEU  48  14.046  -9.335  10.002
  419   HD23  LEU  48          3HD2      LEU  48  15.258  -8.878   8.782
  420    H    VAL  49           H        VAL  49  12.288  -5.573   6.119
  421    HA   VAL  49           HA       VAL  49  10.498  -7.366   4.633
  422    HB   VAL  49           HB       VAL  49   8.695  -5.649   5.054
  423   HG11  VAL  49          1HG1      VAL  49   8.238  -6.328   7.387
  424   HG12  VAL  49          2HG1      VAL  49   8.816  -7.706   6.421
  425   HG13  VAL  49          3HG1      VAL  49   9.919  -6.887   7.553
  426   HG21  VAL  49          1HG2      VAL  49   8.986  -4.036   6.866
  427   HG22  VAL  49          2HG2      VAL  49  10.695  -4.513   7.014
  428   HG23  VAL  49          3HG2      VAL  49  10.111  -3.740   5.521
  429    H    LYS  50           H        LYS  50   9.800  -6.602   2.578
  430    HA   LYS  50           HA       LYS  50  11.484  -4.427   1.573
  431    HB2  LYS  50          1HB       LYS  50  11.741  -6.601   0.482
  432    HB3  LYS  50          2HB       LYS  50   9.990  -6.666   0.174
  433    HG2  LYS  50          1HG       LYS  50  10.185  -4.695  -1.300
  434    HG3  LYS  50          2HG       LYS  50  11.940  -4.656  -1.005
  435    HD2  LYS  50          1HD       LYS  50  12.160  -6.900  -1.990
  436    HD3  LYS  50          2HD       LYS  50  10.404  -6.947  -2.277
  437    HE2  LYS  50          1HE       LYS  50  10.613  -4.953  -3.730
  438    HE3  LYS  50          2HE       LYS  50  12.374  -4.979  -3.482
  439    HZ1  LYS  50          1HZ       LYS  50  11.748  -6.050  -5.540
  440    HZ2  LYS  50          2HZ       LYS  50  12.420  -7.151  -4.510
  441    HZ3  LYS  50          3HZ       LYS  50  10.786  -7.125  -4.740
  442    H    TYR  51           H        TYR  51  10.568  -2.718   0.337
  443    HA   TYR  51           HA       TYR  51   7.666  -2.466   0.756
  444    HB2  TYR  51          1HB       TYR  51   9.866  -0.400   0.784
  445    HB3  TYR  51          2HB       TYR  51   8.126  -0.022   0.786
  446    HD1  TYR  51          1HD       TYR  51  10.945  -1.286   2.776
  447    HD2  TYR  51          2HD       TYR  51   6.758  -0.476   2.768
  448    HE1  TYR  51          1HE       TYR  51  10.908  -1.493   5.244
  449    HE2  TYR  51          2HE       TYR  51   6.704  -0.681   5.231
  450    HH   TYR  51           HH       TYR  51   7.906  -1.077   7.125
  451    H    VAL  52           H        VAL  52   6.457  -2.364  -1.074
  452    HA   VAL  52           HA       VAL  52   7.731  -1.086  -3.394
  453    HB   VAL  52           HB       VAL  52   5.668  -3.341  -3.403
  454   HG11  VAL  52          1HG1      VAL  52   5.987  -3.301  -5.855
  455   HG12  VAL  52          2HG1      VAL  52   5.369  -1.741  -5.263
  456   HG13  VAL  52          3HG1      VAL  52   7.088  -1.913  -5.689
  457   HG21  VAL  52          1HG2      VAL  52   7.428  -4.697  -4.421
  458   HG22  VAL  52          2HG2      VAL  52   8.582  -3.359  -4.203
  459   HG23  VAL  52          3HG2      VAL  52   7.864  -4.156  -2.782
  460    H    CYS  53           H        CYS  53   6.656   0.664  -4.206
  461    HA   CYS  53           HA       CYS  53   3.948   1.078  -3.163
  462    HB2  CYS  53          1HB       CYS  53   5.844   3.307  -3.855
  463    HB3  CYS  53          2HB       CYS  53   4.335   3.388  -2.942
  464    HG   CYS  53           HG       CYS  53   6.363   3.928  -1.354
  465    H    CYS  54           H        CYS  54   2.589   2.479  -4.683
  466    HA   CYS  54           HA       CYS  54   3.635   2.956  -7.286
  467    HB2  CYS  54          1HB       CYS  54   1.699   1.665  -8.373
  468    HB3  CYS  54          2HB       CYS  54   3.160   0.791  -7.903
  469    HG   CYS  54           HG       CYS  54   1.050  -0.732  -7.508
  470    H    ASN  55           H        ASN  55   1.993   4.283  -8.564
  471    HA   ASN  55           HA       ASN  55   0.799   5.898  -6.466
  472    HB2  ASN  55          1HB       ASN  55   1.476   7.919  -7.857
  473    HB3  ASN  55          2HB       ASN  55   2.620   6.606  -7.487
  474   HD21  ASN  55          1HD2      ASN  55   2.937   7.776 -11.035
  475   HD22  ASN  55          2HD2      ASN  55   2.891   8.591  -9.507
  476    H    THR  56           H        THR  56  -0.618   3.660  -7.804
  477    HA   THR  56           HA       THR  56  -2.807   5.244  -8.946
  478    HB   THR  56           HB       THR  56  -3.258   3.348 -10.528
  479    HG1  THR  56          1HG       THR  56  -1.527   1.821 -10.819
  480   HG21  THR  56          1HG2      THR  56  -1.432   3.832 -12.117
  481   HG22  THR  56          2HG2      THR  56  -1.996   5.320 -11.318
  482   HG23  THR  56          3HG2      THR  56  -0.476   4.554 -10.802
  483    H    ASP  57           H        ASP  57  -4.857   3.701  -9.095
  484    HA   ASP  57           HA       ASP  57  -5.262   3.243  -6.329
  485    HB2  ASP  57          1HB       ASP  57  -7.168   3.096  -8.733
  486    HB3  ASP  57          2HB       ASP  57  -7.506   2.685  -7.033
  487    HD2  ASP  57           HD       ASP  57  -7.598   6.421  -8.058
  488    H    ARG  58           H        ARG  58  -5.457   1.207  -5.293
  489    HA   ARG  58           HA       ARG  58  -5.452  -0.935  -4.990
  490    HB2  ARG  58          1HB       ARG  58  -7.008  -0.953  -7.613
  491    HB3  ARG  58          2HB       ARG  58  -6.921  -2.335  -6.508
  492    HG2  ARG  58          1HG       ARG  58  -8.156  -1.218  -4.834
  493    HG3  ARG  58          2HG       ARG  58  -7.844   0.383  -5.523
  494    HD2  ARG  58          1HD       ARG  58  -9.444  -1.739  -6.999
  495    HD3  ARG  58          2HD       ARG  58 -10.213  -0.620  -5.863
  496    HE   ARG  58           HE       ARG  58  -8.689   0.979  -7.598
  497   HH11  ARG  58          1HH1      ARG  58 -10.972   1.354 -10.199
  498   HH12  ARG  58          2HH1      ARG  58  -9.534   1.986  -9.424
  499   HH21  ARG  58          1HH2      ARG  58 -12.020  -0.533  -9.346
  500   HH22  ARG  58          2HH2      ARG  58 -11.371  -1.311  -7.941
  501    H    CYS  59           H        CYS  59  -3.138   0.155  -6.394
  502    HA   CYS  59           HA       CYS  59  -2.602  -1.623  -8.592
  503    HB2  CYS  59          1HB       CYS  59  -0.584  -0.037  -8.681
  504    HB3  CYS  59          2HB       CYS  59  -2.056   0.918  -8.373
  505    HG   CYS  59           HG       CYS  59  -0.060   1.926  -7.095
  506    H    ASN  60           H        ASN  60  -2.032  -1.323  -5.131
  507    HA   ASN  60           HA       ASN  60  -0.029  -3.400  -5.245
  508    HB2  ASN  60          1HB       ASN  60   0.141  -3.042  -2.791
  509    HB3  ASN  60          2HB       ASN  60   0.298  -1.503  -3.651
  510   HD21  ASN  60          1HD2      ASN  60  -0.246  -0.975  -1.282
  511   HD22  ASN  60          2HD2      ASN  60  -1.914  -0.682  -0.920
  Start of MODEL   18
    1    H1   MET   0          1H        MET   0  -8.087  10.321   0.464
    2    H2   MET   0          2H        MET   0  -9.064  11.008  -0.444
    3    H    MET   0           H        MET   0  -9.021   9.488  -0.399
    4    H3   MET   0          3H        MET   0  -9.028   9.510  -0.377
    5    HA   MET   0           HA       MET   0  -7.631  11.115  -2.181
    6    HB2  MET   0          1HB       MET   0  -5.795   9.449  -0.447
    7    HB3  MET   0          2HB       MET   0  -5.318  10.453  -1.838
    8    HG2  MET   0          1HG       MET   0  -6.650  11.613   0.615
    9    HG3  MET   0          2HG       MET   0  -4.887  11.395   0.511
   10    HE1  MET   0          1HE       MET   0  -7.394  14.727  -1.286
   11    HE2  MET   0          2HE       MET   0  -8.029  13.064  -1.233
   12    HE3  MET   0          3HE       MET   0  -7.555  13.886   0.275
   13    H    LEU   1           H        LEU   1  -5.496   8.846  -2.604
   14    HA   LEU   1           HA       LEU   1  -7.056   7.356  -4.418
   15    HB2  LEU   1          1HB       LEU   1  -4.373   7.500  -3.373
   16    HB3  LEU   1          2HB       LEU   1  -4.696   5.905  -4.092
   17    HG   LEU   1           HG       LEU   1  -5.594   7.496  -6.084
   18   HD11  LEU   1          1HD1      LEU   1  -3.957   9.373  -6.390
   19   HD12  LEU   1          2HD1      LEU   1  -4.913   9.585  -4.905
   20   HD13  LEU   1          3HD1      LEU   1  -3.240   8.985  -4.809
   21   HD21  LEU   1          1HD2      LEU   1  -3.440   7.077  -7.220
   22   HD22  LEU   1          2HD2      LEU   1  -2.718   6.640  -5.652
   23   HD23  LEU   1          3HD2      LEU   1  -4.036   5.655  -6.331
   24    H    LYS   2           H        LYS   2  -6.530   4.733  -4.271
   25    HA   LYS   2           HA       LYS   2  -7.396   3.921  -1.593
   26    HB2  LYS   2          1HB       LYS   2  -8.583   2.989  -4.224
   27    HB3  LYS   2          2HB       LYS   2  -9.038   2.423  -2.599
   28    HG2  LYS   2          1HG       LYS   2  -9.884   4.667  -2.048
   29    HG3  LYS   2          2HG       LYS   2  -9.420   5.241  -3.667
   30    HD2  LYS   2          1HD       LYS   2 -10.946   3.515  -4.649
   31    HD3  LYS   2          2HD       LYS   2 -11.484   3.116  -3.000
   32    HE2  LYS   2          1HE       LYS   2 -12.277   5.405  -2.683
   33    HE3  LYS   2          2HE       LYS   2 -11.693   5.849  -4.303
   34    HZ1  LYS   2          1HZ       LYS   2 -14.050   5.393  -4.304
   35    HZ2  LYS   2          2HZ       LYS   2 -13.259   4.279  -5.228
   36    HZ3  LYS   2          3HZ       LYS   2 -13.801   3.869  -3.725
   37    H    CYS   3           H        CYS   3  -6.548   1.969  -0.887
   38    HA   CYS   3           HA       CYS   3  -4.773   0.659  -2.817
   39    HB2  CYS   3          1HB       CYS   3  -4.576   1.218   0.237
   40    HB3  CYS   3          2HB       CYS   3  -3.302   0.406  -0.704
   41    HG   CYS   3           HG       CYS   3  -2.515   2.751   0.017
   42    H    ASN   4           H        ASN   4  -4.482  -1.708  -2.382
   43    HA   ASN   4           HA       ASN   4  -7.010  -2.766  -1.542
   44    HB2  ASN   4          1HB       ASN   4  -4.738  -4.401  -2.879
   45    HB3  ASN   4          2HB       ASN   4  -6.405  -4.676  -2.318
   46   HD21  ASN   4          1HD2      ASN   4  -5.876  -3.572  -6.014
   47   HD22  ASN   4          2HD2      ASN   4  -4.778  -4.441  -4.995
   48    H    LYS   5           H        LYS   5  -7.243  -4.282   0.231
   49    HA   LYS   5           HA       LYS   5  -4.782  -5.058   1.597
   50    HB2  LYS   5          1HB       LYS   5  -7.297  -3.985   2.908
   51    HB3  LYS   5          2HB       LYS   5  -5.919  -4.716   3.766
   52    HG2  LYS   5          1HG       LYS   5  -4.481  -2.872   2.773
   53    HG3  LYS   5          2HG       LYS   5  -5.991  -2.096   2.243
   54    HD2  LYS   5          1HD       LYS   5  -6.762  -2.194   4.652
   55    HD3  LYS   5          2HD       LYS   5  -5.112  -2.705   5.081
   56    HE2  LYS   5          1HE       LYS   5  -4.257  -0.627   3.971
   57    HE3  LYS   5          2HE       LYS   5  -5.945  -0.105   3.762
   58    HZ1  LYS   5          1HZ       LYS   5  -4.955   0.849   5.731
   59    HZ2  LYS   5          2HZ       LYS   5  -6.189  -0.162   6.152
   60    HZ3  LYS   5          3HZ       LYS   5  -4.624  -0.647   6.344
   61    H    LEU   6           H        LEU   6  -8.230  -5.496   2.530
   62    HA   LEU   6           HA       LEU   6  -7.892  -8.256   2.854
   63    HB2  LEU   6          1HB       LEU   6  -9.450  -6.987   3.988
   64    HB3  LEU   6          2HB       LEU   6 -10.410  -6.513   2.567
   65    HG   LEU   6           HG       LEU   6 -10.878  -8.987   2.213
   66   HD11  LEU   6          1HD1      LEU   6 -10.633 -10.448   4.237
   67   HD12  LEU   6          2HD1      LEU   6  -9.053  -9.856   3.674
   68   HD13  LEU   6          3HD1      LEU   6  -9.831  -9.108   5.089
   69   HD21  LEU   6          1HD2      LEU   6 -12.675  -9.053   3.906
   70   HD22  LEU   6          2HD2      LEU   6 -11.911  -7.681   4.746
   71   HD23  LEU   6          3HD2      LEU   6 -12.551  -7.471   3.099
   72    H    VAL   7           H        VAL   7  -8.183  -9.997   1.509
   73    HA   VAL   7           HA       VAL   7  -8.211  -9.456  -1.280
   74    HB   VAL   7           HB       VAL   7  -8.205 -11.948  -1.489
   75   HG11  VAL   7          1HG1      VAL   7  -6.072 -12.357  -0.307
   76   HG12  VAL   7          2HG1      VAL   7  -6.074 -10.758  -1.088
   77   HG13  VAL   7          3HG1      VAL   7  -6.331 -10.893   0.669
   78   HG21  VAL   7          1HG2      VAL   7  -8.177 -13.349   0.512
   79   HG22  VAL   7          2HG2      VAL   7  -8.511 -11.919   1.516
   80   HG23  VAL   7          3HG2      VAL   7  -9.715 -12.476   0.329
   81    HA   PRO   8           HA       PRO   8  -8.618 -10.714  -2.798
   82    HB2  PRO   8          1HB       PRO   8  -9.640 -10.770  -5.282
   83    HB3  PRO   8          2HB       PRO   8  -9.933 -12.144  -4.208
   84    HG2  PRO   8          1HG       PRO   8 -11.736  -9.788  -4.832
   85    HG3  PRO   8          2HG       PRO   8 -12.152 -11.500  -4.682
   86    HD2  PRO   8          1HD       PRO   8 -12.492  -9.643  -2.621
   87    HD3  PRO   8          2HD       PRO   8 -12.311 -11.380  -2.345
   88    H    ILE   9           H        ILE   9 -10.988  -8.208  -3.406
   89    HA   ILE   9           HA       ILE   9  -8.800  -6.634  -4.575
   90    HB   ILE   9           HB       ILE   9 -11.739  -6.659  -5.269
   91   HG12  ILE   9          1HG1      ILE   9 -10.568  -8.605  -6.112
   92   HG13  ILE   9          2HG1      ILE   9 -10.993  -7.514  -7.441
   93   HG21  ILE   9          1HG2      ILE   9  -9.501  -4.995  -6.457
   94   HG22  ILE   9          2HG2      ILE   9 -11.201  -5.028  -6.986
   95   HG23  ILE   9          3HG2      ILE   9 -10.782  -4.394  -5.377
   96   HD11  ILE   9          1HD1      ILE   9  -8.267  -7.530  -6.074
   97   HD12  ILE   9          2HD1      ILE   9  -8.637  -8.472  -7.537
   98   HD13  ILE   9          3HD1      ILE   9  -8.715  -6.696  -7.582
   99    H    ALA  10           H        ALA  10 -10.984  -7.009  -1.962
  100    HA   ALA  10           HA       ALA  10 -12.132  -4.611  -1.551
  101    HB1  ALA  10          1HB       ALA  10 -11.108  -5.480   0.972
  102    HB2  ALA  10          2HB       ALA  10 -12.727  -5.757   0.286
  103    HB3  ALA  10          3HB       ALA  10 -11.423  -6.932  -0.008
  104    H    TYR  11           H        TYR  11 -11.559  -2.548  -0.862
  105    HA   TYR  11           HA       TYR  11  -8.698  -2.101  -0.421
  106    HB2  TYR  11          1HB       TYR  11  -9.038  -0.155  -2.089
  107    HB3  TYR  11          2HB       TYR  11  -9.119  -1.758  -2.828
  108    HD1  TYR  11          1HD       TYR  11 -11.202  -2.610  -3.698
  109    HD2  TYR  11          2HD       TYR  11 -11.031   1.201  -1.812
  110    HE1  TYR  11          1HE       TYR  11 -13.508  -2.045  -4.644
  111    HE2  TYR  11          2HE       TYR  11 -13.328   1.783  -2.749
  112    HH   TYR  11           HH       TYR  11 -14.650   0.512  -5.180
  113    H    LYS  12           H        LYS  12  -8.214   0.014   0.543
  114    HA   LYS  12           HA       LYS  12 -10.573   1.163   1.865
  115    HB2  LYS  12          1HB       LYS  12  -7.799   0.610   2.952
  116    HB3  LYS  12          2HB       LYS  12  -9.003   1.634   3.771
  117    HG2  LYS  12          1HG       LYS  12 -10.546  -0.394   3.745
  118    HG3  LYS  12          2HG       LYS  12  -9.127  -1.348   3.248
  119    HD2  LYS  12          1HD       LYS  12  -7.932  -0.641   5.276
  120    HD3  LYS  12          2HD       LYS  12  -9.337   0.331   5.770
  121    HE2  LYS  12          1HE       LYS  12 -10.711  -1.729   5.824
  122    HE3  LYS  12          2HE       LYS  12  -9.267  -2.680   5.407
  123    HZ1  LYS  12          1HZ       LYS  12  -9.685  -2.689   7.772
  124    HZ2  LYS  12          2HZ       LYS  12  -8.259  -1.925   7.453
  125    HZ3  LYS  12          3HZ       LYS  12  -9.599  -1.044   7.839
  126    H    THR  13           H        THR  13 -10.326   3.468   2.470
  127    HA   THR  13           HA       THR  13  -9.087   4.775   0.194
  128    HB   THR  13           HB       THR  13 -10.886   5.834   2.428
  129    HG1  THR  13          1HG       THR  13 -12.473   5.767   0.728
  130   HG21  THR  13          1HG2      THR  13 -11.194   7.784   0.943
  131   HG22  THR  13          2HG2      THR  13  -9.485   7.593   1.403
  132   HG23  THR  13          3HG2      THR  13 -10.033   7.087  -0.213
  133    H    CYS  14           H        CYS  14  -7.312   6.033   0.206
  134    HA   CYS  14           HA       CYS  14  -5.651   5.869   2.470
  135    HB2  CYS  14          1HB       CYS  14  -5.439   7.448  -0.090
  136    HB3  CYS  14          2HB       CYS  14  -4.177   7.419   1.144
  137    HG   CYS  14           HG       CYS  14  -3.451   5.931  -0.901
  138    HA   PRO  15           HA       PRO  15  -6.931   9.543   4.472
  139    HB2  PRO  15          1HB       PRO  15  -4.870  10.060   6.150
  140    HB3  PRO  15          2HB       PRO  15  -5.903   8.652   6.435
  141    HG2  PRO  15          1HG       PRO  15  -3.224   8.795   5.013
  142    HG3  PRO  15          2HG       PRO  15  -3.784   7.621   6.211
  143    HD2  PRO  15          1HD       PRO  15  -3.845   7.093   3.504
  144    HD3  PRO  15          2HD       PRO  15  -5.023   6.391   4.620
  145    H    GLU  16           H        GLU  16  -6.722  11.842   4.616
  146    HA   GLU  16           HA       GLU  16  -5.790  12.861   2.252
  147    HB2  GLU  16          1HB       GLU  16  -7.434  13.940   3.705
  148    HB3  GLU  16          2HB       GLU  16  -6.181  14.215   4.940
  149    HG2  GLU  16          1HG       GLU  16  -5.004  15.794   3.333
  150    HG3  GLU  16          2HG       GLU  16  -6.290  15.365   2.183
  151    HE2  GLU  16           HE       GLU  16  -7.249  18.397   3.895
  152    H    GLY  17           H        GLY  17  -3.850  13.763   1.540
  153    HA2  GLY  17          1HA       GLY  17  -1.761  14.768   1.888
  154    HA3  GLY  17          2HA       GLY  17  -1.688  14.087   3.501
  155    H    LYS  18           H        LYS  18  -2.779  11.413   2.309
  156    HA   LYS  18           HA       LYS  18  -0.182  10.500   1.321
  157    HB2  LYS  18          1HB       LYS  18  -2.611   8.911   2.194
  158    HB3  LYS  18          2HB       LYS  18  -0.979   8.283   1.869
  159    HG2  LYS  18          1HG       LYS  18  -1.815  10.099   4.155
  160    HG3  LYS  18          2HG       LYS  18  -1.357   8.384   4.271
  161    HD2  LYS  18          1HD       LYS  18   0.902   8.975   3.389
  162    HD3  LYS  18          2HD       LYS  18   0.428  10.691   3.427
  163    HE2  LYS  18          1HE       LYS  18  -0.050  10.411   5.882
  164    HE3  LYS  18          2HE       LYS  18   0.669   8.788   5.774
  165    HZ1  LYS  18          1HZ       LYS  18   2.264  10.419   6.521
  166    HZ2  LYS  18          2HZ       LYS  18   2.719   9.815   5.054
  167    HZ3  LYS  18          3HZ       LYS  18   2.051  11.320   5.156
  168    H    ASN  19           H        ASN  19  -0.117   9.042  -0.565
  169    HA   ASN  19           HA       ASN  19  -2.277   9.715  -2.390
  170    HB2  ASN  19          1HB       ASN  19  -0.305  11.460  -2.707
  171    HB3  ASN  19          2HB       ASN  19   0.526   9.895  -2.890
  172   HD21  ASN  19          1HD2      ASN  19  -1.459  11.623  -5.968
  173   HD22  ASN  19          2HD2      ASN  19  -1.427  12.305  -4.376
  174    H    LEU  20           H        LEU  20   0.793   7.885  -1.725
  175    HA   LEU  20           HA       LEU  20   0.333   6.260  -4.075
  176    HB2  LEU  20          1HB       LEU  20   2.434   6.234  -1.996
  177    HB3  LEU  20          2HB       LEU  20   2.653   5.406  -3.554
  178    HG   LEU  20           HG       LEU  20   2.510   8.407  -3.069
  179   HD11  LEU  20          1HD1      LEU  20   4.853   8.372  -3.965
  180   HD12  LEU  20          2HD1      LEU  20   4.702   7.360  -2.509
  181   HD13  LEU  20          3HD1      LEU  20   4.753   6.603  -4.119
  182   HD21  LEU  20          1HD2      LEU  20   2.902   8.646  -5.497
  183   HD22  LEU  20          2HD2      LEU  20   2.758   6.880  -5.677
  184   HD23  LEU  20          3HD2      LEU  20   1.361   7.836  -5.127
  185    H    CYS  21           H        CYS  21   0.366   3.893  -3.995
  186    HA   CYS  21           HA       CYS  21  -0.610   2.912  -1.415
  187    HB2  CYS  21          1HB       CYS  21  -1.111   1.965  -4.231
  188    HB3  CYS  21          2HB       CYS  21  -1.500   0.989  -2.812
  189    HG   CYS  21           HG       CYS  21  -3.705   2.023  -3.807
  190    H    TYR  22           H        TYR  22   0.767   1.550  -0.311
  191    HA   TYR  22           HA       TYR  22   3.035   0.471  -1.847
  192    HB2  TYR  22          1HB       TYR  22   4.393   0.754   0.038
  193    HB3  TYR  22          2HB       TYR  22   3.499   2.278  -0.178
  194    HD1  TYR  22          1HD       TYR  22   3.851  -0.742   1.922
  195    HD2  TYR  22          2HD       TYR  22   1.887   3.015   1.468
  196    HE1  TYR  22          1HE       TYR  22   3.047  -0.888   4.261
  197    HE2  TYR  22          2HE       TYR  22   1.075   2.885   3.799
  198    HH   TYR  22           HH       TYR  22   1.851   0.111   5.912
  199    H    LYS  23           H        LYS  23   3.877  -1.629  -1.168
  200    HA   LYS  23           HA       LYS  23   2.051  -3.127   0.562
  201    HB2  LYS  23          1HB       LYS  23   2.366  -5.084  -0.900
  202    HB3  LYS  23          2HB       LYS  23   1.512  -3.751  -1.711
  203    HG2  LYS  23          1HG       LYS  23   3.507  -3.150  -2.945
  204    HG3  LYS  23          2HG       LYS  23   4.470  -4.344  -2.041
  205    HD2  LYS  23          1HD       LYS  23   3.795  -5.090  -4.343
  206    HD3  LYS  23          2HD       LYS  23   3.272  -6.174  -3.032
  207    HE2  LYS  23          1HE       LYS  23   1.035  -5.216  -3.086
  208    HE3  LYS  23          2HE       LYS  23   1.541  -4.043  -4.323
  209    HZ1  LYS  23          1HZ       LYS  23   0.380  -5.910  -5.289
  210    HZ2  LYS  23          2HZ       LYS  23   1.945  -5.885  -5.811
  211    HZ3  LYS  23          3HZ       LYS  23   1.476  -6.973  -4.663
  212    H    MET  24           H        MET  24   3.070  -4.837   1.776
  213    HA   MET  24           HA       MET  24   5.947  -4.377   1.936
  214    HB2  MET  24          1HB       MET  24   3.921  -5.031   4.089
  215    HB3  MET  24          2HB       MET  24   5.680  -4.970   4.351
  216    HG2  MET  24          1HG       MET  24   5.668  -2.586   3.684
  217    HG3  MET  24          2HG       MET  24   3.898  -2.662   3.513
  218    HE1  MET  24          1HE       MET  24   2.604  -2.991   7.126
  219    HE2  MET  24          2HE       MET  24   2.216  -2.578   5.437
  220    HE3  MET  24          3HE       MET  24   2.755  -4.224   5.851
  221    H    PHE  25           H        PHE  25   7.310  -6.155   1.864
  222    HA   PHE  25           HA       PHE  25   5.985  -8.772   1.907
  223    HB2  PHE  25          1HB       PHE  25   8.646  -7.756   0.754
  224    HB3  PHE  25          2HB       PHE  25   8.098  -9.430   0.627
  225    HD1  PHE  25          1HD       PHE  25   7.392  -5.968  -0.421
  226    HD2  PHE  25          2HD       PHE  25   6.572 -10.075  -1.067
  227    HE1  PHE  25          1HE       PHE  25   6.203  -5.392  -2.565
  228    HE2  PHE  25          2HE       PHE  25   5.388  -9.507  -3.206
  229    HZ   PHE  25           HZ       PHE  25   5.217  -7.175  -3.930
  230    H    MET  26           H        MET  26   7.349 -10.597   2.843
  231    HA   MET  26           HA       MET  26   9.358  -9.553   4.688
  232    HB2  MET  26          1HB       MET  26   7.661 -12.055   4.827
  233    HB3  MET  26          2HB       MET  26   9.003 -11.693   5.938
  234    HG2  MET  26          1HG       MET  26   7.824  -9.681   6.709
  235    HG3  MET  26          2HG       MET  26   6.484 -10.036   5.593
  236    HE1  MET  26          1HE       MET  26   4.960 -10.771   9.172
  237    HE2  MET  26          2HE       MET  26   6.158  -9.517   8.767
  238    HE3  MET  26          3HE       MET  26   4.790  -9.830   7.671
  239    H    MET  27           H        MET  27  11.415 -10.623   4.773
  240    HA   MET  27           HA       MET  27  12.429 -11.206   2.358
  241    HB2  MET  27          1HB       MET  27  13.243 -11.992   5.148
  242    HB3  MET  27          2HB       MET  27  14.240 -12.441   3.743
  243    HG2  MET  27          1HG       MET  27  13.478  -9.617   4.552
  244    HG3  MET  27          2HG       MET  27  15.053 -10.389   4.849
  245    HE1  MET  27          1HE       MET  27  16.556 -10.760   1.282
  246    HE2  MET  27          2HE       MET  27  16.855 -10.855   3.036
  247    HE3  MET  27          3HE       MET  27  15.708 -11.979   2.265
  248    H    SER  28           H        SER  28  10.815 -13.437   4.632
  249    HA   SER  28           HA       SER  28  11.455 -15.804   3.379
  250    HB2  SER  28          1HB       SER  28  10.316 -15.679   5.520
  251    HB3  SER  28          2HB       SER  28   8.901 -14.918   4.759
  252    HG   SER  28           HG       SER  28   8.620 -17.162   5.111
  253    H    ASP  29           H        ASP  29   8.244 -14.114   3.068
  254    HA   ASP  29           HA       ASP  29   7.960 -15.431   0.524
  255    HB2  ASP  29          1HB       ASP  29   6.094 -15.487   2.291
  256    HB3  ASP  29          2HB       ASP  29   6.093 -13.724   2.040
  257    HD2  ASP  29           HD       ASP  29   3.529 -15.237  -0.063
  258    H    LEU  30           H        LEU  30   9.467 -14.061  -0.725
  259    HA   LEU  30           HA       LEU  30   8.971 -11.244  -0.876
  260    HB2  LEU  30          1HB       LEU  30  10.681 -13.283  -2.006
  261    HB3  LEU  30          2HB       LEU  30  10.546 -11.870  -3.080
  262    HG   LEU  30           HG       LEU  30  11.951 -10.648  -1.814
  263   HD11  LEU  30          1HD1      LEU  30  11.755 -10.486   0.681
  264   HD12  LEU  30          2HD1      LEU  30  10.169 -10.311  -0.104
  265   HD13  LEU  30          3HD1      LEU  30  10.616 -11.852   0.665
  266   HD21  LEU  30          1HD2      LEU  30  13.516 -11.906  -0.374
  267   HD22  LEU  30          2HD2      LEU  30  12.409 -13.299  -0.417
  268   HD23  LEU  30          3HD2      LEU  30  13.185 -12.733  -1.915
  269    H    THR  31           H        THR  31   7.591 -14.122  -2.229
  270    HA   THR  31           HA       THR  31   7.044 -13.046  -4.820
  271    HB   THR  31           HB       THR  31   5.859 -15.443  -3.335
  272    HG1  THR  31          1HG       THR  31   7.394 -16.594  -4.650
  273   HG21  THR  31          1HG2      THR  31   5.218 -16.229  -5.587
  274   HG22  THR  31          2HG2      THR  31   4.443 -14.671  -5.208
  275   HG23  THR  31          3HG2      THR  31   5.853 -14.723  -6.293
  276    H    ILE  32           H        ILE  32   5.201 -13.421  -1.753
  277    HA   ILE  32           HA       ILE  32   3.109 -11.785  -3.005
  278    HB   ILE  32           HB       ILE  32   2.791 -14.184  -1.203
  279   HG12  ILE  32          1HG1      ILE  32   3.230 -14.688  -3.563
  280   HG13  ILE  32          2HG1      ILE  32   1.599 -15.174  -3.065
  281   HG21  ILE  32          1HG2      ILE  32   0.562 -13.717  -0.893
  282   HG22  ILE  32          2HG2      ILE  32   1.266 -12.082  -0.830
  283   HG23  ILE  32          3HG2      ILE  32   0.470 -12.653  -2.317
  284   HD11  ILE  32          1HD1      ILE  32   2.235 -13.626  -5.291
  285   HD12  ILE  32          2HD1      ILE  32   0.625 -13.738  -4.540
  286   HD13  ILE  32          3HD1      ILE  32   1.723 -12.409  -4.096
  287    HA   PRO  33           HA       PRO  33   4.019  -9.232   0.417
  288    HB2  PRO  33          1HB       PRO  33   2.195  -7.260  -0.026
  289    HB3  PRO  33          2HB       PRO  33   3.667  -7.357  -1.000
  290    HG2  PRO  33          1HG       PRO  33   0.895  -8.424  -1.624
  291    HG3  PRO  33          2HG       PRO  33   2.005  -7.537  -2.676
  292    HD2  PRO  33          1HD       PRO  33   1.788 -10.267  -2.809
  293    HD3  PRO  33          2HD       PRO  33   3.327  -9.455  -3.124
  294    H    VAL  34           H        VAL  34   2.994  -8.359   2.419
  295    HA   VAL  34           HA       VAL  34   1.122 -10.505   3.142
  296    HB   VAL  34           HB       VAL  34   2.120 -10.392   5.398
  297   HG11  VAL  34          1HG1      VAL  34   4.376 -11.250   4.861
  298   HG12  VAL  34          2HG1      VAL  34   3.158 -11.907   3.742
  299   HG13  VAL  34          3HG1      VAL  34   4.235 -10.592   3.214
  300   HG21  VAL  34          1HG2      VAL  34   4.083  -9.009   5.850
  301   HG22  VAL  34          2HG2      VAL  34   3.932  -8.270   4.237
  302   HG23  VAL  34          3HG2      VAL  34   2.653  -8.029   5.451
  303    H    LYS  35           H        LYS  35   1.933  -7.038   3.326
  304    HA   LYS  35           HA       LYS  35  -0.823  -6.529   4.023
  305    HB2  LYS  35          1HB       LYS  35   1.546  -5.833   5.749
  306    HB3  LYS  35          2HB       LYS  35   0.110  -4.781   5.717
  307    HG2  LYS  35          1HG       LYS  35  -1.219  -6.932   6.267
  308    HG3  LYS  35          2HG       LYS  35   0.360  -7.624   6.709
  309    HD2  LYS  35          1HD       LYS  35  -0.447  -6.791   8.742
  310    HD3  LYS  35          2HD       LYS  35   0.643  -5.506   8.170
  311    HE2  LYS  35          1HE       LYS  35  -1.208  -4.199   7.363
  312    HE3  LYS  35          2HE       LYS  35  -2.349  -5.525   7.686
  313    HZ1  LYS  35          1HZ       LYS  35  -2.431  -3.844   9.399
  314    HZ2  LYS  35          2HZ       LYS  35  -1.883  -5.267  10.030
  315    HZ3  LYS  35          3HZ       LYS  35  -0.827  -4.037   9.729
  316    H    ARG  36           H        ARG  36  -1.504  -4.400   3.403
  317    HA   ARG  36           HA       ARG  36   0.576  -2.839   2.119
  318    HB2  ARG  36          1HB       ARG  36  -2.182  -3.439   0.952
  319    HB3  ARG  36          2HB       ARG  36  -1.007  -2.321   0.236
  320    HG2  ARG  36          1HG       ARG  36  -0.469  -4.203  -0.970
  321    HG3  ARG  36          2HG       ARG  36   0.569  -4.512   0.434
  322    HD2  ARG  36          1HD       ARG  36  -0.563  -6.550   0.183
  323    HD3  ARG  36          2HD       ARG  36  -1.560  -5.739   1.398
  324    HE   ARG  36           HE       ARG  36  -2.472  -5.119  -1.276
  325   HH11  ARG  36          1HH1      ARG  36  -5.069  -7.436  -1.257
  326   HH12  ARG  36          2HH1      ARG  36  -4.385  -6.027  -2.038
  327   HH21  ARG  36          1HH2      ARG  36  -4.005  -8.383   0.575
  328   HH22  ARG  36          2HH2      ARG  36  -2.533  -7.688   1.165
  329    H    GLY  37           H        GLY  37  -0.461  -0.524   1.520
  330    HA2  GLY  37          1HA       GLY  37  -2.693   0.396   2.973
  331    HA3  GLY  37          2HA       GLY  37  -1.243   0.688   3.913
  332    H    CYS  38           H        CYS  38  -1.940   3.022   3.524
  333    HA   CYS  38           HA       CYS  38  -1.157   3.891   0.840
  334    HB2  CYS  38          1HB       CYS  38  -2.884   5.073   3.144
  335    HB3  CYS  38          2HB       CYS  38  -2.697   5.858   1.557
  336    HG   CYS  38           HG       CYS  38  -5.087   4.930   1.811
  337    H    ILE  39           H        ILE  39   0.360   5.673   0.690
  338    HA   ILE  39           HA       ILE  39   1.107   7.064   3.067
  339    HB   ILE  39           HB       ILE  39   2.560   4.955   3.134
  340   HG12  ILE  39          1HG1      ILE  39   4.207   7.418   2.719
  341   HG13  ILE  39          2HG1      ILE  39   3.070   7.263   4.079
  342   HG21  ILE  39          1HG2      ILE  39   4.443   4.863   1.536
  343   HG22  ILE  39          2HG2      ILE  39   2.882   4.723   0.694
  344   HG23  ILE  39          3HG2      ILE  39   3.772   6.263   0.665
  345   HD11  ILE  39          1HD1      ILE  39   5.356   6.643   4.755
  346   HD12  ILE  39          2HD1      ILE  39   4.259   5.245   4.844
  347   HD13  ILE  39          3HD1      ILE  39   5.396   5.401   3.484
  348    H    ASP  40           H        ASP  40   2.672   8.861   2.527
  349    HA   ASP  40           HA       ASP  40   1.958   9.832  -0.072
  350    HB2  ASP  40          1HB       ASP  40   2.979  12.011   0.794
  351    HB3  ASP  40          2HB       ASP  40   1.657  11.210   1.680
  352    HD2  ASP  40           HD       ASP  40   4.456  12.207   3.906
  353    H    VAL  41           H        VAL  41   4.898   9.076   1.920
  354    HA   VAL  41           HA       VAL  41   6.489   9.204  -0.547
  355    HB   VAL  41           HB       VAL  41   7.355   9.576   2.356
  356   HG11  VAL  41          1HG1      VAL  41   9.562  10.132   1.391
  357   HG12  VAL  41          2HG1      VAL  41   9.086   8.467   0.984
  358   HG13  VAL  41          3HG1      VAL  41   8.946   9.756  -0.236
  359   HG21  VAL  41          1HG2      VAL  41   7.848  11.878   1.703
  360   HG22  VAL  41          2HG2      VAL  41   7.171  11.564   0.088
  361   HG23  VAL  41          3HG2      VAL  41   6.121  11.489   1.524
  362    H    CYS  42           H        CYS  42   7.503   7.357  -1.225
  363    HA   CYS  42           HA       CYS  42   6.588   4.967  -0.051
  364    HB2  CYS  42          1HB       CYS  42   6.931   5.203  -2.441
  365    HB3  CYS  42          2HB       CYS  42   8.664   5.438  -2.200
  366    HG   CYS  42           HG       CYS  42   8.229   3.068  -3.258
  367    HA   PRO  43           HA       PRO  43   9.837   4.721   2.890
  368    HB2  PRO  43          1HB       PRO  43   9.187   2.323   4.042
  369    HB3  PRO  43          2HB       PRO  43   8.292   3.796   4.435
  370    HG2  PRO  43          1HG       PRO  43   7.622   1.641   2.409
  371    HG3  PRO  43          2HG       PRO  43   6.557   2.449   3.566
  372    HD2  PRO  43          1HD       PRO  43   6.627   3.212   0.940
  373    HD3  PRO  43          2HD       PRO  43   6.355   4.399   2.222
  374    H    LYS  44           H        LYS  44  11.929   4.029   2.998
  375    HA   LYS  44           HA       LYS  44  12.761   2.581   0.710
  376    HB2  LYS  44          1HB       LYS  44  14.164   3.394   3.272
  377    HB3  LYS  44          2HB       LYS  44  14.979   2.638   1.882
  378    HG2  LYS  44          1HG       LYS  44  14.363   4.554   0.470
  379    HG3  LYS  44          2HG       LYS  44  13.532   5.308   1.852
  380    HD2  LYS  44          1HD       LYS  44  15.642   5.438   3.082
  381    HD3  LYS  44          2HD       LYS  44  16.488   4.622   1.745
  382    HE2  LYS  44          1HE       LYS  44  15.920   6.483   0.246
  383    HE3  LYS  44          2HE       LYS  44  15.067   7.298   1.577
  384    HZ1  LYS  44          1HZ       LYS  44  17.289   8.162   1.283
  385    HZ2  LYS  44          2HZ       LYS  44  17.159   7.424   2.754
  386    HZ3  LYS  44          3HZ       LYS  44  17.949   6.668   1.517
  387    H    ASN  45           H        ASN  45  14.115   0.551   0.831
  388    HA   ASN  45           HA       ASN  45  12.429  -1.360   2.018
  389    HB2  ASN  45          1HB       ASN  45  15.043  -1.901   0.428
  390    HB3  ASN  45          2HB       ASN  45  13.822  -2.900   1.253
  391   HD21  ASN  45          1HD2      ASN  45  13.170  -2.226  -2.460
  392   HD22  ASN  45          2HD2      ASN  45  14.655  -2.515  -1.616
  393    H    SER  46           H        SER  46  12.971  -2.866   3.748
  394    HA   SER  46           HA       SER  46  15.336  -2.072   5.258
  395    HB2  SER  46          1HB       SER  46  14.192  -2.907   7.235
  396    HB3  SER  46          2HB       SER  46  13.156  -1.739   6.383
  397    HG   SER  46           HG       SER  46  12.029  -3.509   5.500
  398    H    LEU  47           H        LEU  47  15.939  -4.164   6.816
  399    HA   LEU  47           HA       LEU  47  16.879  -6.067   4.912
  400    HB2  LEU  47          1HB       LEU  47  16.927  -5.814   7.852
  401    HB3  LEU  47          2HB       LEU  47  17.861  -7.119   7.086
  402    HG   LEU  47           HG       LEU  47  18.302  -4.130   6.721
  403   HD11  LEU  47          1HD1      LEU  47  20.470  -4.568   7.906
  404   HD12  LEU  47          2HD1      LEU  47  19.076  -4.987   8.931
  405   HD13  LEU  47          3HD1      LEU  47  19.996  -6.271   8.111
  406   HD21  LEU  47          1HD2      LEU  47  20.300  -4.789   5.426
  407   HD22  LEU  47          2HD2      LEU  47  19.816  -6.496   5.582
  408   HD23  LEU  47          3HD2      LEU  47  18.785  -5.356   4.686
  409    H    LEU  48           H        LEU  48  14.188  -5.811   7.197
  410    HA   LEU  48           HA       LEU  48  13.847  -8.699   7.201
  411    HB2  LEU  48          1HB       LEU  48  12.512  -6.419   8.521
  412    HB3  LEU  48          2HB       LEU  48  12.009  -8.080   8.915
  413    HG   LEU  48           HG       LEU  48  14.724  -6.816   9.464
  414   HD11  LEU  48          1HD1      LEU  48  14.086  -7.152  11.867
  415   HD12  LEU  48          2HD1      LEU  48  12.924  -6.095  11.032
  416   HD13  LEU  48          3HD1      LEU  48  12.514  -7.799  11.344
  417   HD21  LEU  48          1HD2      LEU  48  15.277  -8.940  10.597
  418   HD22  LEU  48          2HD2      LEU  48  13.726  -9.619  10.042
  419   HD23  LEU  48          3HD2      LEU  48  14.968  -9.150   8.857
  420    H    VAL  49           H        VAL  49  12.122  -5.664   6.262
  421    HA   VAL  49           HA       VAL  49  10.323  -7.361   4.676
  422    HB   VAL  49           HB       VAL  49   8.553  -5.618   5.114
  423   HG11  VAL  49          1HG1      VAL  49   8.032  -6.352   7.416
  424   HG12  VAL  49          2HG1      VAL  49   8.600  -7.714   6.423
  425   HG13  VAL  49          3HG1      VAL  49   9.696  -6.955   7.600
  426   HG21  VAL  49          1HG2      VAL  49   8.842  -4.064   6.977
  427   HG22  VAL  49          2HG2      VAL  49  10.536  -4.584   7.145
  428   HG23  VAL  49          3HG2      VAL  49  10.002  -3.756   5.663
  429    H    LYS  50           H        LYS  50   9.661  -6.490   2.641
  430    HA   LYS  50           HA       LYS  50  11.412  -4.308   1.759
  431    HB2  LYS  50          1HB       LYS  50  11.751  -6.441   0.621
  432    HB3  LYS  50          2HB       LYS  50  10.014  -6.530   0.242
  433    HG2  LYS  50          1HG       LYS  50  10.234  -4.507  -1.166
  434    HG3  LYS  50          2HG       LYS  50  11.979  -4.469  -0.815
  435    HD2  LYS  50          1HD       LYS  50  12.253  -6.670  -1.861
  436    HD3  LYS  50          2HD       LYS  50  10.504  -6.747  -2.182
  437    HE2  LYS  50          1HE       LYS  50  10.696  -4.721  -3.588
  438    HE3  LYS  50          2HE       LYS  50  12.451  -4.706  -3.302
  439    HZ1  LYS  50          1HZ       LYS  50  11.899  -5.746  -5.396
  440    HZ2  LYS  50          2HZ       LYS  50  12.578  -6.852  -4.376
  441    HZ3  LYS  50          3HZ       LYS  50  10.950  -6.864  -4.641
  442    H    TYR  51           H        TYR  51  10.537  -2.580   0.518
  443    HA   TYR  51           HA       TYR  51   7.616  -2.360   0.812
  444    HB2  TYR  51          1HB       TYR  51   9.783  -0.267   1.008
  445    HB3  TYR  51          2HB       TYR  51   8.036   0.076   0.966
  446    HD1  TYR  51          1HD       TYR  51  10.817  -1.196   3.000
  447    HD2  TYR  51          2HD       TYR  51   6.612  -0.497   2.881
  448    HE1  TYR  51          1HE       TYR  51  10.705  -1.503   5.456
  449    HE2  TYR  51          2HE       TYR  51   6.482  -0.801   5.330
  450    HH   TYR  51           HH       TYR  51   9.374  -1.530   7.296
  451    H    VAL  52           H        VAL  52   6.511  -2.243  -1.077
  452    HA   VAL  52           HA       VAL  52   7.880  -0.892  -3.299
  453    HB   VAL  52           HB       VAL  52   5.905  -3.216  -3.466
  454   HG11  VAL  52          1HG1      VAL  52   6.370  -3.124  -5.893
  455   HG12  VAL  52          2HG1      VAL  52   5.661  -1.597  -5.319
  456   HG13  VAL  52          3HG1      VAL  52   7.408  -1.701  -5.640
  457   HG21  VAL  52          1HG2      VAL  52   7.772  -4.491  -4.394
  458   HG22  VAL  52          2HG2      VAL  52   8.861  -3.118  -4.086
  459   HG23  VAL  52          3HG2      VAL  52   8.087  -3.962  -2.724
  460    H    CYS  53           H        CYS  53   6.779   0.811  -4.189
  461    HA   CYS  53           HA       CYS  53   4.047   1.181  -3.194
  462    HB2  CYS  53          1HB       CYS  53   5.991   3.372  -3.907
  463    HB3  CYS  53          2HB       CYS  53   4.403   3.547  -3.156
  464    HG   CYS  53           HG       CYS  53   6.280   4.141  -1.409
  465    H    CYS  54           H        CYS  54   2.580   2.301  -4.747
  466    HA   CYS  54           HA       CYS  54   3.604   2.675  -7.414
  467    HB2  CYS  54          1HB       CYS  54   1.637   1.358  -8.355
  468    HB3  CYS  54          2HB       CYS  54   3.048   0.459  -7.786
  469    HG   CYS  54           HG       CYS  54   0.857  -0.906  -7.264
  470    H    ASN  55           H        ASN  55   2.091   4.076  -8.677
  471    HA   ASN  55           HA       ASN  55   0.928   5.776  -6.635
  472    HB2  ASN  55          1HB       ASN  55   1.669   7.731  -8.080
  473    HB3  ASN  55          2HB       ASN  55   2.769   6.386  -7.694
  474   HD21  ASN  55          1HD2      ASN  55   3.079   7.461 -11.272
  475   HD22  ASN  55          2HD2      ASN  55   3.083   8.313  -9.763
  476    H    THR  56           H        THR  56  -0.576   3.549  -7.880
  477    HA   THR  56           HA       THR  56  -2.723   5.172  -9.048
  478    HB   THR  56           HB       THR  56  -3.260   3.266 -10.576
  479    HG1  THR  56          1HG       THR  56  -1.612   1.645 -10.833
  480   HG21  THR  56          1HG2      THR  56  -1.421   3.613 -12.188
  481   HG22  THR  56          2HG2      THR  56  -1.905   5.148 -11.428
  482   HG23  THR  56          3HG2      THR  56  -0.423   4.319 -10.896
  483    H    ASP  57           H        ASP  57  -4.832   3.737  -9.106
  484    HA   ASP  57           HA       ASP  57  -5.177   3.258  -6.329
  485    HB2  ASP  57          1HB       ASP  57  -7.161   3.284  -8.670
  486    HB3  ASP  57          2HB       ASP  57  -7.470   2.832  -6.975
  487    HD2  ASP  57           HD       ASP  57  -7.368   6.605  -7.874
  488    H    ARG  58           H        ARG  58  -5.562   1.206  -5.336
  489    HA   ARG  58           HA       ARG  58  -5.761  -0.933  -5.091
  490    HB2  ARG  58          1HB       ARG  58  -7.226  -0.744  -7.763
  491    HB3  ARG  58          2HB       ARG  58  -7.286  -2.163  -6.705
  492    HG2  ARG  58          1HG       ARG  58  -8.476  -0.997  -5.026
  493    HG3  ARG  58          2HG       ARG  58  -8.021   0.593  -5.661
  494    HD2  ARG  58          1HD       ARG  58  -9.757  -1.374  -7.204
  495    HD3  ARG  58          2HD       ARG  58 -10.443  -0.173  -6.100
  496    HE   ARG  58           HE       ARG  58  -8.746   1.280  -7.773
  497   HH11  ARG  58          1HH1      ARG  58 -10.832   1.767 -10.518
  498   HH12  ARG  58          2HH1      ARG  58  -9.410   2.318  -9.658
  499   HH21  ARG  58          1HH2      ARG  58 -12.047  -0.041  -9.721
  500   HH22  ARG  58          2HH2      ARG  58 -11.539  -0.843  -8.272
  501    H    CYS  59           H        CYS  59  -3.315  -0.019  -6.374
  502    HA   CYS  59           HA       CYS  59  -2.810  -1.820  -8.558
  503    HB2  CYS  59          1HB       CYS  59  -0.553  -0.791  -8.531
  504    HB3  CYS  59          2HB       CYS  59  -1.880   0.347  -8.781
  505    HG   CYS  59           HG       CYS  59   0.028   1.505  -7.388
  506    H    ASN  60           H        ASN  60  -2.219  -1.474  -5.057
  507    HA   ASN  60           HA       ASN  60  -0.425  -3.746  -5.143
  508    HB2  ASN  60          1HB       ASN  60  -0.012  -3.177  -2.735
  509    HB3  ASN  60          2HB       ASN  60   0.311  -1.799  -3.803
  510   HD21  ASN  60          1HD2      ASN  60   0.036  -1.001  -1.418
  511   HD22  ASN  60          2HD2      ASN  60  -1.524  -0.358  -1.024
  Start of MODEL   19
    1    H1   MET   0          1H        MET   0 -10.594  10.931  -0.503
    2    H2   MET   0          2H        MET   0 -10.373  11.763  -1.732
    3    H    MET   0           H        MET   0 -10.882  10.335  -1.870
    4    H3   MET   0          3H        MET   0 -10.895  10.362  -1.858
    5    HA   MET   0           HA       MET   0  -8.218  11.143  -1.969
    6    HB2  MET   0          1HB       MET   0  -9.051   9.702   0.512
    7    HB3  MET   0          2HB       MET   0  -7.466   9.311  -0.197
    8    HG2  MET   0          1HG       MET   0  -6.991  10.961   1.404
    9    HG3  MET   0          2HG       MET   0  -7.017  11.833  -0.147
   10    HE1  MET   0          1HE       MET   0 -10.206  12.086   3.191
   11    HE2  MET   0          2HE       MET   0  -9.829  10.553   2.368
   12    HE3  MET   0          3HE       MET   0  -8.588  11.364   3.355
   13    H    LEU   1           H        LEU   1  -6.701   8.903  -2.014
   14    HA   LEU   1           HA       LEU   1  -7.962   7.492  -4.184
   15    HB2  LEU   1          1HB       LEU   1  -5.333   7.325  -2.843
   16    HB3  LEU   1          2HB       LEU   1  -5.620   6.443  -4.360
   17    HG   LEU   1           HG       LEU   1  -5.488   9.453  -3.952
   18   HD11  LEU   1          1HD1      LEU   1  -3.609   9.285  -5.605
   19   HD12  LEU   1          2HD1      LEU   1  -3.292   8.291  -4.165
   20   HD13  LEU   1          3HD1      LEU   1  -3.845   7.523  -5.673
   21   HD21  LEU   1          1HD2      LEU   1  -5.955   9.658  -6.369
   22   HD22  LEU   1          2HD2      LEU   1  -6.241   7.902  -6.445
   23   HD23  LEU   1          3HD2      LEU   1  -7.309   8.937  -5.467
   24    H    LYS   2           H        LYS   2  -7.118   4.953  -4.167
   25    HA   LYS   2           HA       LYS   2  -7.900   3.883  -1.549
   26    HB2  LYS   2          1HB       LYS   2  -8.732   2.885  -4.289
   27    HB3  LYS   2          2HB       LYS   2  -9.102   2.095  -2.737
   28    HG2  LYS   2          1HG       LYS   2 -10.454   4.033  -2.065
   29    HG3  LYS   2          2HG       LYS   2 -10.074   4.840  -3.604
   30    HD2  LYS   2          1HD       LYS   2 -11.190   3.045  -4.843
   31    HD3  LYS   2          2HD       LYS   2 -11.534   2.193  -3.319
   32    HE2  LYS   2          1HE       LYS   2 -12.804   4.242  -2.576
   33    HE3  LYS   2          2HE       LYS   2 -12.614   4.874  -4.228
   34    HZ1  LYS   2          1HZ       LYS   2 -14.721   3.758  -3.941
   35    HZ2  LYS   2          2HZ       LYS   2 -13.792   2.941  -5.033
   36    HZ3  LYS   2          3HZ       LYS   2 -13.970   2.357  -3.502
   37    H    CYS   3           H        CYS   3  -6.608   2.248  -0.785
   38    HA   CYS   3           HA       CYS   3  -4.765   1.077  -2.737
   39    HB2  CYS   3          1HB       CYS   3  -4.224   1.713   0.164
   40    HB3  CYS   3          2HB       CYS   3  -3.138   0.808  -0.895
   41    HG   CYS   3           HG       CYS   3  -2.166   3.219  -0.479
   42    H    ASN   4           H        ASN   4  -4.185  -1.232  -2.206
   43    HA   ASN   4           HA       ASN   4  -6.654  -2.499  -1.680
   44    HB2  ASN   4          1HB       ASN   4  -3.969  -3.811  -2.524
   45    HB3  ASN   4          2HB       ASN   4  -5.562  -4.433  -2.026
   46   HD21  ASN   4          1HD2      ASN   4  -5.151  -3.895  -5.779
   47   HD22  ASN   4          2HD2      ASN   4  -4.050  -4.513  -4.592
   48    H    LYS   5           H        LYS   5  -6.798  -4.443  -0.132
   49    HA   LYS   5           HA       LYS   5  -4.892  -4.284   2.074
   50    HB2  LYS   5          1HB       LYS   5  -6.760  -2.883   2.733
   51    HB3  LYS   5          2HB       LYS   5  -7.914  -4.156   2.272
   52    HG2  LYS   5          1HG       LYS   5  -6.882  -5.612   4.054
   53    HG3  LYS   5          2HG       LYS   5  -5.949  -4.192   4.583
   54    HD2  LYS   5          1HD       LYS   5  -7.859  -4.277   5.995
   55    HD3  LYS   5          2HD       LYS   5  -8.169  -2.977   4.819
   56    HE2  LYS   5          1HE       LYS   5  -9.577  -4.440   3.499
   57    HE3  LYS   5          2HE       LYS   5  -9.179  -5.823   4.544
   58    HZ1  LYS   5          1HZ       LYS   5 -11.318  -4.880   5.092
   59    HZ2  LYS   5          2HZ       LYS   5 -10.274  -4.687   6.355
   60    HZ3  LYS   5          3HZ       LYS   5 -10.643  -3.404   5.386
   61    H    LEU   6           H        LEU   6  -8.059  -5.975   1.807
   62    HA   LEU   6           HA       LEU   6  -6.536  -8.480   1.902
   63    HB2  LEU   6          1HB       LEU   6  -7.858  -8.012   3.752
   64    HB3  LEU   6          2HB       LEU   6  -9.379  -7.786   2.858
   65    HG   LEU   6           HG       LEU   6  -9.114 -10.200   2.076
   66   HD11  LEU   6          1HD1      LEU   6  -7.705 -11.663   3.548
   67   HD12  LEU   6          2HD1      LEU   6  -6.714 -10.456   2.697
   68   HD13  LEU   6          3HD1      LEU   6  -7.132 -10.216   4.410
   69   HD21  LEU   6          1HD2      LEU   6 -10.064 -11.128   4.159
   70   HD22  LEU   6          2HD2      LEU   6  -9.539  -9.666   5.029
   71   HD23  LEU   6          3HD2      LEU   6 -10.755  -9.543   3.735
   72    H    VAL   7           H        VAL   7  -6.861 -10.062   0.355
   73    HA   VAL   7           HA       VAL   7  -8.010  -9.344  -2.087
   74    HB   VAL   7           HB       VAL   7  -7.809 -11.778  -2.625
   75   HG11  VAL   7          1HG1      VAL   7  -5.369 -11.974  -2.270
   76   HG12  VAL   7          2HG1      VAL   7  -5.812 -10.328  -2.783
   77   HG13  VAL   7          3HG1      VAL   7  -5.438 -10.659  -1.074
   78   HG21  VAL   7          1HG2      VAL   7  -6.948 -13.338  -0.954
   79   HG22  VAL   7          2HG2      VAL   7  -7.072 -12.072   0.290
   80   HG23  VAL   7          3HG2      VAL   7  -8.541 -12.689  -0.504
   81    HA   PRO   8           HA       PRO   8  -8.803 -10.478  -3.578
   82    HB2  PRO   8          1HB       PRO   8 -10.648 -10.199  -5.530
   83    HB3  PRO   8          2HB       PRO   8 -10.437 -11.774  -4.753
   84    HG2  PRO   8          1HG       PRO   8 -12.491  -9.621  -4.174
   85    HG3  PRO   8          2HG       PRO   8 -12.716 -11.370  -4.290
   86    HD2  PRO   8          1HD       PRO   8 -12.433 -10.044  -1.865
   87    HD3  PRO   8          2HD       PRO   8 -11.979 -11.738  -2.085
   88    H    ILE   9           H        ILE   9 -11.310  -8.171  -2.780
   89    HA   ILE   9           HA       ILE   9  -9.857  -6.238  -4.450
   90    HB   ILE   9           HB       ILE   9 -12.854  -6.434  -3.869
   91   HG12  ILE   9          1HG1      ILE   9 -12.149  -8.146  -5.374
   92   HG13  ILE   9          2HG1      ILE   9 -13.107  -6.908  -6.219
   93   HG21  ILE   9          1HG2      ILE   9 -13.059  -4.572  -5.482
   94   HG22  ILE   9          2HG2      ILE   9 -12.072  -4.099  -4.079
   95   HG23  ILE   9          3HG2      ILE   9 -11.287  -4.501  -5.624
   96   HD11  ILE   9          1HD1      ILE   9 -11.196  -7.642  -7.589
   97   HD12  ILE   9          2HD1      ILE   9 -11.039  -5.930  -7.133
   98   HD13  ILE   9          3HD1      ILE   9 -10.081  -7.169  -6.288
   99    H    ALA  10           H        ALA  10 -11.096  -7.100  -1.309
  100    HA   ALA  10           HA       ALA  10 -12.005  -4.797  -0.255
  101    HB1  ALA  10          1HB       ALA  10 -12.054  -6.164   1.523
  102    HB2  ALA  10          2HB       ALA  10 -10.984  -7.305   0.673
  103    HB3  ALA  10          3HB       ALA  10 -10.289  -6.022   1.691
  104    H    TYR  11           H        TYR  11 -11.189  -2.845   0.515
  105    HA   TYR  11           HA       TYR  11  -8.318  -2.421   0.178
  106    HB2  TYR  11          1HB       TYR  11  -8.722  -0.449  -1.180
  107    HB3  TYR  11          2HB       TYR  11  -9.274  -1.942  -1.977
  108    HD1  TYR  11          1HD       TYR  11 -10.364   1.187  -0.338
  109    HD2  TYR  11          2HD       TYR  11 -11.620  -2.302  -2.443
  110    HE1  TYR  11          1HE       TYR  11 -12.604   2.196  -0.656
  111    HE2  TYR  11          2HE       TYR  11 -13.861  -1.310  -2.770
  112    HH   TYR  11           HH       TYR  11 -15.255   0.432  -2.241
  113    H    LYS  12           H        LYS  12  -7.631  -0.243   1.037
  114    HA   LYS  12           HA       LYS  12  -9.529   0.704   3.068
  115    HB2  LYS  12          1HB       LYS  12  -6.508   0.833   2.861
  116    HB3  LYS  12          2HB       LYS  12  -7.450   1.753   4.059
  117    HG2  LYS  12          1HG       LYS  12  -8.337  -0.408   4.945
  118    HG3  LYS  12          2HG       LYS  12  -7.260  -1.268   3.820
  119    HD2  LYS  12          1HD       LYS  12  -5.303  -0.250   4.875
  120    HD3  LYS  12          2HD       LYS  12  -6.356   0.681   5.965
  121    HE2  LYS  12          1HE       LYS  12  -7.251  -1.468   6.856
  122    HE3  LYS  12          2HE       LYS  12  -6.072  -2.335   5.846
  123    HZ1  LYS  12          1HZ       LYS  12  -5.277  -2.050   8.093
  124    HZ2  LYS  12          2HZ       LYS  12  -4.317  -1.214   7.043
  125    HZ3  LYS  12          3HZ       LYS  12  -5.410  -0.410   7.980
  126    H    THR  13           H        THR  13  -9.933   2.960   3.249
  127    HA   THR  13           HA       THR  13  -9.411   4.447   0.815
  128    HB   THR  13           HB       THR  13 -10.876   5.177   3.399
  129    HG1  THR  13          1HG       THR  13 -12.733   4.867   2.032
  130   HG21  THR  13          1HG2      THR  13 -11.784   7.066   2.091
  131   HG22  THR  13          2HG2      THR  13 -10.010   7.162   2.208
  132   HG23  THR  13          3HG2      THR  13 -10.775   6.593   0.705
  133    H    CYS  14           H        CYS  14  -7.853   5.937   0.496
  134    HA   CYS  14           HA       CYS  14  -5.736   5.815   2.345
  135    HB2  CYS  14          1HB       CYS  14  -6.167   7.408  -0.175
  136    HB3  CYS  14          2HB       CYS  14  -4.677   7.492   0.769
  137    HG   CYS  14           HG       CYS  14  -4.279   6.042  -1.391
  138    HA   PRO  15           HA       PRO  15  -6.704   9.461   4.632
  139    HB2  PRO  15          1HB       PRO  15  -4.371   9.948   5.906
  140    HB3  PRO  15          2HB       PRO  15  -5.358   8.560   6.388
  141    HG2  PRO  15          1HG       PRO  15  -2.981   8.647   4.498
  142    HG3  PRO  15          2HG       PRO  15  -3.321   7.500   5.800
  143    HD2  PRO  15          1HD       PRO  15  -3.888   6.926   3.164
  144    HD3  PRO  15          2HD       PRO  15  -4.851   6.264   4.491
  145    H    GLU  16           H        GLU  16  -6.455  11.748   4.664
  146    HA   GLU  16           HA       GLU  16  -5.807  12.722   2.178
  147    HB2  GLU  16          1HB       GLU  16  -7.258  13.844   3.797
  148    HB3  GLU  16          2HB       GLU  16  -5.866  14.116   4.873
  149    HG2  GLU  16          1HG       GLU  16  -4.861  15.654   3.116
  150    HG3  GLU  16          2HG       GLU  16  -6.282  15.233   2.131
  151    HE2  GLU  16           HE       GLU  16  -6.989  18.301   3.896
  152    H    GLY  17           H        GLY  17  -3.944  13.571   1.233
  153    HA2  GLY  17          1HA       GLY  17  -1.854  14.629   1.353
  154    HA3  GLY  17          2HA       GLY  17  -1.598  13.968   2.956
  155    H    LYS  18           H        LYS  18  -2.730  11.255   1.951
  156    HA   LYS  18           HA       LYS  18  -0.212  10.321   0.853
  157    HB2  LYS  18          1HB       LYS  18  -2.717   8.958   1.875
  158    HB3  LYS  18          2HB       LYS  18  -1.349   8.079   1.150
  159    HG2  LYS  18          1HG       LYS  18  -1.339   8.060   3.649
  160    HG3  LYS  18          2HG       LYS  18   0.122   8.776   2.931
  161    HD2  LYS  18          1HD       LYS  18  -1.899  10.807   3.326
  162    HD3  LYS  18          2HD       LYS  18  -1.609   9.928   4.845
  163    HE2  LYS  18          1HE       LYS  18   0.913  10.251   4.229
  164    HE3  LYS  18          2HE       LYS  18   0.299  11.550   3.180
  165    HZ1  LYS  18          1HZ       LYS  18   0.903  12.373   5.354
  166    HZ2  LYS  18          2HZ       LYS  18  -0.721  12.542   5.116
  167    HZ3  LYS  18          3HZ       LYS  18  -0.151  11.337   6.089
  168    H    ASN  19           H        ASN  19  -0.256   8.766  -1.035
  169    HA   ASN  19           HA       ASN  19  -2.280   9.487  -2.933
  170    HB2  ASN  19          1HB       ASN  19  -0.673  11.565  -3.015
  171    HB3  ASN  19          2HB       ASN  19   0.469  10.209  -3.186
  172   HD21  ASN  19          1HD2      ASN  19   0.390  10.451  -6.605
  173   HD22  ASN  19          2HD2      ASN  19   1.277  10.255  -5.130
  174    H    LEU  20           H        LEU  20   0.695   7.857  -1.878
  175    HA   LEU  20           HA       LEU  20   0.745   6.194  -4.267
  176    HB2  LEU  20          1HB       LEU  20   2.615   6.235  -1.910
  177    HB3  LEU  20          2HB       LEU  20   2.866   5.417  -3.462
  178    HG   LEU  20           HG       LEU  20   2.814   8.398  -2.928
  179   HD11  LEU  20          1HD1      LEU  20   5.076   8.408  -3.077
  180   HD12  LEU  20          2HD1      LEU  20   4.868   6.749  -2.467
  181   HD13  LEU  20          3HD1      LEU  20   5.127   7.030  -4.206
  182   HD21  LEU  20          1HD2      LEU  20   3.039   6.928  -5.570
  183   HD22  LEU  20          2HD2      LEU  20   1.727   8.011  -5.048
  184   HD23  LEU  20          3HD2      LEU  20   3.358   8.663  -5.330
  185    H    CYS  21           H        CYS  21   0.553   3.877  -4.170
  186    HA   CYS  21           HA       CYS  21  -0.546   2.918  -1.629
  187    HB2  CYS  21          1HB       CYS  21  -0.960   1.925  -4.446
  188    HB3  CYS  21          2HB       CYS  21  -1.454   1.020  -3.010
  189    HG   CYS  21           HG       CYS  21  -3.568   2.093  -4.157
  190    H    TYR  22           H        TYR  22   0.571   1.240  -0.588
  191    HA   TYR  22           HA       TYR  22   2.995   0.309  -1.978
  192    HB2  TYR  22          1HB       TYR  22   4.208   0.472   0.025
  193    HB3  TYR  22          2HB       TYR  22   3.363   2.023  -0.202
  194    HD1  TYR  22          1HD       TYR  22   3.413  -1.121   1.761
  195    HD2  TYR  22          2HD       TYR  22   1.712   2.770   1.375
  196    HE1  TYR  22          1HE       TYR  22   2.419  -1.341   4.020
  197    HE2  TYR  22          2HE       TYR  22   0.713   2.568   3.628
  198    HH   TYR  22           HH       TYR  22   0.453   1.258   5.472
  199    H    LYS  23           H        LYS  23   3.744  -1.846  -1.409
  200    HA   LYS  23           HA       LYS  23   1.936  -3.322   0.361
  201    HB2  LYS  23          1HB       LYS  23   2.256  -5.309  -1.034
  202    HB3  LYS  23          2HB       LYS  23   1.432  -4.001  -1.917
  203    HG2  LYS  23          1HG       LYS  23   3.488  -3.452  -3.099
  204    HG3  LYS  23          2HG       LYS  23   4.386  -4.666  -2.156
  205    HD2  LYS  23          1HD       LYS  23   3.693  -5.372  -4.497
  206    HD3  LYS  23          2HD       LYS  23   3.222  -6.469  -3.177
  207    HE2  LYS  23          1HE       LYS  23   0.970  -5.531  -3.165
  208    HE3  LYS  23          2HE       LYS  23   1.429  -4.363  -4.424
  209    HZ1  LYS  23          1HZ       LYS  23   0.262  -6.249  -5.345
  210    HZ2  LYS  23          2HZ       LYS  23   1.813  -6.211  -5.910
  211    HZ3  LYS  23          3HZ       LYS  23   1.387  -7.295  -4.742
  212    H    MET  24           H        MET  24   2.984  -5.026   1.587
  213    HA   MET  24           HA       MET  24   5.850  -4.500   1.764
  214    HB2  MET  24          1HB       MET  24   3.806  -5.121   3.905
  215    HB3  MET  24          2HB       MET  24   5.563  -5.097   4.190
  216    HG2  MET  24          1HG       MET  24   5.660  -2.737   3.617
  217    HG3  MET  24          2HG       MET  24   3.928  -2.738   3.210
  218    HE1  MET  24          1HE       MET  24   5.439  -3.539   7.520
  219    HE2  MET  24          2HE       MET  24   5.460  -4.745   6.209
  220    HE3  MET  24          3HE       MET  24   6.537  -3.328   6.135
  221    H    PHE  25           H        PHE  25   7.255  -6.259   1.812
  222    HA   PHE  25           HA       PHE  25   5.964  -8.897   1.879
  223    HB2  PHE  25          1HB       PHE  25   8.573  -7.841   0.643
  224    HB3  PHE  25          2HB       PHE  25   8.094  -9.541   0.597
  225    HD1  PHE  25          1HD       PHE  25   6.387 -10.290  -0.909
  226    HD2  PHE  25          2HD       PHE  25   7.401  -6.180  -0.704
  227    HE1  PHE  25          1HE       PHE  25   5.123  -9.871  -3.050
  228    HE2  PHE  25          2HE       PHE  25   6.151  -5.759  -2.839
  229    HZ   PHE  25           HZ       PHE  25   5.028  -7.609  -3.987
  230    H    MET  26           H        MET  26   7.309 -10.673   2.882
  231    HA   MET  26           HA       MET  26   9.365  -9.579   4.642
  232    HB2  MET  26          1HB       MET  26   7.710 -12.106   4.829
  233    HB3  MET  26          2HB       MET  26   9.076 -11.725   5.905
  234    HG2  MET  26          1HG       MET  26   7.896  -9.734   6.710
  235    HG3  MET  26          2HG       MET  26   6.536 -10.089   5.618
  236    HE1  MET  26          1HE       MET  26   5.056 -10.854   9.201
  237    HE2  MET  26          2HE       MET  26   6.230  -9.581   8.783
  238    HE3  MET  26          3HE       MET  26   4.858  -9.920   7.699
  239    H    MET  27           H        MET  27  11.445 -10.604   4.688
  240    HA   MET  27           HA       MET  27  12.405 -11.173   2.242
  241    HB2  MET  27          1HB       MET  27  13.334 -11.914   5.010
  242    HB3  MET  27          2HB       MET  27  14.301 -12.326   3.573
  243    HG2  MET  27          1HG       MET  27  13.469  -9.539   4.440
  244    HG3  MET  27          2HG       MET  27  15.090 -10.252   4.622
  245    HE1  MET  27          1HE       MET  27  16.342 -10.541   0.945
  246    HE2  MET  27          2HE       MET  27  16.769 -10.664   2.670
  247    HE3  MET  27          3HE       MET  27  15.592 -11.796   1.958
  248    H    SER  28           H        SER  28  10.934 -13.427   4.585
  249    HA   SER  28           HA       SER  28  11.650 -15.770   3.276
  250    HB2  SER  28          1HB       SER  28  10.748 -15.723   5.534
  251    HB3  SER  28          2HB       SER  28   9.207 -15.071   4.933
  252    HG   SER  28           HG       SER  28   9.134 -17.330   5.297
  253    H    ASP  29           H        ASP  29   8.454 -14.010   3.241
  254    HA   ASP  29           HA       ASP  29   7.821 -15.477   0.840
  255    HB2  ASP  29          1HB       ASP  29   6.166 -15.363   2.797
  256    HB3  ASP  29          2HB       ASP  29   6.204 -13.616   2.452
  257    HD2  ASP  29           HD       ASP  29   3.363 -15.116   0.730
  258    H    LEU  30           H        LEU  30   9.306 -14.206  -0.580
  259    HA   LEU  30           HA       LEU  30   8.793 -11.404  -0.898
  260    HB2  LEU  30          1HB       LEU  30  10.423 -13.527  -2.011
  261    HB3  LEU  30          2HB       LEU  30  10.233 -12.165  -3.139
  262    HG   LEU  30           HG       LEU  30  11.705 -10.883  -2.012
  263   HD11  LEU  30          1HD1      LEU  30  11.700 -10.655   0.486
  264   HD12  LEU  30          2HD1      LEU  30  10.057 -10.506  -0.179
  265   HD13  LEU  30          3HD1      LEU  30  10.570 -12.025   0.594
  266   HD21  LEU  30          1HD2      LEU  30  13.382 -12.096  -0.663
  267   HD22  LEU  30          2HD2      LEU  30  12.283 -13.494  -0.584
  268   HD23  LEU  30          3HD2      LEU  30  12.940 -12.965  -2.152
  269    H    THR  31           H        THR  31   7.305 -14.356  -1.906
  270    HA   THR  31           HA       THR  31   6.631 -13.529  -4.556
  271    HB   THR  31           HB       THR  31   5.496 -15.738  -2.772
  272    HG1  THR  31          1HG       THR  31   6.924 -17.048  -4.059
  273   HG21  THR  31          1HG2      THR  31   4.700 -16.725  -4.891
  274   HG22  THR  31          2HG2      THR  31   3.977 -15.122  -4.622
  275   HG23  THR  31          3HG2      THR  31   5.313 -15.313  -5.782
  276    H    ILE  32           H        ILE  32   4.933 -13.579  -1.380
  277    HA   ILE  32           HA       ILE  32   2.801 -12.041  -2.686
  278    HB   ILE  32           HB       ILE  32   2.560 -14.293  -0.636
  279   HG12  ILE  32          1HG1      ILE  32   2.766 -15.016  -2.924
  280   HG13  ILE  32          2HG1      ILE  32   1.156 -15.357  -2.249
  281   HG21  ILE  32          1HG2      ILE  32   0.140 -13.792  -0.616
  282   HG22  ILE  32          2HG2      ILE  32   1.084 -12.409  -0.017
  283   HG23  ILE  32          3HG2      ILE  32   0.421 -12.385  -1.667
  284   HD11  ILE  32          1HD1      ILE  32   0.995 -14.568  -4.577
  285   HD12  ILE  32          2HD1      ILE  32   0.237 -13.414  -3.453
  286   HD13  ILE  32          3HD1      ILE  32   1.848 -13.072  -4.129
  287    HA   PRO  33           HA       PRO  33   3.814  -9.302   0.552
  288    HB2  PRO  33          1HB       PRO  33   2.123  -7.263  -0.034
  289    HB3  PRO  33          2HB       PRO  33   3.559  -7.537  -1.029
  290    HG2  PRO  33          1HG       PRO  33   0.707  -8.466  -1.502
  291    HG3  PRO  33          2HG       PRO  33   1.841  -7.737  -2.647
  292    HD2  PRO  33          1HD       PRO  33   1.446 -10.457  -2.535
  293    HD3  PRO  33          2HD       PRO  33   3.010  -9.768  -2.986
  294    H    VAL  34           H        VAL  34   2.862  -8.263   2.496
  295    HA   VAL  34           HA       VAL  34   0.777 -10.163   3.324
  296    HB   VAL  34           HB       VAL  34   1.893 -10.157   5.558
  297   HG11  VAL  34          1HG1      VAL  34   3.875 -11.494   4.925
  298   HG12  VAL  34          2HG1      VAL  34   2.469 -11.917   3.921
  299   HG13  VAL  34          3HG1      VAL  34   3.756 -10.881   3.260
  300   HG21  VAL  34          1HG2      VAL  34   4.130  -9.207   5.815
  301   HG22  VAL  34          2HG2      VAL  34   4.020  -8.511   4.180
  302   HG23  VAL  34          3HG2      VAL  34   2.911  -7.961   5.459
  303    H    LYS  35           H        LYS  35   1.930  -6.864   3.137
  304    HA   LYS  35           HA       LYS  35  -0.505  -6.020   4.493
  305    HB2  LYS  35          1HB       LYS  35   2.316  -5.125   5.122
  306    HB3  LYS  35          2HB       LYS  35   0.877  -4.171   5.552
  307    HG2  LYS  35          1HG       LYS  35   0.060  -6.056   6.931
  308    HG3  LYS  35          2HG       LYS  35   1.531  -6.973   6.529
  309    HD2  LYS  35          1HD       LYS  35   2.089  -6.059   8.592
  310    HD3  LYS  35          2HD       LYS  35   2.779  -4.873   7.459
  311    HE2  LYS  35          1HE       LYS  35   0.876  -3.413   7.737
  312    HE3  LYS  35          2HE       LYS  35   0.038  -4.629   8.728
  313    HZ1  LYS  35          1HZ       LYS  35   1.054  -2.926  10.082
  314    HZ2  LYS  35          2HZ       LYS  35   1.768  -4.384  10.377
  315    HZ3  LYS  35          3HZ       LYS  35   2.545  -3.257   9.458
  316    H    ARG  36           H        ARG  36  -1.499  -4.309   3.477
  317    HA   ARG  36           HA       ARG  36   0.149  -2.785   1.653
  318    HB2  ARG  36          1HB       ARG  36  -2.476  -3.980   0.852
  319    HB3  ARG  36          2HB       ARG  36  -1.508  -2.824  -0.093
  320    HG2  ARG  36          1HG       ARG  36  -0.835  -4.771  -1.089
  321    HG3  ARG  36          2HG       ARG  36   0.363  -4.682   0.225
  322    HD2  ARG  36          1HD       ARG  36  -0.498  -6.904  -0.020
  323    HD3  ARG  36          2HD       ARG  36  -0.976  -6.203   1.544
  324    HE   ARG  36           HE       ARG  36  -3.312  -6.428   0.795
  325   HH11  ARG  36          1HH1      ARG  36  -1.175  -6.844  -1.929
  326   HH12  ARG  36          2HH1      ARG  36  -2.516  -7.417  -2.902
  327   HH21  ARG  36          1HH2      ARG  36  -4.859  -7.074  -0.309
  328   HH22  ARG  36          2HH2      ARG  36  -4.618  -7.547  -1.978
  329    H    GLY  37           H        GLY  37  -0.754  -0.610   1.195
  330    HA2  GLY  37          1HA       GLY  37  -3.132   0.348   2.351
  331    HA3  GLY  37          2HA       GLY  37  -1.820   0.585   3.489
  332    H    CYS  38           H        CYS  38  -2.298   2.941   3.108
  333    HA   CYS  38           HA       CYS  38  -1.340   3.841   0.495
  334    HB2  CYS  38          1HB       CYS  38  -3.036   5.084   2.788
  335    HB3  CYS  38          2HB       CYS  38  -2.782   5.866   1.210
  336    HG   CYS  38           HG       CYS  38  -5.226   5.082   1.428
  337    H    ILE  39           H        ILE  39   0.246   5.601   0.457
  338    HA   ILE  39           HA       ILE  39   0.923   6.871   2.920
  339    HB   ILE  39           HB       ILE  39   2.371   4.760   2.944
  340   HG12  ILE  39          1HG1      ILE  39   4.050   7.218   2.666
  341   HG13  ILE  39          2HG1      ILE  39   2.866   7.039   3.982
  342   HG21  ILE  39          1HG2      ILE  39   4.294   4.721   1.392
  343   HG22  ILE  39          2HG2      ILE  39   2.756   4.622   0.505
  344   HG23  ILE  39          3HG2      ILE  39   3.654   6.157   0.560
  345   HD11  ILE  39          1HD1      ILE  39   5.119   6.365   4.716
  346   HD12  ILE  39          2HD1      ILE  39   4.001   4.981   4.724
  347   HD13  ILE  39          3HD1      ILE  39   5.185   5.161   3.409
  348    H    ASP  40           H        ASP  40   2.516   8.681   2.517
  349    HA   ASP  40           HA       ASP  40   1.920   9.761  -0.073
  350    HB2  ASP  40          1HB       ASP  40   2.898  11.904   0.933
  351    HB3  ASP  40          2HB       ASP  40   1.521  11.077   1.703
  352    HD2  ASP  40           HD       ASP  40   4.146  11.972   4.154
  353    H    VAL  41           H        VAL  41   4.759   8.958   2.047
  354    HA   VAL  41           HA       VAL  41   6.479   9.207  -0.324
  355    HB   VAL  41           HB       VAL  41   7.171   9.515   2.637
  356   HG11  VAL  41          1HG1      VAL  41   9.412  10.161   1.814
  357   HG12  VAL  41          2HG1      VAL  41   9.009   8.496   1.333
  358   HG13  VAL  41          3HG1      VAL  41   8.898   9.817   0.146
  359   HG21  VAL  41          1HG2      VAL  41   7.633  11.849   2.079
  360   HG22  VAL  41          2HG2      VAL  41   7.055  11.565   0.419
  361   HG23  VAL  41          3HG2      VAL  41   5.931  11.417   1.792
  362    H    CYS  42           H        CYS  42   7.553   7.399  -1.005
  363    HA   CYS  42           HA       CYS  42   6.616   4.967   0.063
  364    HB2  CYS  42          1HB       CYS  42   7.073   5.347  -2.321
  365    HB3  CYS  42          2HB       CYS  42   8.800   5.460  -1.971
  366    HG   CYS  42           HG       CYS  42   8.286   3.170  -3.164
  367    HA   PRO  43           HA       PRO  43   9.793   4.620   3.070
  368    HB2  PRO  43          1HB       PRO  43   9.115   2.204   4.149
  369    HB3  PRO  43          2HB       PRO  43   8.189   3.661   4.538
  370    HG2  PRO  43          1HG       PRO  43   7.617   1.535   2.450
  371    HG3  PRO  43          2HG       PRO  43   6.501   2.313   3.582
  372    HD2  PRO  43          1HD       PRO  43   6.681   3.121   0.965
  373    HD3  PRO  43          2HD       PRO  43   6.311   4.270   2.258
  374    H    LYS  44           H        LYS  44  11.883   3.931   3.197
  375    HA   LYS  44           HA       LYS  44  12.755   2.553   0.880
  376    HB2  LYS  44          1HB       LYS  44  14.114   3.301   3.487
  377    HB3  LYS  44          2HB       LYS  44  14.957   2.591   2.089
  378    HG2  LYS  44          1HG       LYS  44  14.347   4.542   0.722
  379    HG3  LYS  44          2HG       LYS  44  13.495   5.253   2.114
  380    HD2  LYS  44          1HD       LYS  44  15.591   5.351   3.374
  381    HD3  LYS  44          2HD       LYS  44  16.456   4.586   2.020
  382    HE2  LYS  44          1HE       LYS  44  15.891   6.492   0.577
  383    HE3  LYS  44          2HE       LYS  44  15.020   7.257   1.926
  384    HZ1  LYS  44          1HZ       LYS  44  17.240   8.143   1.682
  385    HZ2  LYS  44          2HZ       LYS  44  17.100   7.356   3.125
  386    HZ3  LYS  44          3HZ       LYS  44  17.906   6.646   1.874
  387    H    ASN  45           H        ASN  45  14.090   0.520   0.940
  388    HA   ASN  45           HA       ASN  45  12.419  -1.425   2.092
  389    HB2  ASN  45          1HB       ASN  45  15.018  -1.920   0.466
  390    HB3  ASN  45          2HB       ASN  45  13.812  -2.942   1.282
  391   HD21  ASN  45          1HD2      ASN  45  13.120  -2.176  -2.410
  392   HD22  ASN  45          2HD2      ASN  45  14.618  -2.466  -1.590
  393    H    SER  46           H        SER  46  12.960  -2.947   3.797
  394    HA   SER  46           HA       SER  46  15.308  -2.150   5.331
  395    HB2  SER  46          1HB       SER  46  14.145  -2.989   7.294
  396    HB3  SER  46          2HB       SER  46  13.116  -1.823   6.432
  397    HG   SER  46           HG       SER  46  11.986  -3.578   5.552
  398    H    LEU  47           H        LEU  47  15.913  -4.233   6.892
  399    HA   LEU  47           HA       LEU  47  16.867  -6.131   4.981
  400    HB2  LEU  47          1HB       LEU  47  16.953  -5.865   7.920
  401    HB3  LEU  47          2HB       LEU  47  17.907  -7.148   7.139
  402    HG   LEU  47           HG       LEU  47  18.274  -4.147   6.790
  403   HD11  LEU  47          1HD1      LEU  47  20.482  -4.557   7.910
  404   HD12  LEU  47          2HD1      LEU  47  19.127  -5.020   8.965
  405   HD13  LEU  47          3HD1      LEU  47  20.050  -6.272   8.100
  406   HD21  LEU  47          1HD2      LEU  47  20.249  -4.743   5.432
  407   HD22  LEU  47          2HD2      LEU  47  19.806  -6.462   5.573
  408   HD23  LEU  47          3HD2      LEU  47  18.725  -5.330   4.723
  409    H    LEU  48           H        LEU  48  14.133  -5.844   7.163
  410    HA   LEU  48           HA       LEU  48  13.820  -8.742   7.256
  411    HB2  LEU  48          1HB       LEU  48  12.475  -6.436   8.523
  412    HB3  LEU  48          2HB       LEU  48  11.960  -8.087   8.937
  413    HG   LEU  48           HG       LEU  48  14.668  -6.819   9.504
  414   HD11  LEU  48          1HD1      LEU  48  14.002  -7.134  11.902
  415   HD12  LEU  48          2HD1      LEU  48  12.847  -6.089  11.044
  416   HD13  LEU  48          3HD1      LEU  48  12.438  -7.790  11.365
  417   HD21  LEU  48          1HD2      LEU  48  15.213  -8.930  10.664
  418   HD22  LEU  48          2HD2      LEU  48  13.672  -9.620  10.095
  419   HD23  LEU  48          3HD2      LEU  48  14.927  -9.158   8.922
  420    H    VAL  49           H        VAL  49  12.083  -5.723   6.275
  421    HA   VAL  49           HA       VAL  49  10.324  -7.444   4.672
  422    HB   VAL  49           HB       VAL  49   8.531  -5.720   5.078
  423   HG11  VAL  49          1HG1      VAL  49   7.994  -6.433   7.383
  424   HG12  VAL  49          2HG1      VAL  49   8.587  -7.800   6.412
  425   HG13  VAL  49          3HG1      VAL  49   9.663  -7.013   7.592
  426   HG21  VAL  49          1HG2      VAL  49   8.783  -4.140   6.925
  427   HG22  VAL  49          2HG2      VAL  49  10.482  -4.640   7.117
  428   HG23  VAL  49          3HG2      VAL  49   9.954  -3.835   5.620
  429    H    LYS  50           H        LYS  50   9.706  -6.611   2.615
  430    HA   LYS  50           HA       LYS  50  11.408  -4.385   1.752
  431    HB2  LYS  50          1HB       LYS  50  11.795  -6.504   0.606
  432    HB3  LYS  50          2HB       LYS  50  10.062  -6.633   0.225
  433    HG2  LYS  50          1HG       LYS  50  10.239  -4.598  -1.177
  434    HG3  LYS  50          2HG       LYS  50  11.984  -4.529  -0.827
  435    HD2  LYS  50          1HD       LYS  50  12.305  -6.711  -1.886
  436    HD3  LYS  50          2HD       LYS  50  10.555  -6.838  -2.190
  437    HE2  LYS  50          1HE       LYS  50  10.673  -4.809  -3.598
  438    HE3  LYS  50          2HE       LYS  50  12.430  -4.740  -3.328
  439    HZ1  LYS  50          1HZ       LYS  50  11.891  -5.797  -5.416
  440    HZ2  LYS  50          2HZ       LYS  50  12.613  -6.881  -4.404
  441    HZ3  LYS  50          3HZ       LYS  50  10.983  -6.944  -4.654
  442    H    TYR  51           H        TYR  51  10.507  -2.665   0.527
  443    HA   TYR  51           HA       TYR  51   7.576  -2.518   0.769
  444    HB2  TYR  51          1HB       TYR  51   9.681  -0.361   0.945
  445    HB3  TYR  51          2HB       TYR  51   7.924  -0.077   0.904
  446    HD1  TYR  51          1HD       TYR  51  10.748  -1.250   2.943
  447    HD2  TYR  51          2HD       TYR  51   6.528  -0.652   2.834
  448    HE1  TYR  51          1HE       TYR  51  10.653  -1.531   5.402
  449    HE2  TYR  51          2HE       TYR  51   6.414  -0.928   5.287
  450    HH   TYR  51           HH       TYR  51   7.581  -1.316   7.204
  451    H    VAL  52           H        VAL  52   6.460  -2.359  -1.115
  452    HA   VAL  52           HA       VAL  52   7.863  -1.069  -3.352
  453    HB   VAL  52           HB       VAL  52   5.822  -3.339  -3.490
  454   HG11  VAL  52          1HG1      VAL  52   6.283  -3.287  -5.919
  455   HG12  VAL  52          2HG1      VAL  52   5.619  -1.735  -5.359
  456   HG13  VAL  52          3HG1      VAL  52   7.362  -1.892  -5.684
  457   HG21  VAL  52          1HG2      VAL  52   7.651  -4.676  -4.406
  458   HG22  VAL  52          2HG2      VAL  52   8.778  -3.330  -4.117
  459   HG23  VAL  52          3HG2      VAL  52   7.984  -4.137  -2.744
  460    H    CYS  53           H        CYS  53   6.854   0.716  -4.150
  461    HA   CYS  53           HA       CYS  53   4.081   1.101  -3.284
  462    HB2  CYS  53          1HB       CYS  53   6.058   3.317  -3.777
  463    HB3  CYS  53          2HB       CYS  53   4.463   3.427  -3.030
  464    HG   CYS  53           HG       CYS  53   6.320   3.899  -1.225
  465    H    CYS  54           H        CYS  54   2.805   2.511  -4.850
  466    HA   CYS  54           HA       CYS  54   3.984   3.004  -7.401
  467    HB2  CYS  54          1HB       CYS  54   2.096   1.722  -8.578
  468    HB3  CYS  54          2HB       CYS  54   3.527   0.840  -8.035
  469    HG   CYS  54           HG       CYS  54   1.391  -0.670  -7.741
  470    H    ASN  55           H        ASN  55   2.342   4.307  -8.777
  471    HA   ASN  55           HA       ASN  55   1.315   6.021  -6.674
  472    HB2  ASN  55          1HB       ASN  55   2.105   7.972  -8.097
  473    HB3  ASN  55          2HB       ASN  55   3.156   6.572  -7.773
  474   HD21  ASN  55          1HD2      ASN  55   3.416   7.710 -11.332
  475   HD22  ASN  55          2HD2      ASN  55   3.506   8.524  -9.805
  476    H    THR  56           H        THR  56  -0.289   3.868  -7.964
  477    HA   THR  56           HA       THR  56  -2.426   5.610  -8.959
  478    HB   THR  56           HB       THR  56  -3.085   3.811 -10.567
  479    HG1  THR  56          1HG       THR  56  -1.499   2.162 -10.987
  480   HG21  THR  56          1HG2      THR  56  -1.306   4.199 -12.235
  481   HG22  THR  56          2HG2      THR  56  -1.710   5.701 -11.370
  482   HG23  THR  56          3HG2      THR  56  -0.233   4.802 -10.951
  483    H    ASP  57           H        ASP  57  -4.566   4.172  -9.049
  484    HA   ASP  57           HA       ASP  57  -4.905   3.673  -6.297
  485    HB2  ASP  57          1HB       ASP  57  -6.841   3.575  -8.670
  486    HB3  ASP  57          2HB       ASP  57  -7.166   3.067  -6.994
  487    HD2  ASP  57           HD       ASP  57  -7.180   6.880  -7.815
  488    H    ARG  58           H        ARG  58  -5.123   1.633  -5.252
  489    HA   ARG  58           HA       ARG  58  -5.089  -0.513  -4.957
  490    HB2  ARG  58          1HB       ARG  58  -6.806  -0.471  -7.481
  491    HB3  ARG  58          2HB       ARG  58  -6.667  -1.877  -6.412
  492    HG2  ARG  58          1HG       ARG  58  -7.751  -0.760  -4.622
  493    HG3  ARG  58          2HG       ARG  58  -7.503   0.841  -5.342
  494    HD2  ARG  58          1HD       ARG  58  -9.198  -1.294  -6.685
  495    HD3  ARG  58          2HD       ARG  58  -9.886  -0.184  -5.489
  496    HE   ARG  58           HE       ARG  58  -8.541   1.454  -7.308
  497   HH11  ARG  58          1HH1      ARG  58 -10.952   1.738  -9.802
  498   HH12  ARG  58          2HH1      ARG  58  -9.510   2.429  -9.089
  499   HH21  ARG  58          1HH2      ARG  58 -11.878  -0.196  -8.915
  500   HH22  ARG  58          2HH2      ARG  58 -11.134  -0.950  -7.542
  501    H    CYS  59           H        CYS  59  -2.842   0.540  -6.494
  502    HA   CYS  59           HA       CYS  59  -2.453  -1.214  -8.730
  503    HB2  CYS  59          1HB       CYS  59  -0.373   0.274  -8.852
  504    HB3  CYS  59          2HB       CYS  59  -1.773   1.291  -8.432
  505    HG   CYS  59           HG       CYS  59   0.335   2.136  -7.216
  506    H    ASN  60           H        ASN  60  -1.780  -1.073  -5.281
  507    HA   ASN  60           HA       ASN  60   0.254  -3.080  -5.448
  508    HB2  ASN  60          1HB       ASN  60   0.065  -3.029  -2.922
  509    HB3  ASN  60          2HB       ASN  60   0.401  -1.440  -3.628
  510   HD21  ASN  60          1HD2      ASN  60  -0.444  -0.978  -1.368
  511   HD22  ASN  60          2HD2      ASN  60  -2.138  -0.660  -1.206
  Start of MODEL   20
    1    H1   MET   0          1H        MET   0  -8.387  12.038  -2.828
    2    H2   MET   0          2H        MET   0  -6.911  12.012  -3.093
    3    H    MET   0           H        MET   0  -7.826  11.047  -3.834
    4    H3   MET   0          3H        MET   0  -7.824  11.079  -3.834
    5    HA   MET   0           HA       MET   0  -6.472  10.526  -1.459
    6    HB2  MET   0          1HB       MET   0  -9.486  10.571  -1.204
    7    HB3  MET   0          2HB       MET   0  -8.407   9.762  -0.044
    8    HG2  MET   0          1HG       MET   0  -7.367  11.882   0.526
    9    HG3  MET   0          2HG       MET   0  -8.342  12.721  -0.705
   10    HE1  MET   0          1HE       MET   0  -9.940  10.984   3.278
   11    HE2  MET   0          2HE       MET   0  -9.255   9.951   1.999
   12    HE3  MET   0          3HE       MET   0  -8.220  11.129   2.843
   13    H    LEU   1           H        LEU   1  -5.562   8.777  -2.596
   14    HA   LEU   1           HA       LEU   1  -7.129   7.336  -4.439
   15    HB2  LEU   1          1HB       LEU   1  -4.466   7.380  -3.322
   16    HB3  LEU   1          2HB       LEU   1  -4.828   5.809  -4.072
   17    HG   LEU   1           HG       LEU   1  -5.595   7.390  -6.088
   18   HD11  LEU   1          1HD1      LEU   1  -3.996   9.311  -6.309
   19   HD12  LEU   1          2HD1      LEU   1  -5.035   9.496  -4.878
   20   HD13  LEU   1          3HD1      LEU   1  -3.354   8.943  -4.691
   21   HD21  LEU   1          1HD2      LEU   1  -3.373   7.029  -7.106
   22   HD22  LEU   1          2HD2      LEU   1  -2.725   6.613  -5.501
   23   HD23  LEU   1          3HD2      LEU   1  -3.977   5.592  -6.248
   24    H    LYS   2           H        LYS   2  -6.812   4.721  -4.323
   25    HA   LYS   2           HA       LYS   2  -7.672   3.942  -1.623
   26    HB2  LYS   2          1HB       LYS   2  -8.532   2.581  -4.175
   27    HB3  LYS   2          2HB       LYS   2  -9.242   2.450  -2.548
   28    HG2  LYS   2          1HG       LYS   2  -9.324   4.972  -4.231
   29    HG3  LYS   2          2HG       LYS   2 -10.620   3.752  -4.217
   30    HD2  LYS   2          1HD       LYS   2 -10.958   4.088  -1.827
   31    HD3  LYS   2          2HD       LYS   2  -9.595   5.231  -1.770
   32    HE2  LYS   2          1HE       LYS   2 -11.731   6.423  -1.812
   33    HE3  LYS   2          2HE       LYS   2 -10.784   6.747  -3.282
   34    HZ1  LYS   2          1HZ       LYS   2 -13.092   6.320  -3.788
   35    HZ2  LYS   2          2HZ       LYS   2 -12.142   5.136  -4.435
   36    HZ3  LYS   2          3HZ       LYS   2 -13.021   4.836  -3.072
   37    H    CYS   3           H        CYS   3  -6.694   2.141  -0.736
   38    HA   CYS   3           HA       CYS   3  -4.763   0.804  -2.490
   39    HB2  CYS   3          1HB       CYS   3  -4.495   1.386   0.462
   40    HB3  CYS   3          2HB       CYS   3  -3.352   0.454  -0.508
   41    HG   CYS   3           HG       CYS   3  -2.316   2.804   0.066
   42    H    ASN   4           H        ASN   4  -4.473  -1.529  -2.026
   43    HA   ASN   4           HA       ASN   4  -7.042  -2.617  -1.515
   44    HB2  ASN   4          1HB       ASN   4  -4.476  -4.110  -2.431
   45    HB3  ASN   4          2HB       ASN   4  -6.106  -4.616  -1.926
   46   HD21  ASN   4          1HD2      ASN   4  -5.636  -3.944  -5.678
   47   HD22  ASN   4          2HD2      ASN   4  -4.540  -4.628  -4.525
   48    H    LYS   5           H        LYS   5  -7.432  -4.394   0.089
   49    HA   LYS   5           HA       LYS   5  -5.398  -4.593   2.179
   50    HB2  LYS   5          1HB       LYS   5  -8.355  -4.055   2.591
   51    HB3  LYS   5          2HB       LYS   5  -7.193  -4.456   3.877
   52    HG2  LYS   5          1HG       LYS   5  -6.943  -2.018   2.090
   53    HG3  LYS   5          2HG       LYS   5  -7.781  -2.000   3.660
   54    HD2  LYS   5          1HD       LYS   5  -5.729  -2.710   4.789
   55    HD3  LYS   5          2HD       LYS   5  -4.883  -2.802   3.225
   56    HE2  LYS   5          1HE       LYS   5  -4.933  -0.470   2.926
   57    HE3  LYS   5          2HE       LYS   5  -6.196  -0.251   4.159
   58    HZ1  LYS   5          1HZ       LYS   5  -4.037   0.425   4.966
   59    HZ2  LYS   5          2HZ       LYS   5  -4.583  -0.872   5.827
   60    HZ3  LYS   5          3HZ       LYS   5  -3.412  -1.075   4.684
   61    H    LEU   6           H        LEU   6  -8.808  -5.742   2.096
   62    HA   LEU   6           HA       LEU   6  -7.800  -8.442   2.373
   63    HB2  LEU   6          1HB       LEU   6  -9.462  -7.634   3.774
   64    HB3  LEU   6          2HB       LEU   6 -10.629  -7.240   2.490
   65    HG   LEU   6           HG       LEU   6 -10.589  -9.716   1.883
   66   HD11  LEU   6          1HD1      LEU   6  -9.888 -11.270   3.724
   67   HD12  LEU   6          2HD1      LEU   6  -8.515 -10.301   3.138
   68   HD13  LEU   6          3HD1      LEU   6  -9.320  -9.872   4.667
   69   HD21  LEU   6          1HD2      LEU   6 -12.196 -10.325   3.659
   70   HD22  LEU   6          2HD2      LEU   6 -11.673  -8.904   4.595
   71   HD23  LEU   6          3HD2      LEU   6 -12.469  -8.687   3.018
   72    H    VAL   7           H        VAL   7  -7.937 -10.055   0.840
   73    HA   VAL   7           HA       VAL   7  -8.269  -9.316  -1.846
   74    HB   VAL   7           HB       VAL   7  -8.225 -11.779  -2.273
   75   HG11  VAL   7          1HG1      VAL   7  -6.001 -12.218  -1.286
   76   HG12  VAL   7          2HG1      VAL   7  -6.102 -10.561  -1.925
   77   HG13  VAL   7          3HG1      VAL   7  -6.225 -10.848  -0.173
   78   HG21  VAL   7          1HG2      VAL   7  -8.015 -13.340  -0.406
   79   HG22  VAL   7          2HG2      VAL   7  -8.310 -12.010   0.739
   80   HG23  VAL   7          3HG2      VAL   7  -9.584 -12.503  -0.403
   81    HA   PRO   8           HA       PRO   8  -8.743 -10.426  -3.462
   82    HB2  PRO   8          1HB       PRO   8  -9.935 -10.171  -5.862
   83    HB3  PRO   8          2HB       PRO   8 -10.102 -11.692  -4.974
   84    HG2  PRO   8          1HG       PRO   8 -12.025  -9.356  -5.138
   85    HG3  PRO   8          2HG       PRO   8 -12.370 -11.089  -5.195
   86    HD2  PRO   8          1HD       PRO   8 -12.625  -9.546  -2.882
   87    HD3  PRO   8          2HD       PRO   8 -12.350 -11.293  -2.857
   88    H    ILE   9           H        ILE   9 -11.195  -7.920  -3.582
   89    HA   ILE   9           HA       ILE   9  -9.144  -6.193  -4.786
   90    HB   ILE   9           HB       ILE   9 -12.114  -6.300  -5.316
   91   HG12  ILE   9          1HG1      ILE   9 -10.896  -8.119  -6.364
   92   HG13  ILE   9          2HG1      ILE   9 -11.462  -6.961  -7.581
   93   HG21  ILE   9          1HG2      ILE   9 -11.080  -3.986  -5.271
   94   HG22  ILE   9          2HG2      ILE   9 -10.095  -4.500  -6.664
   95   HG23  ILE   9          3HG2      ILE   9 -11.870  -4.469  -6.790
   96   HD11  ILE   9          1HD1      ILE   9  -8.656  -6.924  -6.386
   97   HD12  ILE   9          2HD1      ILE   9  -9.072  -7.774  -7.894
   98   HD13  ILE   9          3HD1      ILE   9  -9.244  -6.006  -7.793
   99    H    ALA  10           H        ALA  10 -11.167  -6.826  -2.093
  100    HA   ALA  10           HA       ALA  10 -12.325  -4.486  -1.427
  101    HB1  ALA  10          1HB       ALA  10 -11.629  -6.922  -0.163
  102    HB2  ALA  10          2HB       ALA  10 -11.054  -5.627   0.914
  103    HB3  ALA  10          3HB       ALA  10 -12.764  -5.684   0.422
  104    H    TYR  11           H        TYR  11 -11.731  -2.468  -0.652
  105    HA   TYR  11           HA       TYR  11  -8.861  -2.023  -0.280
  106    HB2  TYR  11          1HB       TYR  11  -8.969  -0.078  -1.744
  107    HB3  TYR  11          2HB       TYR  11  -9.271  -1.608  -2.604
  108    HD1  TYR  11          1HD       TYR  11 -10.768   1.554  -1.446
  109    HD2  TYR  11          2HD       TYR  11 -11.463  -2.092  -3.546
  110    HE1  TYR  11          1HE       TYR  11 -12.890   2.478  -2.332
  111    HE2  TYR  11          2HE       TYR  11 -13.583  -1.186  -4.439
  112    HH   TYR  11           HH       TYR  11 -14.715   2.104  -3.631
  113    H    LYS  12           H        LYS  12  -8.389   0.138   0.695
  114    HA   LYS  12           HA       LYS  12 -10.737   1.232   2.077
  115    HB2  LYS  12          1HB       LYS  12  -7.950   0.644   3.080
  116    HB3  LYS  12          2HB       LYS  12  -8.998   1.848   3.867
  117    HG2  LYS  12          1HG       LYS  12 -10.701   0.064   4.230
  118    HG3  LYS  12          2HG       LYS  12  -9.561  -1.119   3.546
  119    HD2  LYS  12          1HD       LYS  12  -7.947  -0.618   5.320
  120    HD3  LYS  12          2HD       LYS  12  -9.047   0.611   5.990
  121    HE2  LYS  12          1HE       LYS  12 -10.743  -1.156   6.370
  122    HE3  LYS  12          2HE       LYS  12  -9.586  -2.367   5.774
  123    HZ1  LYS  12          1HZ       LYS  12  -9.592  -2.250   8.172
  124    HZ2  LYS  12          2HZ       LYS  12  -8.126  -1.771   7.586
  125    HZ3  LYS  12          3HZ       LYS  12  -9.200  -0.649   8.140
  126    H    THR  13           H        THR  13 -10.492   3.560   2.671
  127    HA   THR  13           HA       THR  13  -9.352   4.902   0.370
  128    HB   THR  13           HB       THR  13 -10.966   5.947   2.750
  129    HG1  THR  13          1HG       THR  13 -12.674   5.949   1.171
  130   HG21  THR  13          1HG2      THR  13 -11.338   7.932   1.327
  131   HG22  THR  13          2HG2      THR  13  -9.604   7.697   1.656
  132   HG23  THR  13          3HG2      THR  13 -10.282   7.235   0.077
  133    H    CYS  14           H        CYS  14  -7.533   6.087   0.292
  134    HA   CYS  14           HA       CYS  14  -5.741   5.825   2.446
  135    HB2  CYS  14          1HB       CYS  14  -5.638   7.426  -0.108
  136    HB3  CYS  14          2HB       CYS  14  -4.307   7.363   1.051
  137    HG   CYS  14           HG       CYS  14  -3.736   5.866  -1.039
  138    HA   PRO  15           HA       PRO  15  -6.698   9.498   4.618
  139    HB2  PRO  15          1HB       PRO  15  -4.389  10.076   5.921
  140    HB3  PRO  15          2HB       PRO  15  -5.351   8.672   6.401
  141    HG2  PRO  15          1HG       PRO  15  -2.956   8.793   4.533
  142    HG3  PRO  15          2HG       PRO  15  -3.277   7.659   5.851
  143    HD2  PRO  15          1HD       PRO  15  -3.796   6.994   3.244
  144    HD3  PRO  15          2HD       PRO  15  -4.805   6.381   4.561
  145    H    GLU  16           H        GLU  16  -6.545  11.800   4.691
  146    HA   GLU  16           HA       GLU  16  -5.831  12.873   2.264
  147    HB2  GLU  16          1HB       GLU  16  -7.367  13.908   3.861
  148    HB3  GLU  16          2HB       GLU  16  -6.023  14.171   5.001
  149    HG2  GLU  16          1HG       GLU  16  -4.986  15.792   3.341
  150    HG3  GLU  16          2HG       GLU  16  -6.354  15.374   2.284
  151    HE2  GLU  16           HE       GLU  16  -7.205  18.362   4.122
  152    H    GLY  17           H        GLY  17  -3.935  13.685   1.393
  153    HA2  GLY  17          1HA       GLY  17  -1.854  14.718   1.521
  154    HA3  GLY  17          2HA       GLY  17  -1.683  14.211   3.191
  155    H    LYS  18           H        LYS  18  -2.760  11.402   2.301
  156    HA   LYS  18           HA       LYS  18  -0.209  10.426   1.295
  157    HB2  LYS  18          1HB       LYS  18  -2.669   9.192   2.523
  158    HB3  LYS  18          2HB       LYS  18  -1.489   8.194   1.642
  159    HG2  LYS  18          1HG       LYS  18  -1.138   8.176   4.107
  160    HG3  LYS  18          2HG       LYS  18   0.263   8.793   3.200
  161    HD2  LYS  18          1HD       LYS  18  -0.479  11.108   3.661
  162    HD3  LYS  18          2HD       LYS  18  -1.842  10.469   4.608
  163    HE2  LYS  18          1HE       LYS  18  -0.245   9.362   6.132
  164    HE3  LYS  18          2HE       LYS  18   1.104  10.050   5.200
  165    HZ1  LYS  18          1HZ       LYS  18   0.613  11.359   7.153
  166    HZ2  LYS  18          2HZ       LYS  18   0.309  12.239   5.792
  167    HZ3  LYS  18          3HZ       LYS  18  -0.942  11.600   6.655
  168    H    ASN  19           H        ASN  19  -0.130   8.960  -0.573
  169    HA   ASN  19           HA       ASN  19  -2.268   9.598  -2.434
  170    HB2  ASN  19          1HB       ASN  19  -0.291  11.344  -2.757
  171    HB3  ASN  19          2HB       ASN  19   0.533   9.776  -2.930
  172   HD21  ASN  19          1HD2      ASN  19  -1.457  11.482  -6.015
  173   HD22  ASN  19          2HD2      ASN  19  -1.418  12.178  -4.429
  174    H    LEU  20           H        LEU  20   0.789   7.786  -1.676
  175    HA   LEU  20           HA       LEU  20   0.400   6.147  -4.030
  176    HB2  LEU  20          1HB       LEU  20   2.451   6.132  -1.903
  177    HB3  LEU  20          2HB       LEU  20   2.713   5.326  -3.467
  178    HG   LEU  20           HG       LEU  20   2.547   8.316  -2.932
  179   HD11  LEU  20          1HD1      LEU  20   4.895   8.305  -3.814
  180   HD12  LEU  20          2HD1      LEU  20   4.737   7.262  -2.381
  181   HD13  LEU  20          3HD1      LEU  20   4.798   6.540  -4.007
  182   HD21  LEU  20          1HD2      LEU  20   2.953   8.609  -5.351
  183   HD22  LEU  20          2HD2      LEU  20   2.812   6.848  -5.570
  184   HD23  LEU  20          3HD2      LEU  20   1.411   7.789  -5.008
  185    H    CYS  21           H        CYS  21   0.425   3.786  -3.943
  186    HA   CYS  21           HA       CYS  21  -0.561   2.806  -1.365
  187    HB2  CYS  21          1HB       CYS  21  -1.135   1.900  -4.182
  188    HB3  CYS  21          2HB       CYS  21  -1.524   0.922  -2.764
  189    HG   CYS  21           HG       CYS  21  -3.721   2.021  -3.714
  190    H    TYR  22           H        TYR  22   0.705   1.266  -0.338
  191    HA   TYR  22           HA       TYR  22   2.964   0.212  -1.903
  192    HB2  TYR  22          1HB       TYR  22   4.354   0.430  -0.030
  193    HB3  TYR  22          2HB       TYR  22   3.511   1.986  -0.236
  194    HD1  TYR  22          1HD       TYR  22   3.791  -1.043   1.862
  195    HD2  TYR  22          2HD       TYR  22   1.934   2.770   1.425
  196    HE1  TYR  22          1HE       TYR  22   3.007  -1.165   4.208
  197    HE2  TYR  22          2HE       TYR  22   1.144   2.665   3.764
  198    HH   TYR  22           HH       TYR  22   1.091   1.452   5.691
  199    H    LYS  23           H        LYS  23   3.797  -1.906  -1.196
  200    HA   LYS  23           HA       LYS  23   2.013  -3.319   0.644
  201    HB2  LYS  23          1HB       LYS  23   2.256  -5.339  -0.722
  202    HB3  LYS  23          2HB       LYS  23   1.422  -4.035  -1.600
  203    HG2  LYS  23          1HG       LYS  23   3.487  -3.525  -2.826
  204    HG3  LYS  23          2HG       LYS  23   4.340  -4.808  -1.935
  205    HD2  LYS  23          1HD       LYS  23   3.504  -5.390  -4.285
  206    HD3  LYS  23          2HD       LYS  23   3.087  -6.520  -2.975
  207    HE2  LYS  23          1HE       LYS  23   0.870  -5.499  -2.782
  208    HE3  LYS  23          2HE       LYS  23   1.284  -4.336  -4.063
  209    HZ1  LYS  23          1HZ       LYS  23  -0.003  -6.177  -4.913
  210    HZ2  LYS  23          2HZ       LYS  23   1.506  -6.185  -5.580
  211    HZ3  LYS  23          3HZ       LYS  23   1.122  -7.263  -4.391
  212    H    MET  24           H        MET  24   3.064  -4.966   1.913
  213    HA   MET  24           HA       MET  24   5.941  -4.494   1.987
  214    HB2  MET  24          1HB       MET  24   3.934  -5.236   4.122
  215    HB3  MET  24          2HB       MET  24   5.694  -5.277   4.381
  216    HG2  MET  24          1HG       MET  24   5.847  -2.888   3.967
  217    HG3  MET  24          2HG       MET  24   4.110  -2.817   3.587
  218    HE1  MET  24          1HE       MET  24   5.785  -3.767   7.806
  219    HE2  MET  24          2HE       MET  24   5.857  -4.912   6.444
  220    HE3  MET  24          3HE       MET  24   6.809  -3.407   6.395
  221    H    PHE  25           H        PHE  25   7.372  -6.242   1.926
  222    HA   PHE  25           HA       PHE  25   6.122  -8.899   1.979
  223    HB2  PHE  25          1HB       PHE  25   8.667  -7.784   0.667
  224    HB3  PHE  25          2HB       PHE  25   8.226  -9.496   0.624
  225    HD1  PHE  25          1HD       PHE  25   7.425  -6.151  -0.621
  226    HD2  PHE  25          2HD       PHE  25   6.471 -10.275  -0.836
  227    HE1  PHE  25          1HE       PHE  25   6.091  -5.731  -2.716
  228    HE2  PHE  25          2HE       PHE  25   5.142  -9.862  -2.926
  229    HZ   PHE  25           HZ       PHE  25   4.966  -7.598  -3.841
  230    H    MET  26           H        MET  26   7.607 -10.671   2.854
  231    HA   MET  26           HA       MET  26   9.656  -9.530   4.596
  232    HB2  MET  26          1HB       MET  26   8.098 -12.115   4.802
  233    HB3  MET  26          2HB       MET  26   9.470 -11.686   5.851
  234    HG2  MET  26          1HG       MET  26   8.226  -9.740   6.684
  235    HG3  MET  26          2HG       MET  26   6.855 -10.163   5.631
  236    HE1  MET  26          1HE       MET  26   5.508 -10.989   9.251
  237    HE2  MET  26          2HE       MET  26   6.603  -9.661   8.798
  238    HE3  MET  26          3HE       MET  26   5.224 -10.074   7.750
  239    H    MET  27           H        MET  27  11.768 -10.503   4.577
  240    HA   MET  27           HA       MET  27  12.646 -10.951   2.068
  241    HB2  MET  27          1HB       MET  27  13.735 -11.689   4.778
  242    HB3  MET  27          2HB       MET  27  14.658 -12.026   3.293
  243    HG2  MET  27          1HG       MET  27  13.717  -9.301   4.240
  244    HG3  MET  27          2HG       MET  27  15.379  -9.928   4.352
  245    HE1  MET  27          1HE       MET  27  16.535 -10.075   0.643
  246    HE2  MET  27          2HE       MET  27  17.019 -10.183   2.354
  247    HE3  MET  27          3HE       MET  27  15.906 -11.389   1.665
  248    H    SER  28           H        SER  28  11.461 -13.349   4.449
  249    HA   SER  28           HA       SER  28  12.147 -15.618   3.024
  250    HB2  SER  28          1HB       SER  28  11.328 -15.668   5.309
  251    HB3  SER  28          2HB       SER  28   9.754 -15.022   4.791
  252    HG   SER  28           HG       SER  28   9.731 -17.294   5.077
  253    H    ASP  29           H        ASP  29   8.846 -14.080   3.209
  254    HA   ASP  29           HA       ASP  29   8.208 -15.445   0.763
  255    HB2  ASP  29          1HB       ASP  29   6.613 -15.460   2.766
  256    HB3  ASP  29          2HB       ASP  29   6.588 -13.699   2.498
  257    HD2  ASP  29           HD       ASP  29   3.725 -15.178   0.813
  258    H    LEU  30           H        LEU  30   9.603 -14.074  -0.660
  259    HA   LEU  30           HA       LEU  30   8.939 -11.295  -0.913
  260    HB2  LEU  30          1HB       LEU  30  10.633 -13.311  -2.112
  261    HB3  LEU  30          2HB       LEU  30  10.326 -11.955  -3.221
  262    HG   LEU  30           HG       LEU  30  11.763 -10.599  -2.137
  263   HD11  LEU  30          1HD1      LEU  30  11.843 -10.392   0.362
  264   HD12  LEU  30          2HD1      LEU  30  10.169 -10.332  -0.238
  265   HD13  LEU  30          3HD1      LEU  30  10.799 -11.826   0.498
  266   HD21  LEU  30          1HD2      LEU  30  13.558 -11.724  -0.867
  267   HD22  LEU  30          2HD2      LEU  30  12.545 -13.183  -0.761
  268   HD23  LEU  30          3HD2      LEU  30  13.108 -12.604  -2.347
  269    H    THR  31           H        THR  31   7.568 -14.306  -1.925
  270    HA   THR  31           HA       THR  31   6.796 -13.489  -4.546
  271    HB   THR  31           HB       THR  31   5.782 -15.753  -2.761
  272    HG1  THR  31          1HG       THR  31   7.248 -16.996  -4.073
  273   HG21  THR  31          1HG2      THR  31   5.001 -16.763  -4.876
  274   HG22  THR  31          2HG2      THR  31   4.216 -15.192  -4.587
  275   HG23  THR  31          3HG2      THR  31   5.544 -15.321  -5.765
  276    H    ILE  32           H        ILE  32   5.168 -13.622  -1.339
  277    HA   ILE  32           HA       ILE  32   2.944 -12.173  -2.593
  278    HB   ILE  32           HB       ILE  32   2.848 -14.429  -0.536
  279   HG12  ILE  32          1HG1      ILE  32   3.024 -15.133  -2.837
  280   HG13  ILE  32          2HG1      ILE  32   1.459 -15.560  -2.106
  281   HG21  ILE  32          1HG2      ILE  32   0.410 -14.025  -0.451
  282   HG22  ILE  32          2HG2      ILE  32   1.315 -12.604   0.122
  283   HG23  ILE  32          3HG2      ILE  32   0.608 -12.609  -1.510
  284   HD11  ILE  32          1HD1      ILE  32   1.174 -14.777  -4.424
  285   HD12  ILE  32          2HD1      ILE  32   0.397 -13.666  -3.271
  286   HD13  ILE  32          3HD1      ILE  32   1.962 -13.240  -4.003
  287    HA   PRO  33           HA       PRO  33   3.952  -9.374   0.590
  288    HB2  PRO  33          1HB       PRO  33   2.124  -7.430   0.064
  289    HB3  PRO  33          2HB       PRO  33   3.544  -7.625  -0.971
  290    HG2  PRO  33          1HG       PRO  33   0.737  -8.713  -1.361
  291    HG3  PRO  33          2HG       PRO  33   1.797  -7.927  -2.539
  292    HD2  PRO  33          1HD       PRO  33   1.557 -10.658  -2.429
  293    HD3  PRO  33          2HD       PRO  33   3.081  -9.889  -2.891
  294    H    VAL  34           H        VAL  34   3.011  -8.327   2.553
  295    HA   VAL  34           HA       VAL  34   1.109 -10.355   3.513
  296    HB   VAL  34           HB       VAL  34   2.300 -10.221   5.691
  297   HG11  VAL  34          1HG1      VAL  34   4.396 -11.345   5.012
  298   HG12  VAL  34          2HG1      VAL  34   3.016 -11.925   4.050
  299   HG13  VAL  34          3HG1      VAL  34   4.168 -10.763   3.346
  300   HG21  VAL  34          1HG2      VAL  34   4.429  -9.036   5.879
  301   HG22  VAL  34          2HG2      VAL  34   4.202  -8.372   4.243
  302   HG23  VAL  34          3HG2      VAL  34   3.076  -7.929   5.549
  303    H    LYS  35           H        LYS  35   2.005  -6.976   3.223
  304    HA   LYS  35           HA       LYS  35  -0.513  -6.293   4.499
  305    HB2  LYS  35          1HB       LYS  35   2.221  -5.266   5.286
  306    HB3  LYS  35          2HB       LYS  35   0.738  -4.327   5.579
  307    HG2  LYS  35          1HG       LYS  35  -0.103  -6.449   6.809
  308    HG3  LYS  35          2HG       LYS  35   1.607  -6.942   6.815
  309    HD2  LYS  35          1HD       LYS  35   1.324  -5.839   8.872
  310    HD3  LYS  35          2HD       LYS  35   2.085  -4.622   7.820
  311    HE2  LYS  35          1HE       LYS  35  -0.027  -3.543   7.425
  312    HE3  LYS  35          2HE       LYS  35  -0.905  -4.846   8.259
  313    HZ1  LYS  35          1HZ       LYS  35  -0.640  -2.912   9.660
  314    HZ2  LYS  35          2HZ       LYS  35   0.189  -4.189  10.296
  315    HZ3  LYS  35          3HZ       LYS  35   1.002  -2.981   9.521
  316    H    ARG  36           H        ARG  36  -1.503  -4.481   3.565
  317    HA   ARG  36           HA       ARG  36   0.186  -2.926   1.803
  318    HB2  ARG  36          1HB       ARG  36  -2.512  -3.938   0.994
  319    HB3  ARG  36          2HB       ARG  36  -1.488  -2.800   0.087
  320    HG2  ARG  36          1HG       ARG  36  -0.964  -4.745  -1.007
  321    HG3  ARG  36          2HG       ARG  36   0.272  -4.769   0.274
  322    HD2  ARG  36          1HD       ARG  36  -0.761  -6.931  -0.077
  323    HD3  ARG  36          2HD       ARG  36  -1.045  -6.295   1.561
  324    HE   ARG  36           HE       ARG  36  -3.450  -6.295   1.015
  325   HH11  ARG  36          1HH1      ARG  36  -1.593  -6.745  -1.902
  326   HH12  ARG  36          2HH1      ARG  36  -3.052  -7.173  -2.772
  327   HH21  ARG  36          1HH2      ARG  36  -5.132  -6.773   0.030
  328   HH22  ARG  36          2HH2      ARG  36  -5.072  -7.188  -1.672
  329    H    GLY  37           H        GLY  37  -0.644  -0.692   1.462
  330    HA2  GLY  37          1HA       GLY  37  -2.895   0.291   2.878
  331    HA3  GLY  37          2HA       GLY  37  -1.447   0.459   3.853
  332    H    CYS  38           H        CYS  38  -2.104   2.847   3.508
  333    HA   CYS  38           HA       CYS  38  -1.247   3.768   0.867
  334    HB2  CYS  38          1HB       CYS  38  -2.943   4.891   3.219
  335    HB3  CYS  38          2HB       CYS  38  -2.667   5.801   1.713
  336    HG   CYS  38           HG       CYS  38  -5.109   4.988   1.824
  337    H    ILE  39           H        ILE  39   0.303   5.557   0.780
  338    HA   ILE  39           HA       ILE  39   1.044   6.832   3.223
  339    HB   ILE  39           HB       ILE  39   2.531   4.747   3.181
  340   HG12  ILE  39          1HG1      ILE  39   4.168   7.224   2.843
  341   HG13  ILE  39          2HG1      ILE  39   3.027   7.043   4.196
  342   HG21  ILE  39          1HG2      ILE  39   4.392   4.744   1.555
  343   HG22  ILE  39          2HG2      ILE  39   2.820   4.622   0.729
  344   HG23  ILE  39          3HG2      ILE  39   3.694   6.172   0.753
  345   HD11  ILE  39          1HD1      ILE  39   5.308   6.393   4.862
  346   HD12  ILE  39          2HD1      ILE  39   4.201   5.000   4.914
  347   HD13  ILE  39          3HD1      ILE  39   5.343   5.181   3.561
  348    H    ASP  40           H        ASP  40   2.593   8.672   2.768
  349    HA   ASP  40           HA       ASP  40   1.841   9.771   0.229
  350    HB2  ASP  40          1HB       ASP  40   2.844  11.915   1.204
  351    HB3  ASP  40          2HB       ASP  40   1.526  11.057   2.039
  352    HD2  ASP  40           HD       ASP  40   4.277  11.962   4.346
  353    H    VAL  41           H        VAL  41   4.807   8.970   2.164
  354    HA   VAL  41           HA       VAL  41   6.374   9.231  -0.309
  355    HB   VAL  41           HB       VAL  41   7.263   9.500   2.601
  356   HG11  VAL  41          1HG1      VAL  41   9.449  10.139   1.639
  357   HG12  VAL  41          2HG1      VAL  41   9.001   8.483   1.168
  358   HG13  VAL  41          3HG1      VAL  41   8.823   9.819   0.005
  359   HG21  VAL  41          1HG2      VAL  41   7.705  11.837   2.041
  360   HG22  VAL  41          2HG2      VAL  41   7.017  11.578   0.420
  361   HG23  VAL  41          3HG2      VAL  41   5.985  11.421   1.862
  362    H    CYS  42           H        CYS  42   7.450   7.437  -1.052
  363    HA   CYS  42           HA       CYS  42   6.544   4.989   0.007
  364    HB2  CYS  42          1HB       CYS  42   6.911   5.380  -2.377
  365    HB3  CYS  42          2HB       CYS  42   8.647   5.535  -2.098
  366    HG   CYS  42           HG       CYS  42   8.140   3.245  -3.293
  367    HA   PRO  43           HA       PRO  43   9.787   4.635   2.940
  368    HB2  PRO  43          1HB       PRO  43   9.156   2.184   3.984
  369    HB3  PRO  43          2HB       PRO  43   8.247   3.633   4.436
  370    HG2  PRO  43          1HG       PRO  43   7.601   1.557   2.322
  371    HG3  PRO  43          2HG       PRO  43   6.524   2.315   3.503
  372    HD2  PRO  43          1HD       PRO  43   6.604   3.179   0.909
  373    HD3  PRO  43          2HD       PRO  43   6.320   4.314   2.235
  374    H    LYS  44           H        LYS  44  11.889   4.001   2.991
  375    HA   LYS  44           HA       LYS  44  12.730   2.589   0.679
  376    HB2  LYS  44          1HB       LYS  44  14.138   3.412   3.235
  377    HB3  LYS  44          2HB       LYS  44  14.956   2.683   1.833
  378    HG2  LYS  44          1HG       LYS  44  14.289   4.596   0.440
  379    HG3  LYS  44          2HG       LYS  44  13.458   5.325   1.834
  380    HD2  LYS  44          1HD       LYS  44  15.578   5.484   3.044
  381    HD3  LYS  44          2HD       LYS  44  16.426   4.695   1.693
  382    HE2  LYS  44          1HE       LYS  44  15.806   6.557   0.214
  383    HE3  LYS  44          2HE       LYS  44  14.953   7.345   1.560
  384    HZ1  LYS  44          1HZ       LYS  44  17.154   8.253   1.249
  385    HZ2  LYS  44          2HZ       LYS  44  17.053   7.501   2.715
  386    HZ3  LYS  44          3HZ       LYS  44  17.844   6.770   1.466
  387    H    ASN  45           H        ASN  45  14.100   0.579   0.755
  388    HA   ASN  45           HA       ASN  45  12.479  -1.366   1.977
  389    HB2  ASN  45          1HB       ASN  45  15.061  -1.854   0.319
  390    HB3  ASN  45          2HB       ASN  45  13.885  -2.879   1.178
  391   HD21  ASN  45          1HD2      ASN  45  13.119  -2.204  -2.518
  392   HD22  ASN  45          2HD2      ASN  45  14.635  -2.451  -1.718
  393    H    SER  46           H        SER  46  13.049  -2.809   3.730
  394    HA   SER  46           HA       SER  46  15.436  -1.987   5.182
  395    HB2  SER  46          1HB       SER  46  14.336  -2.875   7.174
  396    HB3  SER  46          2HB       SER  46  13.283  -1.698   6.356
  397    HG   SER  46           HG       SER  46  12.162  -3.468   5.448
  398    H    LEU  47           H        LEU  47  16.137  -4.050   6.718
  399    HA   LEU  47           HA       LEU  47  17.067  -5.938   4.785
  400    HB2  LEU  47          1HB       LEU  47  17.238  -5.663   7.720
  401    HB3  LEU  47          2HB       LEU  47  18.190  -6.930   6.912
  402    HG   LEU  47           HG       LEU  47  18.490  -3.924   6.543
  403   HD11  LEU  47          1HD1      LEU  47  20.737  -4.288   7.600
  404   HD12  LEU  47          2HD1      LEU  47  19.422  -4.772   8.695
  405   HD13  LEU  47          3HD1      LEU  47  20.343  -6.010   7.808
  406   HD21  LEU  47          1HD2      LEU  47  20.436  -4.489   5.130
  407   HD22  LEU  47          2HD2      LEU  47  20.029  -6.215   5.290
  408   HD23  LEU  47          3HD2      LEU  47  18.904  -5.108   4.469
  409    H    LEU  48           H        LEU  48  14.370  -5.685   7.004
  410    HA   LEU  48           HA       LEU  48  14.115  -8.587   7.136
  411    HB2  LEU  48          1HB       LEU  48  12.764  -6.294   8.423
  412    HB3  LEU  48          2HB       LEU  48  12.285  -7.951   8.860
  413    HG   LEU  48           HG       LEU  48  14.984  -6.634   9.354
  414   HD11  LEU  48          1HD1      LEU  48  14.381  -6.952  11.769
  415   HD12  LEU  48          2HD1      LEU  48  13.188  -5.930  10.934
  416   HD13  LEU  48          3HD1      LEU  48  12.817  -7.637  11.272
  417   HD21  LEU  48          1HD2      LEU  48  15.595  -8.731  10.508
  418   HD22  LEU  48          2HD2      LEU  48  14.053  -9.450   9.980
  419   HD23  LEU  48          3HD2      LEU  48  15.271  -8.971   8.775
  420    H    VAL  49           H        VAL  49  12.292  -5.604   6.196
  421    HA   VAL  49           HA       VAL  49  10.516  -7.364   4.654
  422    HB   VAL  49           HB       VAL  49   8.706  -5.667   5.116
  423   HG11  VAL  49          1HG1      VAL  49   8.246  -6.417   7.427
  424   HG12  VAL  49          2HG1      VAL  49   8.832  -7.763   6.422
  425   HG13  VAL  49          3HG1      VAL  49   9.929  -6.974   7.581
  426   HG21  VAL  49          1HG2      VAL  49   8.986  -4.107   6.977
  427   HG22  VAL  49          2HG2      VAL  49  10.696  -4.581   7.115
  428   HG23  VAL  49          3HG2      VAL  49  10.113  -3.767   5.642
  429    H    LYS  50           H        LYS  50   9.840  -6.567   2.612
  430    HA   LYS  50           HA       LYS  50  11.477  -4.315   1.688
  431    HB2  LYS  50          1HB       LYS  50  11.863  -6.453   0.561
  432    HB3  LYS  50          2HB       LYS  50  10.124  -6.598   0.212
  433    HG2  LYS  50          1HG       LYS  50  10.256  -4.589  -1.220
  434    HG3  LYS  50          2HG       LYS  50  12.001  -4.478  -0.891
  435    HD2  LYS  50          1HD       LYS  50  12.340  -6.689  -1.911
  436    HD3  LYS  50          2HD       LYS  50  10.594  -6.814  -2.229
  437    HE2  LYS  50          1HE       LYS  50  10.735  -4.781  -3.641
  438    HE3  LYS  50          2HE       LYS  50  12.493  -4.741  -3.371
  439    HZ1  LYS  50          1HZ       LYS  50  11.936  -5.799  -5.455
  440    HZ2  LYS  50          2HZ       LYS  50  12.639  -6.890  -4.436
  441    HZ3  LYS  50          3HZ       LYS  50  11.009  -6.926  -4.687
  442    H    TYR  51           H        TYR  51  10.520  -2.628   0.458
  443    HA   TYR  51           HA       TYR  51   7.595  -2.521   0.770
  444    HB2  TYR  51          1HB       TYR  51   9.673  -0.332   0.879
  445    HB3  TYR  51          2HB       TYR  51   7.910  -0.073   0.874
  446    HD1  TYR  51          1HD       TYR  51  10.798  -1.156   2.865
  447    HD2  TYR  51          2HD       TYR  51   6.561  -0.682   2.835
  448    HE1  TYR  51          1HE       TYR  51  10.760  -1.414   5.328
  449    HE2  TYR  51          2HE       TYR  51   6.504  -0.938   5.292
  450    HH   TYR  51           HH       TYR  51   7.719  -1.272   7.188
  451    H    VAL  52           H        VAL  52   6.446  -2.431  -1.097
  452    HA   VAL  52           HA       VAL  52   7.765  -1.115  -3.370
  453    HB   VAL  52           HB       VAL  52   5.773  -3.431  -3.445
  454   HG11  VAL  52          1HG1      VAL  52   6.164  -3.379  -5.885
  455   HG12  VAL  52          2HG1      VAL  52   5.477  -1.840  -5.314
  456   HG13  VAL  52          3HG1      VAL  52   7.213  -1.957  -5.687
  457   HG21  VAL  52          1HG2      VAL  52   7.607  -4.727  -4.407
  458   HG22  VAL  52          2HG2      VAL  52   8.709  -3.352  -4.156
  459   HG23  VAL  52          3HG2      VAL  52   7.974  -4.173  -2.757
  460    H    CYS  53           H        CYS  53   6.682   0.618  -4.200
  461    HA   CYS  53           HA       CYS  53   3.950   0.989  -3.203
  462    HB2  CYS  53          1HB       CYS  53   5.868   3.210  -3.878
  463    HB3  CYS  53          2HB       CYS  53   4.310   3.328  -3.053
  464    HG   CYS  53           HG       CYS  53   6.253   3.885  -1.365
  465    H    CYS  54           H        CYS  54   2.562   2.318  -4.741
  466    HA   CYS  54           HA       CYS  54   3.636   2.782  -7.351
  467    HB2  CYS  54          1HB       CYS  54   1.663   1.525  -8.415
  468    HB3  CYS  54          2HB       CYS  54   3.102   0.621  -7.933
  469    HG   CYS  54           HG       CYS  54   0.953  -0.839  -7.512
  470    H    ASN  55           H        ASN  55   2.016   4.132  -8.645
  471    HA   ASN  55           HA       ASN  55   0.926   5.822  -6.549
  472    HB2  ASN  55          1HB       ASN  55   1.656   7.793  -7.989
  473    HB3  ASN  55          2HB       ASN  55   2.753   6.441  -7.613
  474   HD21  ASN  55          1HD2      ASN  55   3.070   7.529 -11.183
  475   HD22  ASN  55          2HD2      ASN  55   3.090   8.369  -9.667
  476    H    THR  56           H        THR  56  -0.591   3.615  -7.856
  477    HA   THR  56           HA       THR  56  -2.756   5.272  -8.940
  478    HB   THR  56           HB       THR  56  -3.310   3.404 -10.513
  479    HG1  THR  56          1HG       THR  56  -1.651   1.807 -10.845
  480   HG21  THR  56          1HG2      THR  56  -1.501   3.816 -12.143
  481   HG22  THR  56          2HG2      THR  56  -1.986   5.323 -11.330
  482   HG23  THR  56          3HG2      THR  56  -0.487   4.494 -10.848
  483    H    ASP  57           H        ASP  57  -4.863   3.824  -9.021
  484    HA   ASP  57           HA       ASP  57  -5.217   3.358  -6.259
  485    HB2  ASP  57          1HB       ASP  57  -7.175   3.241  -8.619
  486    HB3  ASP  57          2HB       ASP  57  -7.483   2.839  -6.911
  487    HD2  ASP  57           HD       ASP  57  -7.492   6.582  -7.941
  488    H    ARG  58           H        ARG  58  -5.401   1.325  -5.212
  489    HA   ARG  58           HA       ARG  58  -5.514  -0.811  -4.899
  490    HB2  ARG  58          1HB       ARG  58  -7.136  -0.825  -7.414
  491    HB3  ARG  58          2HB       ARG  58  -7.016  -2.162  -6.246
  492    HG2  ARG  58          1HG       ARG  58  -8.313  -1.101  -4.678
  493    HG3  ARG  58          2HG       ARG  58  -7.843   0.525  -5.232
  494    HD2  ARG  58          1HD       ARG  58  -9.585  -1.267  -6.867
  495    HD3  ARG  58          2HD       ARG  58 -10.234  -0.229  -5.577
  496    HE   ARG  58           HE       ARG  58  -8.860   1.552  -7.319
  497   HH11  ARG  58          1HH1      ARG  58 -11.412  -0.787  -7.736
  498   HH12  ARG  58          2HH1      ARG  58 -12.095   0.179  -9.028
  499   HH21  ARG  58          1HH2      ARG  58  -9.626   2.666  -8.802
  500   HH22  ARG  58          2HH2      ARG  58 -11.076   2.148  -9.639
  501    H    CYS  59           H        CYS  59  -3.178   0.196  -6.369
  502    HA   CYS  59           HA       CYS  59  -2.756  -1.617  -8.561
  503    HB2  CYS  59          1HB       CYS  59  -0.675  -0.108  -8.694
  504    HB3  CYS  59          2HB       CYS  59  -2.113   0.897  -8.388
  505    HG   CYS  59           HG       CYS  59  -0.074   1.861  -7.144
  506    H    ASN  60           H        ASN  60  -2.103  -1.325  -5.117
  507    HA   ASN  60           HA       ASN  60  -0.086  -3.386  -5.270
  508    HB2  ASN  60          1HB       ASN  60   0.188  -2.977  -2.841
  509    HB3  ASN  60          2HB       ASN  60   0.275  -1.448  -3.727
  510   HD21  ASN  60          1HD2      ASN  60  -0.172  -0.945  -1.313
  511   HD22  ASN  60          2HD2      ASN  60  -1.828  -0.660  -0.890