*HEADER    METAL BINDING PROTEIN                   15-MAY-05   1X4V              
*TITLE     SOLUTION STRUCTURE OF THE ZF-AN1 DOMAIN FROM HUMAN                    
*TITLE    2 HYPOTHETICAL PROTEIN LOC130617                                       
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: HYPOTHETICAL PROTEIN LOC130617;                            
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: ZF-AN1 DOMAIN;                                             
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: LOC130617;                                                     
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   7 EXPRESSION_SYSTEM_PLASMID: P040921-15;                               
*SOURCE   8 OTHER_DETAILS: CELL-FREE PROTEIN SYNTHESIS                           
*KEYWDS    ZF-AN1 DOMAIN, ZINC BINDING, STRUCTURAL GENOMICS, NPPSFA,             
*KEYWDS   2 NATIONAL PROJECT ON PROTEIN STRUCTURAL AND FUNCTIONAL                
*KEYWDS   3 ANALYSES, RIKEN STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE,           
*KEYWDS   4 RSGI, METAL BINDING PROTEIN                                          
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    T.TOMIZAWA, T.KIGAWA, S.KOSHIBA, M.INOUE, S.YOKOYAMA, RIKEN           
*AUTHOR   2 STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE (RSGI)                     
*REVDAT   1   12-MAY-09 1X4V    0                                                

**************************************************************
During the CYANA calculations automatic implicit swapping of restraints 
involving diastereotopic substitutents was applied for prochrial groups 
without stereospecific assignment. Diastereotopic substitents were 
swapped individually in each conformer to calculate the minimal target 
function and restraint violations.
The optimal swapping for a given prochiral group may differ among 
the 20 conformers that represent the solution structure. The swapping 
is therefore performed implicitly in the program and is not reflected 
in the distance restraint file deposited in the PDB.
**************************************************************

  15  CYSS   CHI1  150.0  210.0
  20  CYSS   CHI1  150.0  210.0
  38  CYSS   CHI1   30.0   90.0
  41  HIST   CHI1  170.0  330.0

  30  CYSS   CHI1  150.0  210.0
  33  CYSS   CHI1   30.0   90.0
  47  HIS    CHI1   30.0   90.0
  49  CYSS   CHI1  150.0  210.0
15 CYSS SG   201 ZN   ZN   2.33  5.00E+00
20 CYSS SG   201 ZN   ZN   2.33  5.00E+00
38 CYSS SG   201 ZN   ZN   2.33  5.00E+00
41 HIST ND1  201 ZN   ZN   2.33  5.00E+00

15 CYSS CB   201 ZN   ZN   3.25  5.00E+00
20 CYSS CB   201 ZN   ZN   3.25  5.00E+00
38 CYSS CB   201 ZN   ZN   3.25  5.00E+00


15 CYSS SG   20  CYSS SG   3.20  5.00E+00
15 CYSS SG   38  CYSS SG   3.20  5.00E+00
15 CYSS SG   41  HIST ND1  3.20  5.00E+00
41 HIST ND1  20  CYSS SG   3.20  5.00E+00
20 CYSS SG   38  CYSS SG   3.20  5.00E+00
38 CYSS SG   41  HIST ND1  3.20  5.00E+00

30 CYSS SG   401 ZN   ZN   2.33  5.00E+00
33 CYSS SG   401 ZN   ZN   2.33  5.00E+00
47 HIS  NE2  401 ZN   ZN   2.33  5.00E+00
49 CYSS SG   401 ZN   ZN   2.33  5.00E+00

30 CYSS CB   401 ZN   ZN   3.25  5.00E+00
33 CYSS CB   401 ZN   ZN   3.25  5.00E+00
49 CYSS CB   401 ZN   ZN   3.25  5.00E+00

30 CYSS SG   33  CYSS SG   3.20  5.00E+00
30 CYSS SG   49  CYSS SG   3.20  5.00E+00
30 CYSS SG   47  HIS  NE2  3.20  5.00E+00
47 HIS  NE2  33  CYSS SG   3.20  5.00E+00
33 CYSS SG   49  CYSS SG   3.20  5.00E+00
49 CYSS SG   47  HIS  NE2  3.20  5.00E+00
15 CYSS SG   201 ZN   ZN   2.37  5.00E+00
20 CYSS SG   201 ZN   ZN   2.37  5.00E+00
38 CYSS SG   201 ZN   ZN   2.37  5.00E+00
41 HIST ND1  201 ZN   ZN   2.37  5.00E+00

15 CYSS CB   201 ZN   ZN   3.51  5.00E+00
20 CYSS CB   201 ZN   ZN   3.51  5.00E+00
38 CYSS CB   201 ZN   ZN   3.51  5.00E+00


15 CYSS SG   20  CYSS SG   4.00  5.00E+00
15 CYSS SG   38  CYSS SG   4.00  5.00E+00
15 CYSS SG   41  HIST ND1  4.00  5.00E+00
41 HIST ND1  20  CYSS SG   4.00  5.00E+00
20 CYSS SG   38  CYSS SG   4.00  5.00E+00
38 CYSS SG   41  HIST ND1  4.00  5.00E+00

30 CYSS SG   401 ZN   ZN   2.37  5.00E+00
33 CYSS SG   401 ZN   ZN   2.37  5.00E+00
47 HIS  NE2  401 ZN   ZN   2.37  5.00E+00
49 CYSS SG   401 ZN   ZN   2.37  5.00E+00

30 CYSS CB   401 ZN   ZN   3.51  5.00E+00
33 CYSS CB   401 ZN   ZN   3.51  5.00E+00
49 CYSS CB   401 ZN   ZN   3.51  5.00E+00

30 CYSS SG   33  CYSS SG   4.00  5.00E+00
30 CYSS SG   49  CYSS SG   4.00  5.00E+00
30 CYSS SG   47  HIS  NE2  4.00  5.00E+00
47 HIS  NE2  33  CYSS SG   4.00  5.00E+00
33 CYSS SG   49  CYSS SG   4.00  5.00E+00
49 CYSS SG   47  HIS  NE2  4.00  5.00E+00
 30 CYSS HN     36 ASN  HN      5.39 #SUP  0.93  #QF  0.67
 30 CYSS HN     35 ARG  HN      3.76 #SUP  1.00
 30 CYSS HN     36 ASN  HA      3.93 #SUP  0.53  #QF  0.53
 30 CYSS HN     34 SER  HA      4.39 #SUP  0.99  #QF  0.99
 30 CYSS HN     30 CYSS HB3     3.03 #SUP  0.99  #QF  0.99
 30 CYSS HN     30 CYSS HB2     3.19 #SUP  0.99  #QF  0.99
 29 THR  QG2    30 CYSS HN      3.36 #SUP  0.98  #QF  0.98
 30 CYSS HN     37 PHE  HD1     4.72 #SUP  0.91  #QF  0.78
 30 CYSS HN     37 PHE  HE1     5.28 #SUP  0.91  #QF  0.78
 32 ARG  HN     34 SER  HN      3.82 #SUP  0.94  #QF  0.94
 30 CYSS HN     34 SER  HN      4.48 #SUP  1.00
 32 ARG  HA     34 SER  HN      4.52 #SUP  0.88  #QF  0.88
 34 SER  HN     34 SER  HA      2.58 #SUP  0.92  #QF  0.92
 30 CYSS HB3    34 SER  HN      3.63 #SUP  0.98  #QF  0.98
 33 CYSS HB2    34 SER  HN      4.64 #SUP  0.99  #QF  0.99
 30 CYSS HB2    34 SER  HN      3.93 #SUP  0.99  #QF  0.99
 32 ARG  HB2    34 SER  HN      4.62 #SUP  0.88  #QF  0.88
 34 SER  HN     35 ARG  HG3     4.61 #SUP  0.76  #QF  0.76
 28 LEU  HN     36 ASN  HD22    4.40 #SUP  0.50  #QF  0.50
 28 LEU  HN     36 ASN  HA      4.34 #SUP  0.58  #QF  0.58
 28 LEU  HN     28 LEU  HG      3.57 #SUP  1.00
 27 LYS  HG2    28 LEU  HN      4.30 #SUP  0.99  #QF  0.99
 27 LYS  HG3    28 LEU  HN      4.30 #SUP  1.00  #QF  0.59
 28 LEU  HN     28 LEU  QD1     3.77 #SUP  0.98  #QF  0.98
 36 ASN  HA     36 ASN  HD21    4.57 #SUP  1.00
 13 ASN  HB2    36 ASN  HD21    4.68 #SUP  0.82  #QF  0.82
 13 ASN  HB3    36 ASN  HD22    3.68 #SUP  0.58  #QF  0.58
 13 ASN  HN     13 ASN  HD22    5.03 #SUP  0.92  #QF  0.90
 36 ASN  HD22   37 PHE  HN      5.12 #SUP  0.92  #QF  0.90
 13 ASN  HB2    36 ASN  HD22    3.68 #SUP  0.96  #QF  0.74
 13 ASN  HD22   26 MET  HA      4.74 #SUP  0.96  #QF  0.96
 12 THR  HA     13 ASN  HD22    4.55 #SUP  0.65  #QF  0.56
 13 ASN  HD22   25 MET  HA      5.15 #SUP  0.65  #QF  0.56
 12 THR  HA     13 ASN  HD21    4.55 #SUP  0.85  #QF  0.66
 14 LYS  HA     15 CYSS HN      2.69 #SUP  0.91  #QF  0.91
 15 CYSS HN     15 CYSS HB3     3.00 #SUP  0.98  #QF  0.98
 15 CYSS HN     15 CYSS HB2     3.12 #SUP  0.97  #QF  0.97
 15 CYSS HN     38 CYSS HB3     4.58 #SUP  0.99  #QF  0.99
 14 LYS  QB     15 CYSS HN      3.85 #SUP  0.96  #QF  0.96
 14 LYS  HG3    15 CYSS HN      4.68 #SUP  0.74  #QF  0.74
 33 CYSS HB2    51 GLY  HN      4.56 #SUP  1.00
 33 CYSS HB3    51 GLY  HN      4.08 #SUP  0.97  #QF  0.97
 16 GLU  HN     17 ARG  HN      3.31 #SUP  0.99  #QF  0.99
 17 ARG  HN     37 PHE  HD2     4.29 #SUP  0.89  #QF  0.89
 17 ARG  HN     37 PHE  HE2     4.26 #SUP  0.97  #QF  0.97
 17 ARG  HN     37 PHE  HA      4.37 #SUP  1.00
 15 CYSS HA     17 ARG  HN      4.01 #SUP  1.00
 17 ARG  HN     37 PHE  HB3     5.25 #SUP  0.93  #QF  0.93
 15 CYSS HB3    17 ARG  HN      3.66 #SUP  0.81  #QF  0.81
 17 ARG  HN     20 CYSS HB3     3.99 #SUP  0.94  #QF  0.94
 16 GLU  HB3    17 ARG  HN      4.63 #SUP  0.98  #QF  0.98
 17 ARG  HN     17 ARG  HB3     2.99 #SUP  0.99  #QF  0.99
 17 ARG  HN     17 ARG  HB2     3.06 #SUP  0.99  #QF  0.99
 17 ARG  HN     17 ARG  HG2     4.68 #SUP  1.00
 46 ASP  HN     47 HIS  HN      3.14 #SUP  0.87  #QF  0.87
 47 HIS  HN     48 ASP  HN      4.45 #SUP  0.95  #QF  0.95
 41 HIST HD2    47 HIS  HN      5.50 #SUP  0.99  #QF  0.49
 47 HIS  HN     49 CYSS HN      5.50 #SUP  0.99  #QF  0.49
 47 HIS  HN     48 ASP  HA      4.83 #SUP  0.91  #QF  0.91
 45 LEU  HA     47 HIS  HN      4.34 #SUP  0.98  #QF  0.98
 46 ASP  HB3    47 HIS  HN      4.45 #SUP  0.98  #QF  0.98
 47 HIS  HN     47 HIS  HB2     4.10 #SUP  1.00
 44 PRO  HA     47 HIS  HN      4.31 #SUP  0.87  #QF  0.87
 46 ASP  HB2    47 HIS  HN      4.17 #SUP  0.98  #QF  0.98
 47 HIS  HN     49 CYSS QB      4.89 #SUP  0.88  #QF  0.88
 47 HIS  HN     47 HIS  HB3     4.06 #SUP  1.00
 15 CYSS HB2    16 GLU  HN      4.28 #SUP  0.95  #QF  0.95
 16 GLU  HN     38 CYSS HN      4.60 #SUP  0.99  #QF  0.99
 16 GLU  HN     37 PHE  HA      3.36 #SUP  1.00
 15 CYSS HA     16 GLU  HN      2.82 #SUP  0.95  #QF  0.95
 15 CYSS HB3    16 GLU  HN      4.41 #SUP  0.82  #QF  0.82
 16 GLU  HN     16 GLU  HG3     3.36 #SUP  1.00
 16 GLU  HN     16 GLU  HG2     3.77 #SUP  1.00
 16 GLU  HN     16 GLU  HB2     3.25 #SUP  1.00
 10 ILE  HB     11 PHE  HN      4.68 #SUP  0.98  #QF  0.98
 10 ILE  QG2    11 PHE  HN      4.71 #SUP  0.98  #QF  0.96
 10 ILE  QD1    11 PHE  HN      5.27 #SUP  0.98  #QF  0.96
 15 CYSS HN     22 GLN  HN      4.94 #SUP  1.00  #QF  0.96
 20 CYSS HA     22 GLN  HN      4.07 #SUP  0.88  #QF  0.88
 15 CYSS HB2    22 GLN  HN      4.54 #SUP  0.94  #QF  0.94
 22 GLN  HN     22 GLN  HG2     4.18 #SUP  0.97  #QF  0.97
 52 GLU  HA     53 GLY  HN      3.56 #SUP  1.00
 52 GLU  HB2    53 GLY  HN      4.75 #SUP  0.99  #QF  0.99
 20 CYSS HN     21 ARG  HN      4.42 #SUP  0.91  #QF  0.91
 18 ALA  HN     20 CYSS HN      5.19 #SUP  0.83  #QF  0.83
 18 ALA  HA     20 CYSS HN      3.82 #SUP  0.82  #QF  0.82
 20 CYSS HN     20 CYSS HB2     3.04 #SUP  0.98  #QF  0.98
 20 CYSS HN     20 CYSS HB3     2.92 #SUP  0.97  #QF  0.97
 17 ARG  HB3    20 CYSS HN      4.48 #SUP  0.98  #QF  0.98
 18 ALA  QB     20 CYSS HN      4.74 #SUP  0.93  #QF  0.93
 22 GLN  HN     23 ARG  HN      4.88 #SUP  1.00
 22 GLN  HA     23 ARG  HN      2.83 #SUP  0.82  #QF  0.82
 22 GLN  HB3    23 ARG  HN      3.85 #SUP  0.94  #QF  0.94
 23 ARG  HN     23 ARG  QB      3.00 #SUP  0.86  #QF  0.72
 27 LYS  HN     27 LYS  HB3     3.92 #SUP  0.86  #QF  0.72
 23 ARG  HN     23 ARG  HG2     4.71 #SUP  0.95  #QF  0.95
 26 MET  HA     27 LYS  HN      2.72 #SUP  0.85  #QF  0.85
 26 MET  HB2    27 LYS  HN      3.41 #SUP  0.80  #QF  0.80
 27 LYS  HN     27 LYS  HG2     4.60 #SUP  1.00
 27 LYS  HN     27 LYS  HG3     4.60 #SUP  1.00
 43 HIS  HN     46 ASP  HN      4.65 #SUP  0.95  #QF  0.95
 43 HIS  HN     43 HIS  HD2     4.87 #SUP  1.00
 43 HIS  HN     43 HIS  QB      2.74 #SUP  0.85  #QF  0.85
 43 HIS  HN     46 ASP  HB2     3.71 #SUP  0.95  #QF  0.95
 42 ARG  HB2    43 HIS  HN      4.39 #SUP  1.00
 42 ARG  HB3    43 HIS  HN      3.57 #SUP  0.92  #QF  0.92
 47 HIS  HD2    50 SER  HN      4.83 #SUP  0.96  #QF  0.96
 49 CYSS HA     50 SER  HN      3.11 #SUP  0.94  #QF  0.86
 49 CYSS QB     50 SER  HN      4.46 #SUP  0.93  #QF  0.93
 13 ASN  HA     14 LYS  HN      3.04 #SUP  0.87  #QF  0.87
 13 ASN  HB2    14 LYS  HN      4.43 #SUP  0.99  #QF  0.99
 13 ASN  HB3    14 LYS  HN      4.43 #SUP  0.96  #QF  0.96
 14 LYS  HN     14 LYS  QB      3.15 #SUP  0.90  #QF  0.90
  9 LYS  HA     10 ILE  HN      2.81 #SUP  0.69  #QF  0.69
 10 ILE  HN     10 ILE  HB      3.69 #SUP  0.99  #QF  0.99
 10 ILE  HN     10 ILE  HG12    3.80 #SUP  1.00
 10 ILE  HN     10 ILE  HG13    3.80 #SUP  1.00
 10 ILE  HN     10 ILE  QG2     4.07 #SUP  1.00  #QF  0.97
 10 ILE  HN     10 ILE  QD1     4.51 #SUP  1.00  #QF  0.97
 32 ARG  HN     33 CYSS HN      2.89 #SUP  1.00
 30 CYSS HA     32 ARG  HN      4.18 #SUP  0.99  #QF  0.99
 30 CYSS HB3    32 ARG  HN      4.34 #SUP  1.00
 30 CYSS HB2    32 ARG  HN      4.63 #SUP  0.99  #QF  0.99
 31 GLU  HG2    32 ARG  HN      4.77 #SUP  0.99  #QF  0.99
 32 ARG  HN     32 ARG  HB2     3.00 #SUP  0.99  #QF  0.99
 32 ARG  HN     32 ARG  HG3     4.09 #SUP  1.00
 32 ARG  HN     32 ARG  HG2     4.09 #SUP  1.00
 24 GLU  HB3    25 MET  HN      4.46 #SUP  0.95  #QF  0.95
 34 SER  HN     35 ARG  HN      3.18 #SUP  0.99  #QF  0.99
 35 ARG  HN     37 PHE  HZ      4.55 #SUP  0.99  #QF  0.99
 33 CYSS HA     35 ARG  HN      5.50 #SUP  1.00  #QF  0.96
 35 ARG  HN     36 ASN  HA      5.50 #SUP  1.00  #QF  0.96
 34 SER  HA     35 ARG  HN      3.37 #SUP  0.99  #QF  0.99
 30 CYSS HB3    35 ARG  HN      3.35 #SUP  1.00
 33 CYSS HB2    35 ARG  HN      4.31 #SUP  1.00
 35 ARG  HN     35 ARG  HB2     3.08 #SUP  0.99  #QF  0.99
 35 ARG  HN     35 ARG  HG3     3.49 #SUP  1.00
 35 ARG  HN     35 ARG  HG2     4.28 #SUP  1.00
 35 ARG  HN     35 ARG  HB3     3.90 #SUP  1.00
 29 THR  QG2    35 ARG  HN      4.03 #SUP  1.00
 24 GLU  HN     24 GLU  HB2     4.04 #SUP  0.99  #QF  0.99
 23 ARG  QB     24 GLU  HN      4.07 #SUP  0.42  #QF  0.42
 51 GLY  HN     52 GLU  HN      4.15 #SUP  0.97  #QF  0.97
 51 GLY  QA     52 GLU  HN      3.09 #SUP  0.85  #QF  0.85
 52 GLU  HN     52 GLU  QG      4.13 #SUP  1.00
 52 GLU  HN     52 GLU  HB2     3.86 #SUP  1.00
 52 GLU  HN     52 GLU  HB3     3.86 #SUP  0.99  #QF  0.99
 39 ILE  HN     40 LYS  HN      3.27 #SUP  0.99  #QF  0.99
 38 CYSS HA     40 LYS  HN      4.48 #SUP  0.98  #QF  0.98
 38 CYSS HB2    40 LYS  HN      3.71 #SUP  0.90  #QF  0.53
 40 LYS  HN     40 LYS  QE      4.21 #SUP  0.99  #QF  0.99
 39 ILE  HB     40 LYS  HN      3.49 #SUP  1.00
 40 LYS  HN     40 LYS  HB2     2.93 #SUP  0.99  #QF  0.99
 40 LYS  HN     40 LYS  HG3     4.28 #SUP  1.00
 39 ILE  QG2    40 LYS  HN      3.27 #SUP  0.99  #QF  0.99
 42 ARG  HN     43 HIS  HN      3.40 #SUP  1.00
 40 LYS  HN     42 ARG  HN      4.00 #SUP  1.00
 41 HIST HN     42 ARG  HN      2.84 #SUP  1.00
 40 LYS  HA     42 ARG  HN      4.51 #SUP  0.99  #QF  0.99
 39 ILE  HA     42 ARG  HN      3.70 #SUP  1.00
 41 HIST HB3    42 ARG  HN      5.10 #SUP  1.00  #QF  0.98
 41 HIST HB2    42 ARG  HN      4.03 #SUP  0.88  #QF  0.88
 42 ARG  HN     43 HIS  QB      4.48 #SUP  0.48  #QF  0.48
 37 PHE  HB2    42 ARG  HN      4.50 #SUP  1.00
 42 ARG  HN     42 ARG  HB2     3.05 #SUP  1.00
 42 ARG  HN     42 ARG  HB3     2.93 #SUP  0.98  #QF  0.98
 42 ARG  HN     42 ARG  HG2     4.53 #SUP  0.99  #QF  0.99
 28 LEU  QD1    42 ARG  HN      4.93 #SUP  0.90  #QF  0.90
 12 THR  HB     13 ASN  HN      4.48 #SUP  0.84  #QF  0.84
 37 PHE  HA     38 CYSS HN      2.97 #SUP  0.99  #QF  0.99
 15 CYSS HA     38 CYSS HN      3.99 #SUP  1.00
 38 CYSS HN     38 CYSS HB2     3.73 #SUP  1.00
 37 PHE  HB3    38 CYSS HN      3.10 #SUP  0.97  #QF  0.97
 15 CYSS HB2    38 CYSS HN      3.42 #SUP  0.98  #QF  0.98
 38 CYSS HN     38 CYSS HB3     3.28 #SUP  0.99  #QF  0.99
 37 PHE  HB2    38 CYSS HN      3.66 #SUP  1.00
 17 ARG  HA     18 ALA  HN      3.03 #SUP  0.90  #QF  0.90
 18 ALA  HN     18 ALA  QB      3.05 #SUP  0.88  #QF  0.88
 25 MET  HN     26 MET  HN      3.80 #SUP  0.98  #QF  0.98
 26 MET  HN     27 LYS  HN      4.75 #SUP  0.98  #QF  0.98
 26 MET  HN     26 MET  HG3     3.82 #SUP  0.95  #QF  0.95
 26 MET  HN     26 MET  HG2     3.82 #SUP  0.99  #QF  0.99
 24 GLU  HB3    26 MET  HN      3.34 #SUP  0.90  #QF  0.90
 26 MET  HN     26 MET  HB3     3.06 #SUP  0.55  #QF  0.55
 29 THR  HN     30 CYSS HN      4.68 #SUP  0.90  #QF  0.90
 28 LEU  HN     29 THR  HN      4.33 #SUP  0.97  #QF  0.97
 28 LEU  HA     29 THR  HN      2.60 #SUP  0.79  #QF  0.79
 29 THR  HN     29 THR  HB      2.95 #SUP  0.84  #QF  0.84
 28 LEU  HB2    29 THR  HN      4.54 #SUP  1.00
 35 ARG  HN     36 ASN  HN      4.65 #SUP  1.00
 36 ASN  HN     36 ASN  HD21    4.77 #SUP  1.00
 35 ARG  HA     36 ASN  HN      2.80 #SUP  0.97  #QF  0.97
 29 THR  HN     42 ARG  HD3     5.50 #SUP  1.00
 16 GLU  HG3    36 ASN  HN      3.24 #SUP  0.93  #QF  0.74
 36 ASN  HN     36 ASN  HB3     3.48 #SUP  0.93  #QF  0.74
 35 ARG  HG2    36 ASN  HN      3.98 #SUP  1.00
 16 GLU  HB2    36 ASN  HN      4.18 #SUP  1.00
 35 ARG  HB3    36 ASN  HN      3.06 #SUP  0.99  #QF  0.99
 28 LEU  HN     37 PHE  HN      3.91 #SUP  0.91  #QF  0.91
 37 PHE  HN     37 PHE  HD1     4.67 #SUP  0.99  #QF  0.99
 36 ASN  HA     37 PHE  HN      2.72 #SUP  0.70  #QF  0.70
 37 PHE  HN     37 PHE  HB3     4.04 #SUP  1.00
 37 PHE  HN     37 PHE  HB2     3.36 #SUP  0.98  #QF  0.98
 30 CYSS HN     37 PHE  HN      5.17 #SUP  0.93  #QF  0.93
 38 CYSS HA     39 ILE  HN      3.08 #SUP  0.98  #QF  0.98
 38 CYSS HB2    39 ILE  HN      2.93 #SUP  0.83  #QF  0.83
 38 CYSS HB3    39 ILE  HN      4.17 #SUP  1.00
 24 GLU  HG2    39 ILE  HN      4.36 #SUP  0.95  #QF  0.95
 24 GLU  HB2    39 ILE  HN      4.98 #SUP  0.95  #QF  0.67
 39 ILE  HN     42 ARG  HB2     5.21 #SUP  0.95  #QF  0.67
 39 ILE  HN     39 ILE  HB      2.95 #SUP  1.00
 39 ILE  HN     39 ILE  HG13    3.49 #SUP  1.00
 39 ILE  HN     39 ILE  HG12    3.88 #SUP  1.00
 45 LEU  HN     46 ASP  HN      4.18 #SUP  0.99  #QF  0.99
 43 HIS  QB     46 ASP  HN      4.55 #SUP  0.97  #QF  0.97
 30 CYSS HA     31 GLU  HN      2.88 #SUP  0.87  #QF  0.87
 30 CYSS HB2    31 GLU  HN      4.52 #SUP  1.00
 31 GLU  HN     31 GLU  HB3     3.73 #SUP  1.00
 31 GLU  HN     31 GLU  HB2     3.73 #SUP  1.00
 40 LYS  QD     41 HIST HN      5.09 #SUP  1.00
 38 CYSS HN     41 HIST HN      4.23 #SUP  0.99  #QF  0.99
 41 HIST HN     42 ARG  HA      4.60 #SUP  1.00
 39 ILE  HA     41 HIST HN      4.78 #SUP  0.95  #QF  0.95
 41 HIST HN     41 HIST HB3     3.72 #SUP  0.99  #QF  0.99
 41 HIST HN     42 ARG  HB2     5.08 #SUP  1.00
 41 HIST HN     42 ARG  HB3     4.48 #SUP  0.99  #QF  0.99
 40 LYS  HB2    41 HIST HN      3.69 #SUP  1.00
 40 LYS  HB3    41 HIST HN      3.65 #SUP  0.96  #QF  0.96
 39 ILE  QG2    41 HIST HN      4.88 #SUP  0.97  #QF  0.97
 33 CYSS HN     35 ARG  HN      4.35 #SUP  0.99  #QF  0.99
 33 CYSS HN     34 SER  HA      4.77 #SUP  0.98  #QF  0.98
 30 CYSS HB3    33 CYSS HN      3.60 #SUP  0.98  #QF  0.98
 33 CYSS HN     33 CYSS HB2     3.93 #SUP  1.00
 33 CYSS HN     33 CYSS HB3     3.45 #SUP  0.98  #QF  0.98
 32 ARG  HB2    33 CYSS HN      3.26 #SUP  0.98  #QF  0.98
 32 ARG  HB3    33 CYSS HN      3.56 #SUP  1.00
 41 HIST HN     41 HIST HB2     3.13 #SUP  0.87  #QF  0.87
 10 ILE  HN     11 PHE  HN      4.61 #SUP  0.97  #QF  0.97
 40 LYS  HN     41 HIST HN      2.84 #SUP  1.00
 28 LEU  HG     29 THR  HN      5.20 #SUP  0.97  #QF  0.97
 31 GLU  HN     32 ARG  HN      3.29 #SUP  0.92  #QF  0.92
 11 PHE  HN     11 PHE  QD      4.95 #SUP  0.98  #QF  0.98
 11 PHE  HN     12 THR  HN      5.50 #SUP  1.00  #QF  0.99
 12 THR  HN     12 THR  QG2     4.87 #SUP  0.99  #QF  0.99
 13 ASN  HD21   26 MET  HA      4.74 #SUP  0.97  #QF  0.97
 13 ASN  HD21   24 GLU  HB2     5.50 #SUP  0.84  #QF  0.84
 13 ASN  HD22   24 GLU  HB2     5.50 #SUP  0.94  #QF  0.68
 24 GLU  HB2    36 ASN  HD22    5.50 #SUP  0.94  #QF  0.68
 13 ASN  HN     13 ASN  HD21    5.03 #SUP  0.99  #QF  0.99
 14 LYS  HN     15 CYSS HN      4.55 #SUP  0.96  #QF  0.96
 13 ASN  HN     14 LYS  HN      4.70 #SUP  0.99  #QF  0.99
 15 CYSS HN     37 PHE  HA      5.29 #SUP  1.00
 15 CYSS HN     38 CYSS HN      5.50 #SUP  1.00
 16 GLU  HN     37 PHE  HN      4.70 #SUP  0.66  #QF  0.66
 16 GLU  HN     37 PHE  HE2     5.09 #SUP  0.85  #QF  0.85
 17 ARG  HN     20 CYSS HN      5.33 #SUP  0.96  #QF  0.96
 17 ARG  HN     38 CYSS HN      5.08 #SUP  0.99  #QF  0.99
 17 ARG  HB3    18 ALA  HN      5.02 #SUP  1.00
 21 ARG  HN     22 GLN  HN      3.96 #SUP  0.91  #QF  0.91
 22 GLN  HN     22 GLN  HB3     3.60 #SUP  0.87  #QF  0.87
 22 GLN  HN     22 GLN  HB2     3.01 #SUP  0.87  #QF  0.87
 22 GLN  HN     38 CYSS HB3     4.84 #SUP  0.99  #QF  0.99
 15 CYSS HB3    22 GLN  HN      3.93 #SUP  0.76  #QF  0.76
 27 LYS  HN     27 LYS  QE      5.50 #SUP  0.92  #QF  0.59
 23 ARG  HN     38 CYSS HB3     5.50 #SUP  0.92  #QF  0.59
 24 GLU  HN     24 GLU  HB3     4.15 #SUP  0.73  #QF  0.73
 26 MET  HN     28 LEU  QD1     4.61 #SUP  0.96  #QF  0.96
 27 LYS  HN     28 LEU  QD1     5.50 #SUP  0.89  #QF  0.47
 27 LYS  HN     28 LEU  QD2     5.50 #SUP  0.89  #QF  0.47
 24 GLU  HB2    28 LEU  HN      4.78 #SUP  0.61  #QF  0.61
 28 LEU  HN     28 LEU  HB2     3.37 #SUP  0.99  #QF  0.99
 30 CYSS HN     31 GLU  HN      4.79 #SUP  1.00
 30 CYSS HB3    31 GLU  HN      4.90 #SUP  1.00
 32 ARG  HN     32 ARG  HD2     5.33 #SUP  1.00
 32 ARG  HN     51 GLY  QA      5.47 #SUP  0.99  #QF  0.99
 33 CYSS HN     51 GLY  QA      4.78 #SUP  1.00
 30 CYSS HA     33 CYSS HN      5.16 #SUP  0.99  #QF  0.99
 30 CYSS HN     33 CYSS HN      5.50 #SUP  1.00
 31 GLU  HN     33 CYSS HN      4.75 #SUP  0.95  #QF  0.95
 35 ARG  HN     37 PHE  HE1     4.72 #SUP  0.98  #QF  0.81
 36 ASN  HN     37 PHE  HZ      5.36 #SUP  1.00
 37 PHE  HN     38 CYSS HN      4.76 #SUP  1.00
 28 LEU  HB2    37 PHE  HN      3.74 #SUP  0.62  #QF  0.62
 37 PHE  HN     42 ARG  HD2     5.42 #SUP  0.94  #QF  0.94
 38 CYSS HN     42 ARG  HA      4.76 #SUP  1.00
 39 ILE  HN     41 HIST HN      4.73 #SUP  0.99  #QF  0.99
 38 CYSS HN     39 ILE  HN      4.86 #SUP  0.99  #QF  0.99
 41 HIST HN     43 HIS  HN      4.97 #SUP  1.00
 37 PHE  HB2    41 HIST HN      5.30 #SUP  1.00
 38 CYSS HB3    41 HIST HN      5.26 #SUP  1.00  #QF  0.95
 40 LYS  QE     41 HIST HN      5.50 #SUP  1.00  #QF  0.95
 40 LYS  HB3    42 ARG  HN      5.13 #SUP  0.87  #QF  0.87
 42 ARG  HN     46 ASP  HB2     4.94 #SUP  0.67  #QF  0.67
 38 CYSS HN     42 ARG  HN      4.94 #SUP  0.99  #QF  0.99
 43 HIS  HN     44 PRO  HD2     5.09 #SUP  0.99  #QF  0.99
 45 LEU  HN     47 HIS  HN      4.89 #SUP  0.98  #QF  0.98
 47 HIS  HN     47 HIS  HD2     5.03 #SUP  0.99  #QF  0.99
 33 CYSS HB3    50 SER  HN      4.72 #SUP  0.88  #QF  0.88
 33 CYSS HB2    50 SER  HN      5.07 #SUP  0.95  #QF  0.95
 49 CYSS HN     50 SER  HN      5.08 #SUP  0.98  #QF  0.98
 33 CYSS HB3    52 GLU  HN      5.07 #SUP  0.94  #QF  0.94
 52 GLU  QG     53 GLY  HN      5.06 #SUP  0.99  #QF  0.99
 52 GLU  HB3    53 GLY  HN      4.75 #SUP  0.99  #QF  0.99
 47 HIS  HN     47 HIS  HD1     4.48 #SUP  0.94  #QF  0.94
 11 PHE  HA     11 PHE  QD      4.66 #SUP  0.99  #QF  0.99
 47 HIS  HD2    49 CYSS QB      4.09 #SUP  0.99  #QF  0.99
 47 HIS  HD2    49 CYSS HN      4.72 #SUP  0.99  #QF  0.99
 41 HIST HD2    46 ASP  HB2     4.52 #SUP  0.99  #QF  0.99
 43 HIS  HA     43 HIS  HD2     4.43 #SUP  0.98  #QF  0.98
 43 HIS  QB     43 HIS  HD2     3.61 #SUP  0.95  #QF  0.95
 37 PHE  HA     37 PHE  HD2     4.63 #SUP  0.96  #QF  0.96
 37 PHE  HA     37 PHE  HD1     4.57 #SUP  0.99  #QF  0.99
 15 CYSS HB2    37 PHE  HA      4.38 #SUP  1.00
 20 CYSS HA     41 HIST HE1     4.44 #SUP  0.99  #QF  0.99
 20 CYSS HB2    41 HIST HE1     4.07 #SUP  1.00
 40 LYS  HB2    41 HIST HE1     5.40 #SUP  0.84  #QF  0.84
 43 HIS  HE1    45 LEU  HN      4.56 #SUP  0.99  #QF  0.99
 43 HIS  HE1    44 PRO  HD2     4.67 #SUP  0.93  #QF  0.93
 43 HIS  HE1    45 LEU  HG      3.05 #SUP  0.93  #QF  0.93
 43 HIS  HE1    45 LEU  QD1     3.21 #SUP  0.91  #QF  0.91
 30 CYSS HA     47 HIS  HE1     4.94 #SUP  0.92  #QF  0.81
 43 HIS  HA     47 HIS  HE1     5.33 #SUP  0.92  #QF  0.81
 44 PRO  HD3    47 HIS  HE1     4.08 #SUP  0.76  #QF  0.76
 30 CYSS HB3    47 HIS  HE1     4.71 #SUP  0.99  #QF  0.99
 30 CYSS HB2    47 HIS  HE1     3.37 #SUP  0.75  #QF  0.75
 44 PRO  HA     47 HIS  HE1     3.45 #SUP  0.96  #QF  0.96
 47 HIS  HE1    49 CYSS QB      4.41 #SUP  0.82  #QF  0.82
 17 ARG  HA     18 ALA  QB      4.34 #SUP  0.92  #QF  0.92
 39 ILE  HN     39 ILE  QG2     3.87 #SUP  1.00
 39 ILE  QG2    40 LYS  HA      3.73 #SUP  1.00
 37 PHE  HB3    42 ARG  HN      4.47 #SUP  1.00
 10 ILE  QG2    10 ILE  HG12    3.34 #SUP  0.99  #QF  0.99
 18 ALA  QB     19 GLY  HA1     4.77 #SUP  0.87  #QF  0.87
 33 CYSS HA     51 GLY  QA      4.39 #SUP  0.95  #QF  0.95
 33 CYSS HB3    51 GLY  QA      4.17 #SUP  0.98  #QF  0.98
 32 ARG  HB2    51 GLY  QA      4.18 #SUP  0.97  #QF  0.97
 32 ARG  HB3    51 GLY  QA      3.82 #SUP  0.97  #QF  0.97
 51 GLY  QA     52 GLU  QG      5.50 #SUP  0.84  #QF  0.53
 35 ARG  QD     36 ASN  HN      4.72 #SUP  1.00
 35 ARG  HN     35 ARG  QD      4.63 #SUP  1.00
 35 ARG  QD     37 PHE  HZ      3.90 #SUP  0.97  #QF  0.97
 35 ARG  HA     35 ARG  QD      4.07 #SUP  0.97  #QF  0.97
 16 GLU  HG3    35 ARG  QD      4.88 #SUP  0.93  #QF  0.93
 35 ARG  HB2    35 ARG  QD      3.33 #SUP  0.98  #QF  0.98
 16 GLU  HB2    35 ARG  QD      4.00 #SUP  1.00
 35 ARG  HB3    35 ARG  QD      3.40 #SUP  1.00
 32 ARG  HB2    32 ARG  HD2     4.11 #SUP  1.00  #QF  0.99
 32 ARG  HD2    44 PRO  HG3     5.28 #SUP  1.00  #QF  0.99
 32 ARG  HB2    32 ARG  HD3     4.11 #SUP  1.00
 21 ARG  HA     21 ARG  QD      4.38 #SUP  1.00
 21 ARG  HB2    21 ARG  QD      3.70 #SUP  0.99  #QF  0.99
 42 ARG  HA     42 ARG  HD3     3.86 #SUP  0.98  #QF  0.98
 28 LEU  HB2    42 ARG  HD3     4.59 #SUP  0.99  #QF  0.98
 28 LEU  QD2    42 ARG  HD3     3.68 #SUP  1.00  #QF  0.95
 42 ARG  HA     42 ARG  HD2     4.14 #SUP  0.99  #QF  0.99
 28 LEU  HB2    42 ARG  HD2     4.45 #SUP  1.00
 42 ARG  HB2    42 ARG  HD2     3.93 #SUP  1.00
 28 LEU  HB3    42 ARG  HD2     3.80 #SUP  0.99  #QF  0.99
 28 LEU  QD2    42 ARG  HD2     3.92 #SUP  1.00
 17 ARG  HA     17 ARG  HD2     4.27 #SUP  1.00
 43 HIS  HN     46 ASP  HB3     5.25 #SUP  1.00
 46 ASP  HN     46 ASP  HB3     3.97 #SUP  0.99  #QF  0.99
 46 ASP  HN     46 ASP  HB2     3.61 #SUP  0.98  #QF  0.98
 43 HIS  QB     46 ASP  HB2     4.00 #SUP  0.94  #QF  0.94
 14 LYS  HA     14 LYS  QE      5.43 #SUP  0.78  #QF  0.78
 14 LYS  HG2    14 LYS  QE      3.87 #SUP  0.86  #QF  0.60
 28 LEU  HB2    28 LEU  QD1     3.26 #SUP  1.00  #QF  0.99
 28 LEU  HB3    29 THR  HN      4.61 #SUP  0.95  #QF  0.95
 12 THR  HB     23 ARG  QB      3.48 #SUP  0.78  #QF  0.78
 28 LEU  HA     29 THR  HB      4.96 #SUP  0.98  #QF  0.98
 29 THR  HB     34 SER  HA      4.43 #SUP  0.98  #QF  0.98
 39 ILE  HN     39 ILE  QD1     4.09 #SUP  1.00
 39 ILE  HA     39 ILE  QD1     3.87 #SUP  0.99  #QF  0.99
 39 ILE  HB     39 ILE  QD1     3.21 #SUP  0.99  #QF  0.99
 27 LYS  QD     27 LYS  QE      2.97 #SUP  0.97  #QF  0.57
 27 LYS  HG2    27 LYS  QE      3.67 #SUP  0.99  #QF  0.68
 40 LYS  HG2    40 LYS  QE      4.07 #SUP  0.99  #QF  0.68
 27 LYS  HG3    27 LYS  QE      3.67 #SUP  0.94  #QF  0.72
 40 LYS  HG3    40 LYS  QE      4.07 #SUP  0.94  #QF  0.72
 39 ILE  QG2    40 LYS  QE      4.66 #SUP  0.84  #QF  0.84
 27 LYS  HB3    27 LYS  QE      4.46 #SUP  0.87  #QF  0.87
 36 ASN  HN     36 ASN  HB2     3.48 #SUP  0.98  #QF  0.98
 29 THR  HB     30 CYSS HN      4.16 #SUP  1.00
 45 LEU  HN     45 LEU  HB2     3.92 #SUP  1.00
 45 LEU  HB2    45 LEU  QD1     3.15 #SUP  0.95  #QF  0.95
 45 LEU  HB2    46 ASP  HN      4.72 #SUP  0.98  #QF  0.98
 45 LEU  HN     45 LEU  HB3     3.92 #SUP  0.99  #QF  0.99
 45 LEU  HB3    45 LEU  QD1     3.15 #SUP  0.99  #QF  0.92
 10 ILE  HA     10 ILE  QD1     4.18 #SUP  1.00
 13 ASN  HB3    36 ASN  HD21    4.68 #SUP  0.97  #QF  0.97
  9 LYS  QB     11 PHE  HB2     4.57 #SUP  0.82  #QF  0.82
  9 LYS  QB     11 PHE  HB3     4.57 #SUP  0.75  #QF  0.75
 10 ILE  HB     10 ILE  QD1     3.28 #SUP  1.00
 16 GLU  HG2    36 ASN  HN      4.60 #SUP  1.00
 44 PRO  HA     49 CYSS HN      5.03 #SUP  0.95  #QF  0.95
 44 PRO  HA     49 CYSS HA      5.24 #SUP  0.85  #QF  0.85
 44 PRO  HA     49 CYSS QB      3.22 #SUP  0.97  #QF  0.97
 24 GLU  HG2    38 CYSS HA      3.78 #SUP  1.00
 24 GLU  HG2    38 CYSS HB2     4.49 #SUP  1.00
 24 GLU  HG2    38 CYSS HB3     4.73 #SUP  1.00
 24 GLU  HG2    39 ILE  HG13    4.75 #SUP  0.71  #QF  0.71
 24 GLU  HG2    28 LEU  QD1     4.05 #SUP  0.99  #QF  0.99
 24 GLU  HG3    39 ILE  HN      4.36 #SUP  1.00
 24 GLU  HG3    38 CYSS HA      3.78 #SUP  1.00
 31 GLU  HG3    32 ARG  HG3     4.95 #SUP  0.99  #QF  0.99
 24 GLU  HG3    39 ILE  HG13    4.75 #SUP  0.96  #QF  0.67
 24 GLU  HG3    28 LEU  QD1     4.05 #SUP  0.98  #QF  0.98
 31 GLU  HA     31 GLU  HG3     4.12 #SUP  1.00
 31 GLU  HG3    32 ARG  HG2     4.95 #SUP  1.00
 39 ILE  HA     42 ARG  HB2     3.95 #SUP  1.00
 39 ILE  HA     42 ARG  HB3     3.06 #SUP  1.00
 39 ILE  HA     39 ILE  HG13    3.61 #SUP  1.00
 39 ILE  HA     39 ILE  HG12    3.59 #SUP  1.00
 39 ILE  HA     39 ILE  QG2     3.04 #SUP  0.64  #QF  0.64
 47 HIS  HD2    49 CYSS HA      3.32 #SUP  0.96  #QF  0.96
 22 GLN  HG2    40 LYS  QE      4.43 #SUP  1.00
 22 GLN  HG2    38 CYSS HB2     4.86 #SUP  0.99  #QF  0.99
 22 GLN  HN     22 GLN  HG3     4.18 #SUP  1.00
 22 GLN  HG3    40 LYS  QE      4.43 #SUP  0.93  #QF  0.30
 26 MET  HN     26 MET  HB2     4.06 #SUP  1.00
 26 MET  HB2    28 LEU  QD2     4.68 #SUP  0.94  #QF  0.94
 26 MET  HB3    27 LYS  HN      4.47 #SUP  1.00
 14 LYS  QB     14 LYS  QE      4.47 #SUP  0.95  #QF  0.95
 29 THR  QG2    34 SER  HB2     4.49 #SUP  0.99  #QF  0.99
 29 THR  QG2    34 SER  HB3     4.49 #SUP  0.99  #QF  0.99
 17 ARG  HB2    41 HIST HB3     4.51 #SUP  0.96  #QF  0.96
 38 CYSS HN     41 HIST HB3     4.62 #SUP  0.95  #QF  0.95
 41 HIST HB2    47 HIS  HB3     4.60 #SUP  0.97  #QF  0.97
 33 CYSS HB2    51 GLY  QA      4.63 #SUP  0.99  #QF  0.99
 33 CYSS HB2    35 ARG  HG3     4.25 #SUP  0.97  #QF  0.97
 33 CYSS HB2    35 ARG  HG2     4.70 #SUP  0.99  #QF  0.99
 38 CYSS HN     41 HIST HB2     4.51 #SUP  0.96  #QF  0.96
 32 ARG  HB3    33 CYSS HB3     5.15 #SUP  1.00  #QF  0.74
 33 CYSS HB3    35 ARG  HG3     5.46 #SUP  1.00  #QF  0.74
 25 MET  HB2    26 MET  HN      4.57 #SUP  0.96  #QF  0.96
 25 MET  HB3    26 MET  HN      4.57 #SUP  0.98  #QF  0.98
 27 LYS  HB3    28 LEU  HN      4.70 #SUP  1.00
 27 LYS  HB2    28 LEU  HN      4.70 #SUP  1.00
 27 LYS  HN     27 LYS  HB2     3.92 #SUP  1.00
 27 LYS  HB2    27 LYS  QE      4.46 #SUP  0.99  #QF  0.99
 12 THR  HA     12 THR  QG2     3.14 #SUP  0.89  #QF  0.89
 44 PRO  HB2    45 LEU  HN      4.63 #SUP  1.00
 44 PRO  HB2    49 CYSS QB      3.50 #SUP  0.93  #QF  0.93
 35 ARG  HB2    36 ASN  HN      3.96 #SUP  1.00
 35 ARG  HB2    37 PHE  HZ      4.06 #SUP  0.99  #QF  0.99
 44 PRO  HB3    45 LEU  HN      4.63 #SUP  0.99  #QF  0.99
 44 PRO  HB3    49 CYSS QB      3.50 #SUP  0.82  #QF  0.82
 40 LYS  HB2    40 LYS  QD      3.74 #SUP  1.00
 39 ILE  QG2    40 LYS  HB2     4.78 #SUP  0.95  #QF  0.95
 40 LYS  HN     40 LYS  HB3     3.54 #SUP  1.00
 40 LYS  HB3    40 LYS  QD      3.73 #SUP  1.00
 35 ARG  HB3    37 PHE  HZ      4.29 #SUP  1.00
 16 GLU  HG3    35 ARG  HB3     4.49 #SUP  0.99  #QF  0.99
 24 GLU  HB3    38 CYSS HA      4.57 #SUP  1.00
 24 GLU  HB3    28 LEU  QD1     4.64 #SUP  0.91  #QF  0.91
 24 GLU  HB2    26 MET  HN      4.49 #SUP  1.00
 24 GLU  HB2    38 CYSS HA      4.31 #SUP  0.99  #QF  0.99
 24 GLU  HB2    28 LEU  QD1     4.65 #SUP  0.98  #QF  0.98
 14 LYS  HA     23 ARG  QB      4.84 #SUP  0.97  #QF  0.42
 10 ILE  HA     10 ILE  HG12    3.97 #SUP  0.95  #QF  0.95
 10 ILE  HA     10 ILE  HG13    3.97 #SUP  1.00
 10 ILE  HA     10 ILE  QG2     3.08 #SUP  0.97  #QF  0.97
 30 CYSS HB3    37 PHE  HE1     4.42 #SUP  0.96  #QF  0.84
 30 CYSS HB3    37 PHE  HZ      5.36 #SUP  1.00
 15 CYSS HB3    38 CYSS HN      4.40 #SUP  1.00
 14 LYS  HA     15 CYSS HB3     4.85 #SUP  0.99  #QF  0.99
 15 CYSS HB3    38 CYSS HB3     4.10 #SUP  1.00
 15 CYSS HB3    20 CYSS HB3     4.26 #SUP  0.58  #QF  0.58
 30 CYSS HB2    33 CYSS HN      4.16 #SUP  0.93  #QF  0.93
 30 CYSS HB2    35 ARG  HN      3.47 #SUP  1.00  #QF  0.95
 30 CYSS HB2    37 PHE  HD1     4.81 #SUP  0.98  #QF  0.84
 30 CYSS HB2    37 PHE  HE1     4.96 #SUP  0.98  #QF  0.84
 30 CYSS HB2    37 PHE  HZ      4.77 #SUP  0.98  #QF  0.98
 30 CYSS HB2    35 ARG  HB2     4.65 #SUP  0.74  #QF  0.74
 15 CYSS HB2    20 CYSS HB3     4.73 #SUP  0.39  #QF  0.39
 26 MET  HG3    28 LEU  HG      4.44 #SUP  1.00
 26 MET  HG3    28 LEU  QD1     3.92 #SUP  1.00  #QF  0.78
 26 MET  HG2    28 LEU  HG      4.44 #SUP  0.98  #QF  0.98
 26 MET  HG2    28 LEU  QD1     3.92 #SUP  1.00  #QF  0.97
 32 ARG  HN     32 ARG  HB3     3.80 #SUP  1.00
 15 CYSS HA     37 PHE  HA      3.24 #SUP  1.00
 15 CYSS HA     38 CYSS HB3     4.65 #SUP  1.00
 15 CYSS HA     16 GLU  HG3     4.26 #SUP  1.00
 15 CYSS HA     16 GLU  HB2     4.64 #SUP  0.99  #QF  0.99
 37 PHE  HB3    42 ARG  HA      3.45 #SUP  1.00
 37 PHE  HB2    42 ARG  HA      3.15 #SUP  1.00
 17 ARG  HN     20 CYSS HB2     4.91 #SUP  1.00  #QF  0.95
 20 CYSS HB2    21 ARG  HN      5.25 #SUP  1.00  #QF  0.95
 17 ARG  HB3    20 CYSS HB2     3.80 #SUP  1.00
 17 ARG  HB2    20 CYSS HB2     4.41 #SUP  0.99  #QF  0.99
 20 CYSS HB3    41 HIST HE1     4.06 #SUP  0.99  #QF  0.99
 17 ARG  HB3    20 CYSS HB3     3.71 #SUP  0.99  #QF  0.99
 17 ARG  HB2    20 CYSS HB3     4.31 #SUP  0.94  #QF  0.94
 17 ARG  HB3    41 HIST HB3     4.60 #SUP  0.99  #QF  0.99
 17 ARG  HB2    41 HIST HB2     4.63 #SUP  0.98  #QF  0.98
 15 CYSS HB3    17 ARG  HB2     4.87 #SUP  0.81  #QF  0.65
 15 CYSS HB2    38 CYSS HB2     4.28 #SUP  0.99  #QF  0.99
 22 GLN  HG3    38 CYSS HB2     4.86 #SUP  0.83  #QF  0.77
 24 GLU  HG3    38 CYSS HB2     4.49 #SUP  0.98  #QF  0.98
 22 GLN  HB3    38 CYSS HB2     4.12 #SUP  0.74  #QF  0.74
 15 CYSS HB2    38 CYSS HB3     3.42 #SUP  1.00
 22 GLN  HB3    38 CYSS HB3     3.94 #SUP  0.98  #QF  0.98
 38 CYSS HB3    40 LYS  HN      4.67 #SUP  0.94  #QF  0.94
 24 GLU  HG3    38 CYSS HB3     4.73 #SUP  0.80  #QF  0.80
 49 CYSS HN     49 CYSS QB      3.61 #SUP  0.96  #QF  0.96
 21 ARG  HB3    21 ARG  QD      3.70 #SUP  1.00
 31 GLU  HA     34 SER  HN      4.56 #SUP  0.90  #QF  0.90
 31 GLU  HA     31 GLU  HG2     4.12 #SUP  0.89  #QF  0.89
 29 THR  QG2    31 GLU  HA      4.75 #SUP  0.70  #QF  0.70
 40 LYS  HA     40 LYS  HG2     3.66 #SUP  0.97  #QF  0.93
 40 LYS  HA     40 LYS  HG3     3.66 #SUP  1.00
 22 GLN  HB2    38 CYSS HB2     4.41 #SUP  1.00
 22 GLN  HB2    38 CYSS HB3     4.13 #SUP  1.00
 28 LEU  HB2    42 ARG  HB2     4.71 #SUP  0.95  #QF  0.95
 28 LEU  QD1    42 ARG  HB3     4.29 #SUP  0.99  #QF  0.99
 32 ARG  HA     32 ARG  HD2     4.83 #SUP  1.00
 32 ARG  HA     32 ARG  HD3     4.83 #SUP  1.00
 32 ARG  HA     32 ARG  HG2     3.69 #SUP  1.00
 16 GLU  HA     16 GLU  HG3     3.54 #SUP  1.00
 16 GLU  HA     16 GLU  HG2     3.12 #SUP  1.00
 39 ILE  HG12   42 ARG  HB3     4.49 #SUP  0.31  #QF  0.31
 40 LYS  HN     40 LYS  QD      4.25 #SUP  0.90  #QF  0.90
 14 LYS  HA     14 LYS  QD      5.33 #SUP  0.94  #QF  0.46
 27 LYS  HA     27 LYS  QD      4.39 #SUP  1.00
 40 LYS  HA     40 LYS  QD      4.17 #SUP  1.00
 22 GLN  HA     23 ARG  QB      4.71 #SUP  0.93  #QF  0.91
 16 GLU  HN     16 GLU  HB3     3.81 #SUP  1.00
 16 GLU  HB3    35 ARG  QD      4.20 #SUP  0.98  #QF  0.98
 16 GLU  HB3    35 ARG  HB3     4.23 #SUP  1.00
 16 GLU  HB2    35 ARG  HB2     4.32 #SUP  0.98  #QF  0.98
 16 GLU  HB2    35 ARG  HB3     4.11 #SUP  1.00
 17 ARG  HA     17 ARG  HD3     4.27 #SUP  0.99  #QF  0.99
 25 MET  HA     25 MET  HG2     4.03 #SUP  0.96  #QF  0.96
 25 MET  HA     25 MET  HG3     4.03 #SUP  0.99  #QF  0.99
 41 HIST HB3    47 HIS  HB2     4.31 #SUP  0.98  #QF  0.98
 41 HIST HB2    47 HIS  HB2     4.62 #SUP  0.87  #QF  0.87
 41 HIST HB3    47 HIS  HB3     4.13 #SUP  0.99  #QF  0.99
 51 GLY  QA     52 GLU  HA      4.71 #SUP  0.91  #QF  0.73
 52 GLU  HA     52 GLU  QG      3.53 #SUP  0.99  #QF  0.99
 27 LYS  HA     28 LEU  HN      2.94 #SUP  0.92  #QF  0.92
 27 LYS  HA     36 ASN  HD22    5.50 #SUP  1.00  #QF  0.96
 13 ASN  HB3    27 LYS  HA      4.95 #SUP  0.61  #QF  0.61
 27 LYS  HA     27 LYS  HG2     3.82 #SUP  1.00
 27 LYS  HA     27 LYS  HG3     3.82 #SUP  1.00
 43 HIS  HA     44 PRO  HG3     4.50 #SUP  1.00
 32 ARG  HD3    44 PRO  HG3     5.28 #SUP  0.96  #QF  0.96
 43 HIS  HA     44 PRO  HG2     4.50 #SUP  1.00
 32 ARG  HD2    44 PRO  HG2     5.28 #SUP  0.98  #QF  0.98
 32 ARG  HD3    44 PRO  HG2     5.28 #SUP  1.00  #QF  0.75
 14 LYS  HA     14 LYS  HG2     4.18 #SUP  0.98  #QF  0.98
 45 LEU  HN     45 LEU  HG      3.57 #SUP  0.99  #QF  0.99
 45 LEU  HA     45 LEU  HG      3.86 #SUP  1.00
 21 ARG  HA     21 ARG  HG3     3.93 #SUP  0.99  #QF  0.99
 31 GLU  HG2    32 ARG  HG3     4.95 #SUP  0.99  #QF  0.99
 32 ARG  HA     32 ARG  HG3     3.69 #SUP  1.00
 21 ARG  HA     21 ARG  HG2     3.93 #SUP  0.99  #QF  0.99
 31 GLU  HG2    32 ARG  HG2     4.95 #SUP  0.99  #QF  0.99
 17 ARG  HN     17 ARG  HG3     4.68 #SUP  1.00
 17 ARG  HA     17 ARG  HG3     4.20 #SUP  1.00
 17 ARG  HA     17 ARG  HG2     4.20 #SUP  1.00
 35 ARG  HA     35 ARG  HG3     3.75 #SUP  1.00
 35 ARG  HA     35 ARG  HG2     3.49 #SUP  1.00
 39 ILE  HA     42 ARG  HG3     4.72 #SUP  1.00
 42 ARG  HN     42 ARG  HG3     4.53 #SUP  1.00
 28 LEU  QD2    42 ARG  HG3     4.53 #SUP  1.00  #QF  0.88
 39 ILE  HA     42 ARG  HG2     4.72 #SUP  0.99  #QF  0.99
 28 LEU  QD2    42 ARG  HG2     4.53 #SUP  0.99  #QF  0.99
 28 LEU  QD1    39 ILE  HN      4.19 #SUP  0.99  #QF  0.99
 28 LEU  HA     28 LEU  QD1     4.39 #SUP  0.99  #QF  0.99
 28 LEU  QD1    42 ARG  HB2     3.90 #SUP  0.97  #QF  0.97
 28 LEU  QD1    38 CYSS HA      4.43 #SUP  0.99  #QF  0.99
 28 LEU  QD1    39 ILE  HA      3.40 #SUP  0.95  #QF  0.95
 28 LEU  QD1    42 ARG  HD2     4.43 #SUP  0.99  #QF  0.99
 26 MET  QE     28 LEU  QD1     4.04 #SUP  0.60  #QF  0.60
 45 LEU  HN     45 LEU  QD1     4.42 #SUP  0.96  #QF  0.96
 45 LEU  HA     45 LEU  QD1     3.90 #SUP  0.99  #QF  0.99
 40 LYS  HN     40 LYS  HG2     4.28 #SUP  1.00
 14 LYS  HG3    14 LYS  QE      3.87 #SUP  0.98  #QF  0.98
 14 LYS  HA     14 LYS  HG3     4.18 #SUP  1.00
 14 LYS  HG2    15 CYSS HN      4.68 #SUP  1.00
 28 LEU  QD2    29 THR  HN      4.23 #SUP  0.99  #QF  0.99
 28 LEU  HA     28 LEU  QD2     3.09 #SUP  0.97  #QF  0.97
 28 LEU  QD2    39 ILE  HA      4.38 #SUP  0.98  #QF  0.98
 26 MET  HG3    28 LEU  QD2     3.94 #SUP  0.99  #QF  0.99
 26 MET  HG2    28 LEU  QD2     3.94 #SUP  0.98  #QF  0.98
 28 LEU  HB2    28 LEU  QD2     3.57 #SUP  0.99  #QF  0.99
 26 MET  QE     28 LEU  QD2     3.74 #SUP  0.74  #QF  0.74
 28 LEU  QD2    42 ARG  HB2     3.66 #SUP  0.99  #QF  0.99
 28 LEU  QD2    42 ARG  HB3     4.48 #SUP  0.97  #QF  0.97
 45 LEU  HN     45 LEU  QD2     4.35 #SUP  0.97  #QF  0.97
 43 HIS  HE1    45 LEU  QD2     4.48 #SUP  0.99  #QF  0.99
 45 LEU  HA     45 LEU  QD2     2.74 #SUP  0.99  #QF  0.99
 54 HIS  HA     55 PRO  HD3     3.74 #SUP  0.98  #QF  0.98
 54 HIS  HA     55 PRO  HD2     3.74 #SUP  0.99  #QF  0.99
 29 THR  HN     29 THR  QG2     4.21 #SUP  1.00  #QF  0.93
 29 THR  QG2    36 ASN  HN      4.47 #SUP  1.00  #QF  0.93
 29 THR  QG2    34 SER  HN      4.00 #SUP  1.00
 29 THR  QG2    36 ASN  HA      4.34 #SUP  0.90  #QF  0.90
 29 THR  QG2    34 SER  HA      3.05 #SUP  0.97  #QF  0.97
 56 THR  HA     56 THR  QG2     3.72 #SUP  1.00
 12 THR  QG2    25 MET  HA      3.68 #SUP  1.00  #QF  0.99
 12 THR  QG2    23 ARG  QB      3.80 #SUP  0.60  #QF  0.60
 12 THR  QG2    25 MET  HG3     4.73 #SUP  0.93  #QF  0.93
 43 HIS  QB     44 PRO  HD3     4.27 #SUP  1.00
 43 HIS  HA     44 PRO  HD3     3.09 #SUP  0.99  #QF  0.99
 43 HIS  HA     44 PRO  HD2     3.60 #SUP  1.00
 43 HIS  QB     44 PRO  HD2     4.58 #SUP  1.00
 28 LEU  HB3    28 LEU  QD2     3.22 #SUP  0.99  #QF  0.99
  9 LYS  QB     11 PHE  QD      4.72 #SUP  0.69  #QF  0.69
  9 LYS  QB     11 PHE  QE      4.68 #SUP  0.78  #QF  0.78
 28 LEU  QD1    39 ILE  HG13    3.14 #SUP  0.98  #QF  0.97
 28 LEU  QD1    39 ILE  HB      4.28 #SUP  0.98  #QF  0.79
 28 LEU  HB3    28 LEU  QD1     3.44 #SUP  0.96  #QF  0.96
 39 ILE  QG2    39 ILE  HG13    3.45 #SUP  1.00  #QF  0.99
 39 ILE  QG2    40 LYS  QD      3.88 #SUP  1.00  #QF  0.99
 39 ILE  QG2    39 ILE  HG12    3.05 #SUP  0.97  #QF  0.97
 44 PRO  HA     47 HIS  HD2     4.91 #SUP  0.95  #QF  0.95
 41 HIST HD2    46 ASP  HB3     3.79 #SUP  0.85  #QF  0.85
 40 LYS  HB3    41 HIST HD2     4.81 #SUP  0.71  #QF  0.71
  9 LYS  HA      9 LYS  HG2     3.94 #SUP  0.95  #QF  0.95
  9 LYS  HA      9 LYS  HG3     3.94 #SUP  0.93  #QF  0.93
 10 ILE  QG2    10 ILE  HG13    3.34 #SUP  0.96  #QF  0.96
 28 LEU  QD1    39 ILE  HG12    3.96 #SUP  0.89  #QF  0.89
 16 GLU  HB3    37 PHE  HZ      5.25 #SUP  0.99  #QF  0.99
 16 GLU  HB2    37 PHE  HZ      5.02 #SUP  0.99  #QF  0.99
 16 GLU  HB2    17 ARG  HN      4.99 #SUP  0.99  #QF  0.99
 16 GLU  HB3    36 ASN  HN      5.12 #SUP  1.00
 24 GLU  HG3    26 MET  HN      5.50 #SUP  0.98  #QF  0.98
 24 GLU  HG2    26 MET  HN      5.50 #SUP  0.98  #QF  0.98
 33 CYSS HB3    35 ARG  HN      5.21 #SUP  0.99  #QF  0.99
 38 CYSS HA     39 ILE  HB      4.88 #SUP  1.00
 40 LYS  QE     41 HIST HE1     5.50 #SUP  0.57  #QF  0.57
 17 ARG  HB3    41 HIST HE1     4.93 #SUP  0.99  #QF  0.99
 17 ARG  HB2    41 HIST HE1     4.59 #SUP  0.89  #QF  0.89
 40 LYS  HB3    41 HIST HE1     5.19 #SUP  0.89  #QF  0.89
 37 PHE  HD1    42 ARG  HA      4.86 #SUP  0.98  #QF  0.98
 37 PHE  HN     42 ARG  HA      4.88 #SUP  0.99  #QF  0.99
 43 HIS  QB     45 LEU  HN      4.88 #SUP  0.97  #QF  0.97
 43 HIS  HD2    44 PRO  HD2     5.00 #SUP  0.97  #QF  0.97
 43 HIS  HD2    44 PRO  HD3     5.15 #SUP  0.97  #QF  0.97
 45 LEU  HB3    46 ASP  HN      4.72 #SUP  0.98  #QF  0.98
 17 ARG  HB2    47 HIS  HB3     5.14 #SUP  0.82  #QF  0.82
 38 CYSS HB2    39 ILE  HB      4.75 #SUP  0.98  #QF  0.98
 38 CYSS HB2    39 ILE  QG2     5.50 #SUP  0.99  #QF  0.90
 38 CYSS HB2    39 ILE  QD1     5.50 #SUP  0.99  #QF  0.90
 39 ILE  HA     42 ARG  HD2     5.19 #SUP  0.97  #QF  0.97
 39 ILE  HA     42 ARG  HD3     4.81 #SUP  0.97  #QF  0.97
 31 GLU  HG3    32 ARG  HN      4.77 #SUP  0.97  #QF  0.97
  9 LYS  HA     10 ILE  QG2     5.50 #SUP  1.00  #QF  0.91
  9 LYS  HA     10 ILE  QD1     5.50 #SUP  1.00  #QF  0.91
  9 LYS  QB     10 ILE  HN      5.31 #SUP  0.99  #QF  0.99
  9 LYS  QB     12 THR  HN      5.50 #SUP  0.99  #QF  0.99
 11 PHE  HB2    12 THR  QG2     4.98 #SUP  0.80  #QF  0.73
 11 PHE  HB3    12 THR  QG2     4.98 #SUP  0.78  #QF  0.78
 12 THR  QG2    25 MET  HG2     4.73 #SUP  0.93  #QF  0.93
 13 ASN  HB2    27 LYS  HA      4.95 #SUP  0.93  #QF  0.93
 15 CYSS HA     16 GLU  HG2     4.88 #SUP  1.00
 15 CYSS HA     37 PHE  HB2     5.34 #SUP  0.96  #QF  0.96
 15 CYSS HA     37 PHE  HB3     4.91 #SUP  0.99  #QF  0.99
 15 CYSS HB3    37 PHE  HA      4.93 #SUP  0.98  #QF  0.98
 14 LYS  QE     16 GLU  HA      4.82 #SUP  0.54  #QF  0.54
 14 LYS  QD     16 GLU  HA      5.50 #SUP  0.79  #QF  0.79
 16 GLU  HG2    35 ARG  HB3     4.92 #SUP  1.00
 17 ARG  HB3    37 PHE  HE2     5.50 #SUP  0.88  #QF  0.88
 17 ARG  HB2    37 PHE  HE2     4.97 #SUP  0.86  #QF  0.86
 17 ARG  HD2    18 ALA  QB      5.50 #SUP  0.64  #QF  0.29
 17 ARG  HD3    18 ALA  QB      5.50 #SUP  0.64  #QF  0.29
 18 ALA  QB     19 GLY  HA2     4.77 #SUP  0.91  #QF  0.91
 20 CYSS HB3    21 ARG  HN      5.50 #SUP  1.00  #QF  0.99
 15 CYSS HN     22 GLN  HB2     5.50 #SUP  0.99  #QF  0.70
 22 GLN  HB2    23 ARG  HN      5.50 #SUP  0.99  #QF  0.70
 22 GLN  HG2    40 LYS  QD      5.10 #SUP  0.95  #QF  0.95
 22 GLN  HG3    40 LYS  QD      5.10 #SUP  0.97  #QF  0.97
 23 ARG  HN     23 ARG  HG3     4.71 #SUP  0.96  #QF  0.96
 13 ASN  HD21   25 MET  HA      5.15 #SUP  0.88  #QF  0.88
 24 GLU  HB2    27 LYS  HA      5.25 #SUP  0.80  #QF  0.65
 26 MET  HB2    27 LYS  HA      5.50 #SUP  0.80  #QF  0.65
 27 LYS  HA     28 LEU  HB2     4.75 #SUP  0.95  #QF  0.95
 26 MET  HA     27 LYS  HB2     5.50 #SUP  0.94  #QF  0.94
 26 MET  HA     27 LYS  HB3     5.50 #SUP  0.78  #QF  0.78
 27 LYS  HN     27 LYS  QD      5.06 #SUP  0.99  #QF  0.99
 28 LEU  HB3    42 ARG  HB2     4.78 #SUP  0.98  #QF  0.98
 28 LEU  HB3    42 ARG  HD3     4.77 #SUP  0.98  #QF  0.98
 28 LEU  HB2    42 ARG  HB3     5.49 #SUP  0.87  #QF  0.87
 28 LEU  HN     28 LEU  QD2     4.80 #SUP  0.87  #QF  0.87
 29 THR  QG2    35 ARG  HA      4.80 #SUP  0.92  #QF  0.92
 29 THR  QG2    30 CYSS HA      5.00 #SUP  0.98  #QF  0.98
 30 CYSS HA     35 ARG  HN      5.50 #SUP  1.00  #QF  0.91
 29 THR  QG2    30 CYSS HB3     4.92 #SUP  0.98  #QF  0.98
 30 CYSS HB3    35 ARG  HB2     4.91 #SUP  0.94  #QF  0.94
 30 CYSS HB3    34 SER  HA      4.86 #SUP  0.90  #QF  0.90
 32 ARG  HG3    33 CYSS HN      4.93 #SUP  0.99  #QF  0.99
 32 ARG  HG2    33 CYSS HN      4.93 #SUP  1.00
 32 ARG  HN     32 ARG  HD3     5.33 #SUP  1.00
 33 CYSS HB2    35 ARG  HB2     4.95 #SUP  0.77  #QF  0.77
 32 ARG  HB2    33 CYSS HB3     5.37 #SUP  0.93  #QF  0.78
 33 CYSS HB3    35 ARG  HB2     5.50 #SUP  0.93  #QF  0.78
 34 SER  HB3    35 ARG  HN      5.24 #SUP  0.96  #QF  0.96
 34 SER  HB2    35 ARG  HN      5.24 #SUP  0.96  #QF  0.96
 35 ARG  HG3    36 ASN  HN      5.05 #SUP  0.98  #QF  0.98
 16 GLU  HG2    36 ASN  HB2     4.94 #SUP  0.89  #QF  0.89
 16 GLU  HG2    36 ASN  HB3     4.94 #SUP  0.83  #QF  0.83
 16 GLU  HB2    37 PHE  HA      5.14 #SUP  0.99  #QF  0.99
 16 GLU  HG3    37 PHE  HA      4.93 #SUP  0.99  #QF  0.99
 37 PHE  HA     42 ARG  HA      5.37 #SUP  0.99  #QF  0.99
 36 ASN  HA     37 PHE  HA      5.50 #SUP  0.91  #QF  0.58
 37 PHE  HA     38 CYSS HA      5.50 #SUP  0.91  #QF  0.58
 37 PHE  HB3    41 HIST HN      4.80 #SUP  1.00
 37 PHE  HB2    42 ARG  HB3     5.05 #SUP  0.96  #QF  0.96
 30 CYSS HB2    37 PHE  HB2     5.50 #SUP  0.97  #QF  0.49
 37 PHE  HB2    42 ARG  HD2     5.50 #SUP  0.97  #QF  0.49
 38 CYSS HA     39 ILE  HG13    5.23 #SUP  0.91  #QF  0.91
 38 CYSS HB2    39 ILE  HG13    5.50 #SUP  0.98  #QF  0.95
 38 CYSS HB2    40 LYS  QD      5.50 #SUP  0.98  #QF  0.95
 38 CYSS HA     39 ILE  HA      4.95 #SUP  0.97  #QF  0.97
 39 ILE  HB     40 LYS  HA      5.06 #SUP  1.00
 39 ILE  HG12   40 LYS  HN      5.27 #SUP  0.99  #QF  0.99
 40 LYS  HA     42 ARG  HB3     5.50 #SUP  0.99  #QF  0.92
 37 PHE  HB2    41 HIST HB3     4.92 #SUP  0.97  #QF  0.97
 37 PHE  HB2    41 HIST HB2     5.02 #SUP  0.97  #QF  0.97
 28 LEU  QD1    42 ARG  HA      5.05 #SUP  1.00  #QF  0.99
 28 LEU  QD2    42 ARG  HA      5.50 #SUP  1.00  #QF  0.99
 37 PHE  HB3    42 ARG  HB2     5.02 #SUP  0.98  #QF  0.98
 37 PHE  HB3    42 ARG  HB3     5.50 #SUP  0.97  #QF  0.97
 42 ARG  HD2    43 HIS  HA      5.15 #SUP  0.95  #QF  0.95
 42 ARG  HN     42 ARG  HD2     5.09 #SUP  1.00
 29 THR  HA     36 ASN  HA      5.00 #SUP  0.80  #QF  0.80
 17 ARG  HB2    47 HIS  HB2     4.62 #SUP  0.67  #QF  0.67
 17 ARG  HD2    47 HIS  HB3     5.50 #SUP  0.84  #QF  0.52
 17 ARG  HD3    47 HIS  HB3     5.50 #SUP  0.84  #QF  0.52
  8 ARG  HA      8 ARG  QG      3.70 
  8 ARG  HA      8 ARG  QD      4.41 
  8 ARG  QB      8 ARG  QD      3.30 
  9 LYS  HA      9 LYS  QG      3.44 
  9 LYS  HA      9 LYS  QD      4.78 
  9 LYS  HA     10 ILE  QG1     4.62 
  9 LYS  QB     11 PHE  QB      3.87 
  9 LYS  QG      9 LYS  QE      3.40 
 10 ILE  HA     10 ILE  QG1     3.38 
 10 ILE  QG2    10 ILE  QG1     2.92 
 11 PHE  HN     11 PHE  QB      3.62 
 12 THR  QG2    25 MET  QB      4.23 
 12 THR  QG2    25 MET  QG      4.03 
 13 ASN  HN     13 ASN  QD2     4.24 
 13 ASN  QB     13 ASN  QD2     3.07 
 13 ASN  QB     14 LYS  HN      3.74 
 13 ASN  QB     24 GLU  HB2     4.76 
 13 ASN  QB     27 LYS  HA      4.24 
 13 ASN  QB     36 ASN  HD21    4.04 
 13 ASN  QB     36 ASN  HD22    3.07 
 13 ASN  QD2    24 GLU  HB2     4.77 
 13 ASN  QD2    25 MET  HA      4.54 
 13 ASN  QD2    26 MET  HN      4.37 
 13 ASN  QD2    26 MET  HA      4.02 
 13 ASN  QD2    27 LYS  HN      4.49 
 13 ASN  QD2    27 LYS  HA      4.78 
 13 ASN  QD2    27 LYS  QD      4.96 
 14 LYS  HN     14 LYS  QG      4.49 
 14 LYS  HA     14 LYS  QG      3.53 
 14 LYS  HA     23 ARG  QG      3.62 
 14 LYS  HA     23 ARG  QD      5.34 
 14 LYS  QG     15 CYSS HN      4.04 
 15 CYSS HN     23 ARG  QG      5.24 
 17 ARG  HA     17 ARG  QG      3.69 
 17 ARG  HA     17 ARG  QD      3.75 
 17 ARG  QG     18 ALA  HN      4.40 
 17 ARG  QG     20 CYSS HB2     5.00 
 17 ARG  QG     20 CYSS HB3     4.84 
 17 ARG  QG     41 HIST HB3     4.59 
 17 ARG  QG     41 HIST HD2     4.48 
 17 ARG  QG     47 HIS  HB2     4.64 
 17 ARG  QD     18 ALA  HN      4.34 
 17 ARG  QD     41 HIST HD2     4.93 
 17 ARG  QD     47 HIS  HB2     4.61 
 18 ALA  QB     19 GLY  QA      4.19 
 20 CYSS HA     21 ARG  QB      5.34 
 20 CYSS HA     21 ARG  QG      5.34 
 21 ARG  HA     21 ARG  QG      3.41 
 21 ARG  QB     21 ARG  QD      3.14 
 21 ARG  QB     22 GLN  HN      4.41 
 21 ARG  QG     22 GLN  HN      4.79 
 22 GLN  HN     22 GLN  QG      3.51 
 22 GLN  HA     22 GLN  QG      3.54 
 22 GLN  HA     23 ARG  QG      5.16 
 22 GLN  QG     23 ARG  HN      4.14 
 22 GLN  QG     38 CYSS HB2     4.00 
 22 GLN  QG     38 CYSS HB3     4.15 
 22 GLN  QG     40 LYS  HB3     5.20 
 22 GLN  QG     40 LYS  QD      4.49 
 23 ARG  HN     23 ARG  QG      3.94 
 23 ARG  HN     23 ARG  QD      5.00 
 23 ARG  QB     23 ARG  QD      3.14 
 24 GLU  HN     24 GLU  QG      4.41 
 24 GLU  QG     26 MET  HN      4.76 
 24 GLU  QG     38 CYSS HB2     3.88 
 24 GLU  QG     38 CYSS HB3     3.96 
 24 GLU  QG     39 ILE  HN      3.53 
 25 MET  HN     25 MET  QB      3.67 
 25 MET  HN     25 MET  QG      4.53 
 25 MET  HA     25 MET  QG      3.50 
 26 MET  HN     26 MET  QG      3.15 
 26 MET  HA     27 LYS  QB      4.70 
 26 MET  QG     28 LEU  HN      4.90 
 26 MET  QG     28 LEU  HG      3.72 
 26 MET  QG     28 LEU  QD2     3.32 
 27 LYS  HN     27 LYS  QB      3.24 
 27 LYS  HN     27 LYS  QG      3.96 
 27 LYS  QB     27 LYS  QE      3.72 
 27 LYS  QB     28 LEU  HN      3.96 
 27 LYS  QG     28 LEU  HN      3.72 
 28 LEU  HB3    42 ARG  QG      4.49 
 28 LEU  QD2    42 ARG  QG      3.76 
 29 THR  QG2    36 ASN  QB      4.38 
 31 GLU  HN     31 GLU  QB      3.27 
 31 GLU  HN     31 GLU  QG      3.82 
 31 GLU  HA     31 GLU  QG      3.50 
 31 GLU  QG     32 ARG  HN      3.90 
 31 GLU  QG     32 ARG  QG      3.58 
 31 GLU  QG     32 ARG  QD      4.89 
 32 ARG  HN     32 ARG  QG      3.21 
 32 ARG  HN     32 ARG  QD      4.55 
 32 ARG  HA     32 ARG  QD      4.21 
 32 ARG  HB2    32 ARG  QD      3.32 
 32 ARG  HB3    32 ARG  QD      3.53 
 32 ARG  QG     51 GLY  QA      5.04 
 32 ARG  QD     44 PRO  QB      3.94 
 32 ARG  QD     44 PRO  QG      3.63 
 35 ARG  HA     36 ASN  QB      4.23 
 36 ASN  HN     36 ASN  QB      3.04 
 36 ASN  QB     36 ASN  HD21    2.95 
 36 ASN  QB     37 PHE  HN      3.76 
 39 ILE  HA     42 ARG  QG      4.07 
 40 LYS  HN     40 LYS  QG      3.57 
 40 LYS  QG     40 LYS  QE      3.57 
 40 LYS  QG     41 HIST HN      4.96 
 40 LYS  QG     41 HIST HD2     5.34 
 42 ARG  HN     42 ARG  QG      3.88 
 42 ARG  HA     42 ARG  QG      3.74 
 42 ARG  QG     43 HIS  HN      3.75 
 42 ARG  QG     43 HIS  HA      4.92 
 43 HIS  QB     44 PRO  QG      5.35 
 43 HIS  HE1    44 PRO  QG      4.90 
 43 HIS  HE1    45 LEU  QB      4.13 
 44 PRO  QB     45 LEU  HN      3.90 
 44 PRO  QB     45 LEU  QD2     4.34 
 44 PRO  QB     49 CYSS QB      3.03 
 44 PRO  QG     45 LEU  HN      4.64 
 44 PRO  QG     47 HIS  HE1     4.99 
 45 LEU  HN     45 LEU  QB      3.30 
 45 LEU  QB     45 LEU  QD1     2.73 
 45 LEU  QB     45 LEU  QD2     2.97 
 45 LEU  QB     46 ASP  HN      4.09 
 50 SER  HN     50 SER  QB      3.71 
 52 GLU  HN     52 GLU  QB      3.23 
 52 GLU  HA     53 GLY  QA      5.14 
 52 GLU  QB     53 GLY  HN      4.17 
 52 GLU  QG     53 GLY  QA      5.34 
 54 HIS  HA     55 PRO  QD      3.26 
 54 HIS  QB     55 PRO  QD      3.47 
 59 GLY  QA     60 PRO  QD      3.12 


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           H        GLY   1  -5.214 -31.797  -3.226
    2    HA2  GLY   1           1HA      GLY   1  -6.411 -31.560  -0.781
    3    HA3  GLY   1           2HA      GLY   1  -4.703 -31.719  -0.399
    4    H    SER   2           H        SER   2  -6.851 -29.476  -0.376
    5    HA   SER   2           HA       SER   2  -6.057 -27.468  -2.159
    6    HB2  SER   2           1HB      SER   2  -7.237 -27.195   0.616
    7    HB3  SER   2           2HB      SER   2  -7.149 -25.902  -0.581
    8    HG   SER   2           HG       SER   2  -8.277 -27.829  -1.856
    9    H    SER   3           H        SER   3  -4.176 -26.467  -2.335
   10    HA   SER   3           HA       SER   3  -2.631 -25.912   0.106
   11    HB2  SER   3           1HB      SER   3  -1.733 -27.866  -1.287
   12    HB3  SER   3           2HB      SER   3  -1.319 -26.660  -2.505
   13    HG   SER   3           HG       SER   3  -0.145 -27.191  -0.067
   14    H    GLY   4           H        GLY   4  -2.533 -23.782   0.341
   15    HA2  GLY   4           1HA      GLY   4  -1.920 -21.604  -0.177
   16    HA3  GLY   4           2HA      GLY   4  -1.573 -22.123  -1.819
   17    H    SER   5           H        SER   5  -3.075 -19.784  -0.725
   18    HA   SER   5           HA       SER   5  -5.572 -20.231  -2.223
   19    HB2  SER   5           1HB      SER   5  -6.703 -18.670  -0.680
   20    HB3  SER   5           2HB      SER   5  -6.079 -20.084   0.168
   21    HG   SER   5           HG       SER   5  -5.420 -17.450   0.448
   22    H    SER   6           H        SER   6  -5.334 -19.172  -4.081
   23    HA   SER   6           HA       SER   6  -3.705 -16.811  -4.302
   24    HB2  SER   6           1HB      SER   6  -5.512 -18.161  -6.322
   25    HB3  SER   6           2HB      SER   6  -4.389 -16.850  -6.683
   26    HG   SER   6           HG       SER   6  -3.903 -19.528  -6.248
   27    H    GLY   7           H        GLY   7  -4.410 -14.729  -4.922
   28    HA2  GLY   7           1HA      GLY   7  -7.278 -14.175  -4.771
   29    HA3  GLY   7           2HA      GLY   7  -6.250 -13.414  -3.566
   30    H    ARG   8           H        ARG   8  -7.688 -13.008  -6.521
   31    HA   ARG   8           HA       ARG   8  -6.184 -10.583  -7.011
   32    HB2  ARG   8           1HB      ARG   8  -4.930 -12.342  -8.249
   33    HB3  ARG   8           2HB      ARG   8  -6.388 -12.689  -9.169
   34    HG2  ARG   8           1HG      ARG   8  -6.330 -10.603 -10.251
   35    HG3  ARG   8           2HG      ARG   8  -5.145  -9.959  -9.112
   36    HD2  ARG   8           1HD      ARG   8  -3.975 -10.445 -11.119
   37    HD3  ARG   8           2HD      ARG   8  -3.542 -11.700  -9.958
   38    HE   ARG   8           HE       ARG   8  -5.744 -12.395 -11.678
   39   HH11  ARG   8          2HH1      ARG   8  -2.285 -12.391 -11.290
   40   HH12  ARG   8          1HH1      ARG   8  -2.028 -13.696 -12.401
   41   HH21  ARG   8          2HH2      ARG   8  -5.419 -14.113 -13.142
   42   HH22  ARG   8          1HH2      ARG   8  -3.812 -14.674 -13.454
   43    H    LYS   9           H        LYS   9  -7.743  -9.122  -7.176
   44    HA   LYS   9           HA       LYS   9  -9.966  -9.620  -9.010
   45    HB2  LYS   9           1HB      LYS   9 -10.205  -8.940  -6.094
   46    HB3  LYS   9           2HB      LYS   9 -11.451  -8.444  -7.232
   47    HG2  LYS   9           1HG      LYS   9 -10.540 -11.288  -6.865
   48    HG3  LYS   9           2HG      LYS   9 -11.931 -10.573  -6.046
   49    HD2  LYS   9           1HD      LYS   9 -12.776  -9.975  -8.381
   50    HD3  LYS   9           2HD      LYS   9 -11.543 -11.086  -8.984
   51    HE2  LYS   9           1HE      LYS   9 -13.558 -11.897  -6.907
   52    HE3  LYS   9           2HE      LYS   9 -13.891 -12.019  -8.634
   53    HZ1  LYS   9           1HZ      LYS   9 -12.123 -13.613  -6.969
   54    HZ2  LYS   9           2HZ      LYS   9 -11.535 -13.233  -8.509
   55    HZ3  LYS   9           3HZ      LYS   9 -13.006 -14.053  -8.344
   56    H    ILE  10           H        ILE  10 -10.695  -7.821 -10.075
   57    HA   ILE  10           HA       ILE  10  -8.985  -5.501  -9.977
   58    HB   ILE  10           HB       ILE  10 -11.473  -5.764 -11.647
   59   HG12  ILE  10          1HG1      ILE  10 -10.015  -7.800 -11.865
   60   HG13  ILE  10          2HG1      ILE  10 -10.215  -6.885 -13.356
   61   HG21  ILE  10          1HG2      ILE  10 -10.613  -4.082 -12.940
   62   HG22  ILE  10          2HG2      ILE  10  -9.962  -3.630 -11.365
   63   HG23  ILE  10          3HG2      ILE  10  -8.943  -4.473 -12.532
   64   HD11  ILE  10          1HD1      ILE  10  -7.871  -6.267 -11.650
   65   HD12  ILE  10          2HD1      ILE  10  -7.865  -7.772 -12.569
   66   HD13  ILE  10          3HD1      ILE  10  -8.040  -6.230 -13.405
   67    H    PHE  11           H        PHE  11  -9.844  -5.265  -7.620
   68    HA   PHE  11           HA       PHE  11 -12.161  -3.445  -7.682
   69    HB2  PHE  11           1HB      PHE  11 -11.382  -5.578  -5.761
   70    HB3  PHE  11           2HB      PHE  11 -12.103  -4.117  -5.093
   71    HD1  PHE  11           2HD      PHE  11 -12.689  -6.518  -7.890
   72    HD2  PHE  11           1HD      PHE  11 -14.376  -4.100  -4.821
   73    HE1  PHE  11           2HE      PHE  11 -14.927  -7.373  -8.451
   74    HE2  PHE  11           1HE      PHE  11 -16.616  -4.952  -5.376
   75    HZ   PHE  11           HZ       PHE  11 -16.894  -6.589  -7.194
   76    H    THR  12           H        THR  12  -9.085  -4.145  -6.055
   77    HA   THR  12           HA       THR  12  -8.570  -1.282  -5.863
   78    HB   THR  12           HB       THR  12  -7.868  -1.468  -3.486
   79    HG1  THR  12           1HG      THR  12  -9.082  -3.437  -2.498
   80   HG21  THR  12          1HG2      THR  12 -10.762  -2.211  -3.922
   81   HG22  THR  12          2HG2      THR  12 -10.099  -0.590  -4.129
   82   HG23  THR  12          3HG2      THR  12 -10.088  -1.351  -2.538
   83    H    ASN  13           H        ASN  13  -6.309  -0.840  -5.153
   84    HA   ASN  13           HA       ASN  13  -4.526  -2.905  -6.239
   85    HB2  ASN  13           1HB      ASN  13  -3.897   0.018  -5.793
   86    HB3  ASN  13           2HB      ASN  13  -2.966  -1.143  -6.734
   87   HD21  ASN  13          1HD2      ASN  13  -5.564   1.068  -6.718
   88   HD22  ASN  13          2HD2      ASN  13  -6.052   0.859  -8.362
   89    H    LYS  14           H        LYS  14  -2.248  -2.821  -5.271
   90    HA   LYS  14           HA       LYS  14  -2.407  -2.493  -2.348
   91    HB2  LYS  14           1HB      LYS  14  -2.557  -4.853  -2.795
   92    HB3  LYS  14           2HB      LYS  14  -1.195  -4.781  -3.905
   93    HG2  LYS  14           1HG      LYS  14   0.138  -3.966  -1.848
   94    HG3  LYS  14           2HG      LYS  14  -1.205  -4.636  -0.920
   95    HD2  LYS  14           1HD      LYS  14   0.373  -6.374  -1.053
   96    HD3  LYS  14           2HD      LYS  14  -0.849  -6.775  -2.261
   97    HE2  LYS  14           1HE      LYS  14   0.573  -5.827  -4.011
   98    HE3  LYS  14           2HE      LYS  14   1.790  -5.416  -2.804
   99    HZ1  LYS  14           1HZ      LYS  14   1.584  -7.972  -2.297
  100    HZ2  LYS  14           2HZ      LYS  14   2.598  -7.398  -3.522
  101    HZ3  LYS  14           3HZ      LYS  14   1.077  -8.028  -3.910
  102    H    CYS  15           H        CYS  15  -0.964  -1.080  -1.639
  103    HA   CYS  15           HA       CYS  15   1.032   0.079  -3.223
  104    HB2  CYS  15           1HB      CYS  15   0.101   1.215  -1.276
  105    HB3  CYS  15           2HB      CYS  15   0.783  -0.009  -0.209
  106    H    GLU  16           H        GLU  16   3.218  -0.231  -3.403
  107    HA   GLU  16           HA       GLU  16   4.204  -2.823  -2.456
  108    HB2  GLU  16           1HB      GLU  16   5.302  -0.963  -4.572
  109    HB3  GLU  16           2HB      GLU  16   5.985  -2.525  -4.145
  110    HG2  GLU  16           1HG      GLU  16   3.526  -3.335  -4.693
  111    HG3  GLU  16           2HG      GLU  16   3.538  -1.877  -5.684
  112    H    ARG  17           H        ARG  17   4.010  -0.435  -0.749
  113    HA   ARG  17           HA       ARG  17   6.799   0.309  -0.321
  114    HB2  ARG  17           1HB      ARG  17   5.008   2.039  -0.264
  115    HB3  ARG  17           2HB      ARG  17   4.326   1.239   1.146
  116    HG2  ARG  17           1HG      ARG  17   5.555   2.913   2.117
  117    HG3  ARG  17           2HG      ARG  17   6.707   1.577   2.145
  118    HD2  ARG  17           1HD      ARG  17   6.660   3.391  -0.218
  119    HD3  ARG  17           2HD      ARG  17   7.404   3.961   1.276
  120    HE   ARG  17           HE       ARG  17   8.475   2.053  -0.549
  121   HH11  ARG  17          2HH1      ARG  17   8.337   2.928   2.818
  122   HH12  ARG  17          1HH1      ARG  17   9.854   2.187   3.207
  123   HH21  ARG  17          2HH2      ARG  17  10.473   1.073  -0.049
  124   HH22  ARG  17          1HH2      ARG  17  11.068   1.132   1.576
  125    H    ALA  18           H        ALA  18   7.903  -0.052   1.618
  126    HA   ALA  18           HA       ALA  18   7.462  -2.545   2.845
  127    HB1  ALA  18           1HB      ALA  18   9.525  -0.693   2.762
  128    HB2  ALA  18           2HB      ALA  18   9.070  -0.768   4.464
  129    HB3  ALA  18           3HB      ALA  18   9.529  -2.240   3.609
  130    H    GLY  19           H        GLY  19   6.445  -3.150   4.685
  131    HA2  GLY  19           1HA      GLY  19   4.922  -3.030   6.403
  132    HA3  GLY  19           2HA      GLY  19   5.856  -1.631   6.911
  133    H    CYS  20           H        CYS  20   3.881  -2.052   3.998
  134    HA   CYS  20           HA       CYS  20   2.018  -0.028   5.029
  135    HB2  CYS  20           1HB      CYS  20   3.810   0.869   3.396
  136    HB3  CYS  20           2HB      CYS  20   2.916  -0.007   2.158
  137    H    ARG  21           H        ARG  21  -0.088  -0.412   4.616
  138    HA   ARG  21           HA       ARG  21  -0.759  -2.530   2.689
  139    HB2  ARG  21           1HB      ARG  21  -2.341  -3.508   4.210
  140    HB3  ARG  21           2HB      ARG  21  -0.786  -3.405   5.026
  141    HG2  ARG  21           1HG      ARG  21  -1.760  -1.132   5.907
  142    HG3  ARG  21           2HG      ARG  21  -3.302  -1.907   5.538
  143    HD2  ARG  21           1HD      ARG  21  -2.991  -3.572   7.109
  144    HD3  ARG  21           2HD      ARG  21  -1.237  -3.393   7.101
  145    HE   ARG  21           HE       ARG  21  -3.113  -1.963   8.730
  146   HH11  ARG  21          2HH1      ARG  21   0.033  -1.846   7.243
  147   HH12  ARG  21          1HH1      ARG  21   0.673  -0.708   8.382
  148   HH21  ARG  21          2HH2      ARG  21  -2.281  -0.465  10.237
  149   HH22  ARG  21          1HH2      ARG  21  -0.643   0.076  10.085
  150    H    GLN  22           H        GLN  22  -0.863   0.240   2.213
  151    HA   GLN  22           HA       GLN  22  -3.583   1.134   2.576
  152    HB2  GLN  22           1HB      GLN  22  -1.134   2.283   1.282
  153    HB3  GLN  22           2HB      GLN  22  -2.711   3.001   0.981
  154    HG2  GLN  22           1HG      GLN  22  -1.221   3.935   2.874
  155    HG3  GLN  22           2HG      GLN  22  -2.949   3.724   3.151
  156   HE21  GLN  22          1HE2      GLN  22  -3.637   1.851   4.335
  157   HE22  GLN  22          2HE2      GLN  22  -2.584   1.132   5.500
  158    H    ARG  23           H        ARG  23  -5.225   0.918   1.190
  159    HA   ARG  23           HA       ARG  23  -4.636  -0.217  -1.463
  160    HB2  ARG  23           1HB      ARG  23  -7.152  -0.498   0.192
  161    HB3  ARG  23           2HB      ARG  23  -6.876  -1.217  -1.389
  162    HG2  ARG  23           1HG      ARG  23  -5.271  -2.711  -0.550
  163    HG3  ARG  23           2HG      ARG  23  -5.110  -1.813   0.961
  164    HD2  ARG  23           1HD      ARG  23  -7.501  -3.403   0.043
  165    HD3  ARG  23           2HD      ARG  23  -6.391  -3.822   1.347
  166    HE   ARG  23           HE       ARG  23  -8.588  -1.981   1.470
  167   HH11  ARG  23          2HH1      ARG  23  -5.501  -2.833   2.835
  168   HH12  ARG  23          1HH1      ARG  23  -5.824  -2.085   4.364
  169   HH21  ARG  23          2HH2      ARG  23  -9.025  -0.992   3.478
  170   HH22  ARG  23          1HH2      ARG  23  -7.829  -1.039   4.729
  171    H    GLU  24           H        GLU  24  -4.610   1.479  -2.827
  172    HA   GLU  24           HA       GLU  24  -6.547   3.625  -2.559
  173    HB2  GLU  24           1HB      GLU  24  -4.072   3.169  -4.145
  174    HB3  GLU  24           2HB      GLU  24  -5.265   4.276  -4.809
  175    HG2  GLU  24           1HG      GLU  24  -4.268   4.553  -1.999
  176    HG3  GLU  24           2HG      GLU  24  -3.395   5.243  -3.366
  177    H    MET  25           H        MET  25  -8.485   3.523  -3.461
  178    HA   MET  25           HA       MET  25  -9.604   1.567  -4.926
  179    HB2  MET  25           1HB      MET  25 -10.095   4.536  -5.152
  180    HB3  MET  25           2HB      MET  25 -11.119   3.334  -5.926
  181    HG2  MET  25           1HG      MET  25 -11.691   2.390  -3.774
  182    HG3  MET  25           2HG      MET  25 -10.599   3.512  -2.968
  183    HE1  MET  25           1HE      MET  25 -14.423   4.520  -2.163
  184    HE2  MET  25           2HE      MET  25 -13.906   2.902  -2.638
  185    HE3  MET  25           3HE      MET  25 -12.962   3.821  -1.465
  186    H    MET  26           H        MET  26  -7.664   4.218  -6.228
  187    HA   MET  26           HA       MET  26  -7.827   3.002  -8.896
  188    HB2  MET  26           1HB      MET  26  -6.990   5.116  -9.754
  189    HB3  MET  26           2HB      MET  26  -8.395   5.395  -8.735
  190    HG2  MET  26           1HG      MET  26  -6.523   5.721  -6.890
  191    HG3  MET  26           2HG      MET  26  -5.560   6.131  -8.307
  192    HE1  MET  26           1HE      MET  26  -5.175   8.537  -7.158
  193    HE2  MET  26           2HE      MET  26  -5.267   8.506  -8.919
  194    HE3  MET  26           3HE      MET  26  -6.083   9.783  -8.016
  195    H    LYS  27           H        LYS  27  -5.881   2.764 -10.151
  196    HA   LYS  27           HA       LYS  27  -3.703   1.739  -8.570
  197    HB2  LYS  27           1HB      LYS  27  -4.346   0.501 -10.530
  198    HB3  LYS  27           2HB      LYS  27  -4.152   1.919 -11.552
  199    HG2  LYS  27           1HG      LYS  27  -1.794   1.867 -11.328
  200    HG3  LYS  27           2HG      LYS  27  -1.878   0.665 -10.039
  201    HD2  LYS  27           1HD      LYS  27  -2.907   0.127 -12.814
  202    HD3  LYS  27           2HD      LYS  27  -1.229  -0.171 -12.354
  203    HE2  LYS  27           1HE      LYS  27  -3.642  -1.361 -10.989
  204    HE3  LYS  27           2HE      LYS  27  -2.650  -2.187 -12.190
  205    HZ1  LYS  27           1HZ      LYS  27  -2.250  -2.240  -9.511
  206    HZ2  LYS  27           2HZ      LYS  27  -1.124  -1.085 -10.020
  207    HZ3  LYS  27           3HZ      LYS  27  -1.095  -2.643 -10.680
  208    H    LEU  28           H        LEU  28  -1.728   2.616  -8.252
  209    HA   LEU  28           HA       LEU  28  -1.072   5.112  -9.657
  210    HB2  LEU  28           1HB      LEU  28  -0.845   4.610  -6.695
  211    HB3  LEU  28           2HB      LEU  28  -0.153   5.999  -7.528
  212    HG   LEU  28           HG       LEU  28  -3.084   5.503  -7.757
  213   HD11  LEU  28          1HD1      LEU  28  -3.605   6.449  -5.694
  214   HD12  LEU  28          2HD1      LEU  28  -1.960   7.029  -5.435
  215   HD13  LEU  28          3HD1      LEU  28  -2.316   5.306  -5.315
  216   HD21  LEU  28          1HD2      LEU  28  -3.111   7.962  -7.810
  217   HD22  LEU  28          2HD2      LEU  28  -2.079   7.277  -9.066
  218   HD23  LEU  28          3HD2      LEU  28  -1.358   7.973  -7.613
  219    H    THR  29           H        THR  29   0.626   4.523 -10.856
  220    HA   THR  29           HA       THR  29   2.749   2.922  -9.589
  221    HB   THR  29           HB       THR  29   2.316   3.353 -12.549
  222    HG1  THR  29           1HG      THR  29   0.711   2.042 -11.160
  223   HG21  THR  29          1HG2      THR  29   4.338   2.437 -12.743
  224   HG22  THR  29          2HG2      THR  29   3.703   0.968 -12.002
  225   HG23  THR  29          3HG2      THR  29   4.446   2.213 -10.998
  226    H    CYS  30           H        CYS  30   4.781   3.704  -9.429
  227    HA   CYS  30           HA       CYS  30   5.253   6.461  -9.574
  228    HB2  CYS  30           1HB      CYS  30   6.505   4.683  -8.212
  229    HB3  CYS  30           2HB      CYS  30   7.432   4.383  -9.679
  230    H    GLU  31           H        GLU  31   7.090   7.450 -10.852
  231    HA   GLU  31           HA       GLU  31   6.787   6.665 -13.667
  232    HB2  GLU  31           1HB      GLU  31   7.343   8.933 -14.247
  233    HB3  GLU  31           2HB      GLU  31   6.085   8.963 -13.019
  234    HG2  GLU  31           1HG      GLU  31   7.864   9.349 -11.314
  235    HG3  GLU  31           2HG      GLU  31   9.015   9.515 -12.639
  236    H    ARG  32           H        ARG  32   9.008   6.720 -11.103
  237    HA   ARG  32           HA       ARG  32  11.326   6.670 -12.893
  238    HB2  ARG  32           1HB      ARG  32  11.028   6.956  -9.911
  239    HB3  ARG  32           2HB      ARG  32  12.582   6.597 -10.652
  240    HG2  ARG  32           1HG      ARG  32  12.518   8.657 -11.897
  241    HG3  ARG  32           2HG      ARG  32  10.891   8.999 -11.307
  242    HD2  ARG  32           1HD      ARG  32  12.185  10.287  -9.896
  243    HD3  ARG  32           2HD      ARG  32  11.993   8.806  -8.959
  244    HE   ARG  32           HE       ARG  32  14.348   8.841 -10.609
  245   HH11  ARG  32          2HH1      ARG  32  12.991   9.723  -7.526
  246   HH12  ARG  32          1HH1      ARG  32  14.520   9.744  -6.712
  247   HH21  ARG  32          2HH2      ARG  32  16.367   8.866  -9.548
  248   HH22  ARG  32          1HH2      ARG  32  16.440   9.258  -7.863
  249    H    CYS  33           H        CYS  33  10.060   4.798 -10.130
  250    HA   CYS  33           HA       CYS  33  11.635   2.495 -10.937
  251    HB2  CYS  33           1HB      CYS  33  10.638   1.455  -8.879
  252    HB3  CYS  33           2HB      CYS  33  11.561   2.924  -8.578
  253    H    SER  34           H        SER  34   8.405   3.677 -11.210
  254    HA   SER  34           HA       SER  34   6.570   2.887 -12.301
  255    HB2  SER  34           1HB      SER  34   8.350   0.663 -13.318
  256    HB3  SER  34           2HB      SER  34   6.842   1.234 -14.032
  257    HG   SER  34           HG       SER  34   9.312   2.114 -14.471
  258    H    ARG  35           H        ARG  35   6.693   2.264  -9.683
  259    HA   ARG  35           HA       ARG  35   5.644  -0.488  -9.589
  260    HB2  ARG  35           1HB      ARG  35   7.360   0.983  -7.600
  261    HB3  ARG  35           2HB      ARG  35   6.381  -0.399  -7.130
  262    HG2  ARG  35           1HG      ARG  35   7.575  -1.635  -9.039
  263    HG3  ARG  35           2HG      ARG  35   8.733  -0.304  -8.976
  264    HD2  ARG  35           1HD      ARG  35   9.194  -0.771  -6.648
  265    HD3  ARG  35           2HD      ARG  35   7.959  -2.028  -6.627
  266    HE   ARG  35           HE       ARG  35  10.020  -2.453  -8.588
  267   HH11  ARG  35          2HH1      ARG  35   9.070  -2.934  -5.273
  268   HH12  ARG  35          1HH1      ARG  35  10.110  -4.299  -5.037
  269   HH21  ARG  35          2HH2      ARG  35  11.393  -4.250  -8.289
  270   HH22  ARG  35          1HH2      ARG  35  11.432  -5.046  -6.752
  271    H    ASN  36           H        ASN  36   3.908  -0.871  -8.131
  272    HA   ASN  36           HA       ASN  36   2.035   1.274  -8.009
  273    HB2  ASN  36           1HB      ASN  36   1.497  -1.194  -8.308
  274    HB3  ASN  36           2HB      ASN  36   1.802  -1.376  -6.583
  275   HD21  ASN  36          1HD2      ASN  36   0.614   0.402  -5.261
  276   HD22  ASN  36          2HD2      ASN  36  -1.057   0.595  -5.652
  277    H    PHE  37           H        PHE  37   1.262   2.404  -6.254
  278    HA   PHE  37           HA       PHE  37   2.186   1.868  -3.586
  279    HB2  PHE  37           1HB      PHE  37   3.114   4.393  -4.971
  280    HB3  PHE  37           2HB      PHE  37   3.343   4.013  -3.267
  281    HD1  PHE  37           2HD      PHE  37   4.557   1.706  -2.825
  282    HD2  PHE  37           1HD      PHE  37   4.836   3.965  -6.422
  283    HE1  PHE  37           2HE      PHE  37   6.681   0.585  -3.361
  284    HE2  PHE  37           1HE      PHE  37   6.960   2.846  -6.964
  285    HZ   PHE  37           HZ       PHE  37   7.886   1.155  -5.432
  286    H    CYS  38           H        CYS  38   1.469   3.752  -2.093
  287    HA   CYS  38           HA       CYS  38  -1.276   4.417  -2.863
  288    HB2  CYS  38           1HB      CYS  38  -1.677   4.782  -0.492
  289    HB3  CYS  38           2HB      CYS  38  -0.909   3.215  -0.731
  290    H    ILE  39           H        ILE  39  -2.120   6.508  -2.660
  291    HA   ILE  39           HA       ILE  39  -0.840   8.614  -3.686
  292    HB   ILE  39           HB       ILE  39  -2.888   8.646  -1.479
  293   HG12  ILE  39          1HG1      ILE  39  -3.096   9.338  -4.416
  294   HG13  ILE  39          2HG1      ILE  39  -3.516   7.771  -3.734
  295   HG21  ILE  39          1HG2      ILE  39  -3.210  11.015  -1.877
  296   HG22  ILE  39          2HG2      ILE  39  -1.551  10.706  -1.365
  297   HG23  ILE  39          3HG2      ILE  39  -1.907  11.015  -3.065
  298   HD11  ILE  39          1HD1      ILE  39  -5.444   9.287  -4.158
  299   HD12  ILE  39          2HD1      ILE  39  -5.313   8.713  -2.494
  300   HD13  ILE  39          3HD1      ILE  39  -4.810  10.353  -2.905
  301    H    LYS  40           H        LYS  40  -0.658   7.643  -0.297
  302    HA   LYS  40           HA       LYS  40   0.828   9.858   0.623
  303    HB2  LYS  40           1HB      LYS  40   0.224   7.125   1.630
  304    HB3  LYS  40           2HB      LYS  40   1.584   7.970   2.358
  305    HG2  LYS  40           1HG      LYS  40  -0.147   8.564   3.747
  306    HG3  LYS  40           2HG      LYS  40  -0.106   9.924   2.622
  307    HD2  LYS  40           1HD      LYS  40  -2.391   9.261   2.918
  308    HD3  LYS  40           2HD      LYS  40  -1.885   8.789   1.294
  309    HE2  LYS  40           1HE      LYS  40  -1.765   6.526   1.864
  310    HE3  LYS  40           2HE      LYS  40  -1.716   6.870   3.593
  311    HZ1  LYS  40           1HZ      LYS  40  -4.020   7.621   3.455
  312    HZ2  LYS  40           2HZ      LYS  40  -3.867   6.012   2.956
  313    HZ3  LYS  40           3HZ      LYS  40  -4.061   7.239   1.807
  314    H    HIS  41           H        HIS  41   1.816   6.666  -0.565
  315    HA   HIS  41           HA       HIS  41   4.612   7.562  -0.546
  316    HB2  HIS  41           1HB      HIS  41   3.474   4.779  -0.885
  317    HB3  HIS  41           2HB      HIS  41   5.187   5.183  -0.828
  318    HD2  HIS  41           2HD      HIS  41   5.118   7.101   1.846
  319    HE1  HIS  41           1HE      HIS  41   3.459   3.674   3.717
  320    HE2  HIS  41           2HE      HIS  41   4.515   5.932   4.073
  321    H    ARG  42           H        ARG  42   2.287   8.032  -2.552
  322    HA   ARG  42           HA       ARG  42   3.051   6.760  -4.968
  323    HB2  ARG  42           1HB      ARG  42   0.887   7.542  -5.078
  324    HB3  ARG  42           2HB      ARG  42   1.270   9.032  -4.224
  325    HG2  ARG  42           1HG      ARG  42   0.741   9.595  -6.470
  326    HG3  ARG  42           2HG      ARG  42   2.481   9.800  -6.265
  327    HD2  ARG  42           1HD      ARG  42   2.524   7.304  -7.115
  328    HD3  ARG  42           2HD      ARG  42   0.971   7.757  -7.816
  329    HE   ARG  42           HE       ARG  42   3.544   8.525  -8.743
  330   HH11  ARG  42          2HH1      ARG  42   0.268   9.653  -8.406
  331   HH12  ARG  42          1HH1      ARG  42   0.372  10.754  -9.740
  332   HH21  ARG  42          2HH2      ARG  42   3.694   9.970 -10.501
  333   HH22  ARG  42          1HH2      ARG  42   2.321  10.933 -10.931
  334    H    HIS  43           H        HIS  43   3.975   9.765  -3.408
  335    HA   HIS  43           HA       HIS  43   5.451  10.743  -5.674
  336    HB2  HIS  43           1HB      HIS  43   4.364  12.009  -3.587
  337    HB3  HIS  43           2HB      HIS  43   5.988  11.791  -2.941
  338    HD1  HIS  43           1HD      HIS  43   7.882  13.153  -4.014
  339    HD2  HIS  43           2HD      HIS  43   4.167  13.781  -5.765
  340    HE1  HIS  43           1HE      HIS  43   8.166  15.171  -5.488
  341    HA   PRO  44           HA       PRO  44   9.204   8.543  -4.988
  342    HB2  PRO  44           1HB      PRO  44  10.904  10.201  -6.304
  343    HB3  PRO  44           2HB      PRO  44   9.764   9.136  -7.136
  344    HG2  PRO  44           1HG      PRO  44   9.530  12.059  -6.530
  345    HG3  PRO  44           2HG      PRO  44   9.121  11.189  -8.020
  346    HD2  PRO  44           1HD      PRO  44   7.252  11.934  -6.208
  347    HD3  PRO  44           2HD      PRO  44   7.097  10.463  -7.189
  348    H    LEU  45           H        LEU  45   8.376  11.317  -3.434
  349    HA   LEU  45           HA       LEU  45  11.006  11.687  -2.181
  350    HB2  LEU  45           1HB      LEU  45   8.532  13.394  -2.253
  351    HB3  LEU  45           2HB      LEU  45   9.879  13.719  -1.164
  352    HG   LEU  45           HG       LEU  45  10.090  13.663  -4.173
  353   HD11  LEU  45          1HD1      LEU  45  10.083  16.043  -4.128
  354   HD12  LEU  45          2HD1      LEU  45  10.041  16.070  -2.366
  355   HD13  LEU  45          3HD1      LEU  45   8.643  15.493  -3.272
  356   HD21  LEU  45          1HD2      LEU  45  12.215  14.978  -3.541
  357   HD22  LEU  45          2HD2      LEU  45  12.220  13.224  -3.353
  358   HD23  LEU  45          3HD2      LEU  45  11.999  14.263  -1.944
  359    H    ASP  46           H        ASP  46   7.810  10.515  -1.625
  360    HA   ASP  46           HA       ASP  46   8.347  10.273   1.257
  361    HB2  ASP  46           1HB      ASP  46   5.802  10.307  -0.346
  362    HB3  ASP  46           2HB      ASP  46   5.837   9.647   1.287
  363    H    HIS  47           H        HIS  47   9.342   8.566  -1.033
  364    HA   HIS  47           HA       HIS  47   8.935   6.038   0.274
  365    HB2  HIS  47           1HB      HIS  47   7.743   4.887  -1.331
  366    HB3  HIS  47           2HB      HIS  47   6.991   6.476  -1.452
  367    HD1  HIS  47           1HD      HIS  47   6.671   7.157  -3.794
  368    HD2  HIS  47           2HD      HIS  47  10.068   4.810  -3.335
  369    HE1  HIS  47           1HE      HIS  47   7.652   6.938  -6.098
  370    H    ASP  48           H        ASP  48  10.666   4.738   0.016
  371    HA   ASP  48           HA       ASP  48  13.030   5.720  -1.105
  372    HB2  ASP  48           1HB      ASP  48  12.634   3.837   0.655
  373    HB3  ASP  48           2HB      ASP  48  12.570   2.776  -0.750
  374    H    CYS  49           H        CYS  49  12.572   6.362  -3.241
  375    HA   CYS  49           HA       CYS  49  11.620   4.517  -5.203
  376    HB2  CYS  49           1HB      CYS  49  11.403   7.044  -5.289
  377    HB3  CYS  49           2HB      CYS  49  13.108   7.090  -5.727
  378    H    SER  50           H        SER  50  12.742   2.924  -6.085
  379    HA   SER  50           HA       SER  50  15.667   3.219  -6.311
  380    HB2  SER  50           1HB      SER  50  14.056   0.700  -5.835
  381    HB3  SER  50           2HB      SER  50  15.796   0.743  -6.116
  382    HG   SER  50           HG       SER  50  14.374   1.895  -3.949
  383    H    GLY  51           H        GLY  51  13.940   4.154  -8.301
  384    HA2  GLY  51           1HA      GLY  51  13.900   2.106 -10.385
  385    HA3  GLY  51           2HA      GLY  51  13.181   3.706 -10.487
  386    H    GLU  52           H        GLU  52  14.331   5.368 -11.355
  387    HA   GLU  52           HA       GLU  52  16.756   4.647 -12.762
  388    HB2  GLU  52           1HB      GLU  52  15.111   7.182 -12.737
  389    HB3  GLU  52           2HB      GLU  52  16.546   6.950 -13.726
  390    HG2  GLU  52           1HG      GLU  52  15.511   5.459 -15.128
  391    HG3  GLU  52           2HG      GLU  52  14.322   4.980 -13.918
  392    H    GLY  53           H        GLY  53  18.095   4.370 -10.860
  393    HA2  GLY  53           1HA      GLY  53  19.445   6.845 -10.173
  394    HA3  GLY  53           2HA      GLY  53  18.676   6.022  -8.824
  395    H    HIS  54           H        HIS  54  19.188   3.355  -9.818
  396    HA   HIS  54           HA       HIS  54  21.948   3.136  -8.939
  397    HB2  HIS  54           1HB      HIS  54  21.485   0.709  -8.856
  398    HB3  HIS  54           2HB      HIS  54  20.310   1.641  -7.933
  399    HD1  HIS  54           1HD      HIS  54  20.612  -0.740 -10.719
  400    HD2  HIS  54           2HD      HIS  54  17.727   1.827  -9.187
  401    HE1  HIS  54           1HE      HIS  54  18.442  -1.469 -11.762
  402    HA   PRO  55           HA       PRO  55  23.335   2.908 -13.172
  403    HB2  PRO  55           1HB      PRO  55  25.964   2.588 -12.574
  404    HB3  PRO  55           2HB      PRO  55  25.142   4.151 -12.487
  405    HG2  PRO  55           1HG      PRO  55  25.795   2.229 -10.286
  406    HG3  PRO  55           2HG      PRO  55  25.949   3.996 -10.312
  407    HD2  PRO  55           1HD      PRO  55  23.876   2.732  -9.113
  408    HD3  PRO  55           2HD      PRO  55  23.709   4.324  -9.882
  409    H    THR  56           H        THR  56  23.242   1.162 -14.425
  410    HA   THR  56           HA       THR  56  24.499  -1.328 -13.510
  411    HB   THR  56           HB       THR  56  22.593  -2.638 -14.403
  412    HG1  THR  56           1HG      THR  56  21.602  -0.042 -14.870
  413   HG21  THR  56          1HG2      THR  56  21.075  -2.246 -12.537
  414   HG22  THR  56          2HG2      THR  56  21.807  -0.667 -12.253
  415   HG23  THR  56          3HG2      THR  56  22.750  -2.135 -11.999
  416    H    SER  57           H        SER  57  25.389  -2.593 -15.111
  417    HA   SER  57           HA       SER  57  24.971  -1.905 -17.902
  418    HB2  SER  57           1HB      SER  57  26.870  -0.454 -16.846
  419    HB3  SER  57           2HB      SER  57  27.815  -1.941 -16.937
  420    HG   SER  57           HG       SER  57  27.549  -0.252 -18.837
  421    H    SER  58           H        SER  58  25.167  -3.635 -19.204
  422    HA   SER  58           HA       SER  58  25.269  -6.216 -18.188
  423    HB2  SER  58           1HB      SER  58  24.538  -5.252 -20.549
  424    HB3  SER  58           2HB      SER  58  26.170  -5.745 -20.998
  425    HG   SER  58           HG       SER  58  24.429  -7.355 -21.248
  426    H    GLY  59           H        GLY  59  26.851  -7.604 -17.677
  427    HA2  GLY  59           1HA      GLY  59  29.553  -7.173 -18.701
  428    HA3  GLY  59           2HA      GLY  59  29.340  -7.081 -16.959
  429    HA   PRO  60           HA       PRO  60  29.712 -11.424 -16.558
  430    HB2  PRO  60           1HB      PRO  60  27.804 -12.059 -14.734
  431    HB3  PRO  60           2HB      PRO  60  29.282 -11.184 -14.314
  432    HG2  PRO  60           1HG      PRO  60  26.530 -10.120 -14.822
  433    HG3  PRO  60           2HG      PRO  60  27.686  -9.673 -13.554
  434    HD2  PRO  60           1HD      PRO  60  27.324  -8.184 -15.786
  435    HD3  PRO  60           2HD      PRO  60  28.892  -8.302 -14.961
  436    H    SER  61           H        SER  61  28.832 -13.452 -17.117
  437    HA   SER  61           HA       SER  61  26.559 -13.272 -18.938
  438    HB2  SER  61           1HB      SER  61  28.791 -14.366 -19.556
  439    HB3  SER  61           2HB      SER  61  28.306 -15.693 -18.500
  440    HG   SER  61           HG       SER  61  27.275 -14.903 -20.967
  441    H    SER  62           H        SER  62  27.649 -15.202 -16.166
  442    HA   SER  62           HA       SER  62  25.504 -16.927 -15.928
  443    HB2  SER  62           1HB      SER  62  27.194 -15.663 -13.761
  444    HB3  SER  62           2HB      SER  62  26.071 -16.994 -13.481
  445    HG   SER  62           HG       SER  62  28.191 -17.085 -15.363
  446    H    GLY  63           H        GLY  63  23.786 -16.895 -14.225
  447    HA2  GLY  63           1HA      GLY  63  22.476 -15.375 -12.746
  448    HA3  GLY  63           2HA      GLY  63  22.607 -14.191 -14.038
  Start of MODEL    2
    1    H1   GLY   1           H        GLY   1 -31.434 -19.852  -3.212
    2    HA2  GLY   1           1HA      GLY   1 -31.987 -18.216  -0.850
    3    HA3  GLY   1           2HA      GLY   1 -30.595 -19.264  -1.082
    4    H    SER   2           H        SER   2 -28.864 -17.991  -0.891
    5    HA   SER   2           HA       SER   2 -28.874 -15.388  -2.253
    6    HB2  SER   2           1HB      SER   2 -27.236 -16.486   0.029
    7    HB3  SER   2           2HB      SER   2 -26.773 -15.017  -0.830
    8    HG   SER   2           HG       SER   2 -29.023 -14.325  -0.325
    9    H    SER   3           H        SER   3 -26.631 -14.724  -3.071
   10    HA   SER   3           HA       SER   3 -25.296 -17.005  -4.365
   11    HB2  SER   3           1HB      SER   3 -25.084 -15.656  -6.430
   12    HB3  SER   3           2HB      SER   3 -26.769 -15.968  -6.015
   13    HG   SER   3           HG       SER   3 -25.385 -13.593  -6.116
   14    H    GLY   4           H        GLY   4 -24.386 -15.822  -2.029
   15    HA2  GLY   4           1HA      GLY   4 -22.556 -14.796  -1.086
   16    HA3  GLY   4           2HA      GLY   4 -21.723 -15.337  -2.536
   17    H    SER   5           H        SER   5 -23.847 -12.735  -1.365
   18    HA   SER   5           HA       SER   5 -23.346 -10.924  -3.437
   19    HB2  SER   5           1HB      SER   5 -24.085 -10.430  -0.545
   20    HB3  SER   5           2HB      SER   5 -24.080  -9.179  -1.789
   21    HG   SER   5           HG       SER   5 -25.477 -11.025  -2.862
   22    H    SER   6           H        SER   6 -21.380 -10.301  -4.052
   23    HA   SER   6           HA       SER   6 -19.261  -9.950  -2.088
   24    HB2  SER   6           1HB      SER   6 -17.750  -9.935  -3.900
   25    HB3  SER   6           2HB      SER   6 -18.982 -11.105  -4.370
   26    HG   SER   6           HG       SER   6 -19.968  -9.411  -5.594
   27    H    GLY   7           H        GLY   7 -18.996  -8.059  -1.115
   28    HA2  GLY   7           1HA      GLY   7 -20.102  -5.640  -2.306
   29    HA3  GLY   7           2HA      GLY   7 -19.466  -5.802  -0.675
   30    H    ARG   8           H        ARG   8 -17.149  -5.839  -0.394
   31    HA   ARG   8           HA       ARG   8 -15.741  -3.805  -1.385
   32    HB2  ARG   8           1HB      ARG   8 -14.857  -6.532  -0.536
   33    HB3  ARG   8           2HB      ARG   8 -13.666  -5.422  -1.201
   34    HG2  ARG   8           1HG      ARG   8 -14.168  -3.797   0.520
   35    HG3  ARG   8           2HG      ARG   8 -15.443  -4.837   1.158
   36    HD2  ARG   8           1HD      ARG   8 -13.695  -5.333   2.573
   37    HD3  ARG   8           2HD      ARG   8 -13.527  -6.593   1.351
   38    HE   ARG   8           HE       ARG   8 -11.572  -5.603   0.622
   39   HH11  ARG   8          2HH1      ARG   8 -13.178  -3.552   2.931
   40   HH12  ARG   8          1HH1      ARG   8 -11.822  -2.492   3.130
   41   HH21  ARG   8          2HH2      ARG   8  -9.779  -4.216   0.875
   42   HH22  ARG   8          1HH2      ARG   8  -9.889  -2.870   1.959
   43    H    LYS   9           H        LYS   9 -15.658  -3.140  -3.437
   44    HA   LYS   9           HA       LYS   9 -15.718  -4.819  -5.698
   45    HB2  LYS   9           1HB      LYS   9 -14.881  -1.939  -5.355
   46    HB3  LYS   9           2HB      LYS   9 -14.963  -2.733  -6.922
   47    HG2  LYS   9           1HG      LYS   9 -17.011  -1.738  -6.862
   48    HG3  LYS   9           2HG      LYS   9 -17.408  -3.301  -6.144
   49    HD2  LYS   9           1HD      LYS   9 -17.399  -2.399  -3.953
   50    HD3  LYS   9           2HD      LYS   9 -16.642  -0.900  -4.497
   51    HE2  LYS   9           1HE      LYS   9 -18.897  -0.346  -4.185
   52    HE3  LYS   9           2HE      LYS   9 -18.731  -0.568  -5.926
   53    HZ1  LYS   9           1HZ      LYS   9 -19.399  -3.017  -4.669
   54    HZ2  LYS   9           2HZ      LYS   9 -20.232  -2.179  -5.879
   55    HZ3  LYS   9           3HZ      LYS   9 -20.525  -1.826  -4.251
   56    H    ILE  10           H        ILE  10 -14.179  -5.991  -6.626
   57    HA   ILE  10           HA       ILE  10 -11.500  -5.968  -5.609
   58    HB   ILE  10           HB       ILE  10 -12.566  -7.442  -8.020
   59   HG12  ILE  10          1HG1      ILE  10 -12.439  -9.341  -6.147
   60   HG13  ILE  10          2HG1      ILE  10 -12.746  -7.965  -5.093
   61   HG21  ILE  10          1HG2      ILE  10 -10.326  -7.726  -8.251
   62   HG22  ILE  10          2HG2      ILE  10 -10.002  -7.454  -6.540
   63   HG23  ILE  10          3HG2      ILE  10 -10.628  -9.011  -7.082
   64   HD11  ILE  10          1HD1      ILE  10 -14.849  -7.624  -5.928
   65   HD12  ILE  10          2HD1      ILE  10 -14.474  -8.375  -7.480
   66   HD13  ILE  10          3HD1      ILE  10 -14.714  -9.378  -6.049
   67    H    PHE  11           H        PHE  11 -11.802  -3.472  -6.465
   68    HA   PHE  11           HA       PHE  11 -10.197  -3.381  -8.930
   69    HB2  PHE  11           1HB      PHE  11 -12.485  -1.583  -8.126
   70    HB3  PHE  11           2HB      PHE  11 -11.326  -1.152  -9.380
   71    HD1  PHE  11           2HD      PHE  11 -13.344  -4.163  -8.475
   72    HD2  PHE  11           1HD      PHE  11 -12.081  -1.463 -11.513
   73    HE1  PHE  11           2HE      PHE  11 -14.678  -5.404 -10.128
   74    HE2  PHE  11           1HE      PHE  11 -13.414  -2.699 -13.171
   75    HZ   PHE  11           HZ       PHE  11 -14.714  -4.673 -12.480
   76    H    THR  12           H        THR  12  -9.098  -3.500  -6.379
   77    HA   THR  12           HA       THR  12  -8.125  -0.747  -5.975
   78    HB   THR  12           HB       THR  12  -7.474  -1.535  -3.666
   79    HG1  THR  12           1HG      THR  12  -7.779  -3.842  -4.346
   80   HG21  THR  12          1HG2      THR  12  -9.665  -0.305  -4.413
   81   HG22  THR  12          2HG2      THR  12  -9.511  -0.924  -2.769
   82   HG23  THR  12          3HG2      THR  12 -10.431  -1.830  -3.969
   83    H    ASN  13           H        ASN  13  -5.871  -0.860  -4.791
   84    HA   ASN  13           HA       ASN  13  -4.194  -2.947  -5.978
   85    HB2  ASN  13           1HB      ASN  13  -3.523  -0.005  -6.177
   86    HB3  ASN  13           2HB      ASN  13  -2.607  -1.348  -6.853
   87   HD21  ASN  13          1HD2      ASN  13  -5.755   0.245  -6.986
   88   HD22  ASN  13          2HD2      ASN  13  -6.054  -0.094  -8.654
   89    H    LYS  14           H        LYS  14  -2.630  -3.655  -4.653
   90    HA   LYS  14           HA       LYS  14  -2.470  -2.523  -1.995
   91    HB2  LYS  14           1HB      LYS  14  -2.557  -4.927  -2.180
   92    HB3  LYS  14           2HB      LYS  14  -1.168  -4.940  -3.258
   93    HG2  LYS  14           1HG      LYS  14   0.078  -3.848  -1.270
   94    HG3  LYS  14           2HG      LYS  14  -1.266  -4.470  -0.310
   95    HD2  LYS  14           1HD      LYS  14  -0.762  -6.700  -0.849
   96    HD3  LYS  14           2HD      LYS  14   0.277  -6.227  -2.196
   97    HE2  LYS  14           1HE      LYS  14   0.927  -5.454   0.628
   98    HE3  LYS  14           2HE      LYS  14   1.386  -7.028  -0.019
   99    HZ1  LYS  14           1HZ      LYS  14   2.385  -5.615  -1.922
  100    HZ2  LYS  14           2HZ      LYS  14   3.232  -5.761  -0.466
  101    HZ3  LYS  14           3HZ      LYS  14   2.345  -4.357  -0.791
  102    H    CYS  15           H        CYS  15  -0.987  -1.122  -1.327
  103    HA   CYS  15           HA       CYS  15   0.919   0.028  -3.017
  104    HB2  CYS  15           1HB      CYS  15   0.074   1.210  -1.073
  105    HB3  CYS  15           2HB      CYS  15   0.774   0.005   0.004
  106    H    GLU  16           H        GLU  16   3.055  -0.318  -3.381
  107    HA   GLU  16           HA       GLU  16   4.136  -2.859  -2.436
  108    HB2  GLU  16           1HB      GLU  16   5.163  -0.949  -4.544
  109    HB3  GLU  16           2HB      GLU  16   5.861  -2.518  -4.167
  110    HG2  GLU  16           1HG      GLU  16   3.559  -3.474  -4.730
  111    HG3  GLU  16           2HG      GLU  16   3.231  -1.902  -5.458
  112    H    ARG  17           H        ARG  17   3.951  -0.467  -0.708
  113    HA   ARG  17           HA       ARG  17   6.751   0.267  -0.323
  114    HB2  ARG  17           1HB      ARG  17   4.984   2.017  -0.260
  115    HB3  ARG  17           2HB      ARG  17   4.297   1.231   1.155
  116    HG2  ARG  17           1HG      ARG  17   5.544   2.835   2.172
  117    HG3  ARG  17           2HG      ARG  17   6.743   1.543   2.088
  118    HD2  ARG  17           1HD      ARG  17   7.941   2.575   0.430
  119    HD3  ARG  17           2HD      ARG  17   6.534   3.428  -0.203
  120    HE   ARG  17           HE       ARG  17   7.070   5.181   1.149
  121   HH11  ARG  17          2HH1      ARG  17   8.561   2.306   2.425
  122   HH12  ARG  17          1HH1      ARG  17   9.413   3.146   3.678
  123   HH21  ARG  17          2HH2      ARG  17   8.187   6.299   2.794
  124   HH22  ARG  17          1HH2      ARG  17   9.199   5.418   3.887
  125    H    ALA  18           H        ALA  18   7.905  -0.159   1.549
  126    HA   ALA  18           HA       ALA  18   7.353  -2.607   2.847
  127    HB1  ALA  18           1HB      ALA  18   9.445  -2.442   3.653
  128    HB2  ALA  18           2HB      ALA  18   9.579  -1.107   2.508
  129    HB3  ALA  18           3HB      ALA  18   9.215  -0.782   4.203
  130    H    GLY  19           H        GLY  19   6.285  -3.076   4.675
  131    HA2  GLY  19           1HA      GLY  19   5.017  -2.804   6.569
  132    HA3  GLY  19           2HA      GLY  19   5.987  -1.373   6.888
  133    H    CYS  20           H        CYS  20   3.901  -1.916   4.093
  134    HA   CYS  20           HA       CYS  20   2.002   0.058   5.146
  135    HB2  CYS  20           1HB      CYS  20   3.755   1.074   3.564
  136    HB3  CYS  20           2HB      CYS  20   2.948   0.169   2.288
  137    H    ARG  21           H        ARG  21  -0.098  -0.327   4.650
  138    HA   ARG  21           HA       ARG  21  -0.680  -2.478   2.729
  139    HB2  ARG  21           1HB      ARG  21  -2.450  -3.296   4.252
  140    HB3  ARG  21           2HB      ARG  21  -0.840  -3.445   4.944
  141    HG2  ARG  21           1HG      ARG  21  -1.217  -1.828   6.524
  142    HG3  ARG  21           2HG      ARG  21  -2.452  -1.019   5.557
  143    HD2  ARG  21           1HD      ARG  21  -3.659  -2.036   7.276
  144    HD3  ARG  21           2HD      ARG  21  -3.846  -3.138   5.913
  145    HE   ARG  21           HE       ARG  21  -2.632  -4.721   7.056
  146   HH11  ARG  21          2HH1      ARG  21  -2.356  -1.644   8.661
  147   HH12  ARG  21          1HH1      ARG  21  -1.589  -2.300  10.070
  148   HH21  ARG  21          2HH2      ARG  21  -1.623  -5.597   8.905
  149   HH22  ARG  21          1HH2      ARG  21  -1.172  -4.549  10.207
  150    H    GLN  22           H        GLN  22  -0.786   0.372   2.350
  151    HA   GLN  22           HA       GLN  22  -3.421   1.363   2.613
  152    HB2  GLN  22           1HB      GLN  22  -0.968   2.174   1.148
  153    HB3  GLN  22           2HB      GLN  22  -2.494   2.840   0.580
  154    HG2  GLN  22           1HG      GLN  22  -1.162   3.195   3.235
  155    HG3  GLN  22           2HG      GLN  22  -1.692   4.421   2.084
  156   HE21  GLN  22          1HE2      GLN  22  -2.353   3.114   4.983
  157   HE22  GLN  22          2HE2      GLN  22  -4.048   3.432   5.084
  158    H    ARG  23           H        ARG  23  -5.079   1.562   1.101
  159    HA   ARG  23           HA       ARG  23  -4.842  -0.128  -1.297
  160    HB2  ARG  23           1HB      ARG  23  -7.226   0.034   0.556
  161    HB3  ARG  23           2HB      ARG  23  -7.165  -0.870  -0.951
  162    HG2  ARG  23           1HG      ARG  23  -5.101  -2.019   0.189
  163    HG3  ARG  23           2HG      ARG  23  -5.884  -1.456   1.667
  164    HD2  ARG  23           1HD      ARG  23  -7.770  -2.761   1.314
  165    HD3  ARG  23           2HD      ARG  23  -7.457  -2.920  -0.414
  166    HE   ARG  23           HE       ARG  23  -6.027  -4.680   0.025
  167   HH11  ARG  23          2HH1      ARG  23  -6.981  -3.131   2.993
  168   HH12  ARG  23          1HH1      ARG  23  -6.349  -4.388   4.005
  169   HH21  ARG  23          2HH2      ARG  23  -5.192  -6.341   1.345
  170   HH22  ARG  23          1HH2      ARG  23  -5.331  -6.213   3.066
  171    H    GLU  24           H        GLU  24  -4.931   1.219  -2.973
  172    HA   GLU  24           HA       GLU  24  -6.721   3.541  -2.843
  173    HB2  GLU  24           1HB      GLU  24  -4.431   2.931  -4.721
  174    HB3  GLU  24           2HB      GLU  24  -5.430   4.377  -4.790
  175    HG2  GLU  24           1HG      GLU  24  -3.246   4.714  -3.678
  176    HG3  GLU  24           2HG      GLU  24  -4.632   5.117  -2.666
  177    H    MET  25           H        MET  25  -8.514   3.634  -4.036
  178    HA   MET  25           HA       MET  25  -9.585   1.454  -5.362
  179    HB2  MET  25           1HB      MET  25 -10.184   4.395  -5.699
  180    HB3  MET  25           2HB      MET  25 -11.164   3.111  -6.397
  181    HG2  MET  25           1HG      MET  25 -12.333   3.510  -4.490
  182    HG3  MET  25           2HG      MET  25 -11.232   2.259  -3.916
  183    HE1  MET  25           1HE      MET  25 -12.553   3.304  -2.003
  184    HE2  MET  25           2HE      MET  25 -11.324   3.733  -0.814
  185    HE3  MET  25           3HE      MET  25 -12.399   4.974  -1.458
  186    H    MET  26           H        MET  26  -7.655   4.116  -6.632
  187    HA   MET  26           HA       MET  26  -7.793   2.959  -9.319
  188    HB2  MET  26           1HB      MET  26  -6.749   5.043 -10.072
  189    HB3  MET  26           2HB      MET  26  -8.205   5.364  -9.139
  190    HG2  MET  26           1HG      MET  26  -5.610   5.350  -7.705
  191    HG3  MET  26           2HG      MET  26  -5.970   6.712  -8.763
  192    HE1  MET  26           1HE      MET  26  -6.582   8.627  -5.845
  193    HE2  MET  26           2HE      MET  26  -5.887   8.380  -7.447
  194    HE3  MET  26           3HE      MET  26  -7.533   8.995  -7.284
  195    H    LYS  27           H        LYS  27  -5.565   3.338 -10.533
  196    HA   LYS  27           HA       LYS  27  -3.570   1.877  -8.954
  197    HB2  LYS  27           1HB      LYS  27  -4.223   0.758 -10.991
  198    HB3  LYS  27           2HB      LYS  27  -3.915   2.208 -11.938
  199    HG2  LYS  27           1HG      LYS  27  -1.615   1.974 -11.788
  200    HG3  LYS  27           2HG      LYS  27  -1.715   0.926 -10.372
  201    HD2  LYS  27           1HD      LYS  27  -1.168  -0.542 -12.097
  202    HD3  LYS  27           2HD      LYS  27  -2.917  -0.722 -11.946
  203    HE2  LYS  27           1HE      LYS  27  -1.864   1.317 -13.838
  204    HE3  LYS  27           2HE      LYS  27  -1.748  -0.382 -14.294
  205    HZ1  LYS  27           1HZ      LYS  27  -3.893   1.152 -14.736
  206    HZ2  LYS  27           2HZ      LYS  27  -4.326   0.437 -13.266
  207    HZ3  LYS  27           3HZ      LYS  27  -3.950  -0.534 -14.599
  208    H    LEU  28           H        LEU  28  -1.967   3.023  -8.115
  209    HA   LEU  28           HA       LEU  28  -1.060   5.436  -9.543
  210    HB2  LEU  28           1HB      LEU  28  -1.026   4.786  -6.602
  211    HB3  LEU  28           2HB      LEU  28  -0.218   6.182  -7.311
  212    HG   LEU  28           HG       LEU  28  -3.163   5.786  -7.686
  213   HD11  LEU  28          1HD1      LEU  28  -1.761   6.393  -5.186
  214   HD12  LEU  28          2HD1      LEU  28  -3.413   5.842  -5.461
  215   HD13  LEU  28          3HD1      LEU  28  -3.016   7.552  -5.626
  216   HD21  LEU  28          1HD2      LEU  28  -1.415   8.239  -7.517
  217   HD22  LEU  28          2HD2      LEU  28  -3.140   8.207  -7.883
  218   HD23  LEU  28          3HD2      LEU  28  -1.985   7.488  -9.007
  219    H    THR  29           H        THR  29   0.490   4.427 -10.810
  220    HA   THR  29           HA       THR  29   2.635   2.981  -9.427
  221    HB   THR  29           HB       THR  29   2.248   3.272 -12.410
  222    HG1  THR  29           1HG      THR  29   1.487   1.091 -10.738
  223   HG21  THR  29          1HG2      THR  29   4.097   2.034 -12.645
  224   HG22  THR  29          2HG2      THR  29   3.579   0.891 -11.406
  225   HG23  THR  29          3HG2      THR  29   4.419   2.371 -10.945
  226    H    CYS  30           H        CYS  30   4.675   3.745  -9.287
  227    HA   CYS  30           HA       CYS  30   5.197   6.475  -9.538
  228    HB2  CYS  30           1HB      CYS  30   6.446   4.644  -8.187
  229    HB3  CYS  30           2HB      CYS  30   7.384   4.417  -9.659
  230    H    GLU  31           H        GLU  31   7.123   7.333 -10.854
  231    HA   GLU  31           HA       GLU  31   6.739   6.491 -13.648
  232    HB2  GLU  31           1HB      GLU  31   7.324   8.745 -14.302
  233    HB3  GLU  31           2HB      GLU  31   6.038   8.804 -13.104
  234    HG2  GLU  31           1HG      GLU  31   7.571   9.449 -11.390
  235    HG3  GLU  31           2HG      GLU  31   8.949   9.191 -12.458
  236    H    ARG  32           H        ARG  32   9.004   6.716 -11.108
  237    HA   ARG  32           HA       ARG  32  11.300   6.591 -12.911
  238    HB2  ARG  32           1HB      ARG  32  11.078   6.834  -9.910
  239    HB3  ARG  32           2HB      ARG  32  12.610   6.633 -10.750
  240    HG2  ARG  32           1HG      ARG  32  12.159   8.714 -11.999
  241    HG3  ARG  32           2HG      ARG  32  10.683   8.926 -11.055
  242    HD2  ARG  32           1HD      ARG  32  12.201  10.236  -9.902
  243    HD3  ARG  32           2HD      ARG  32  12.261   8.717  -9.010
  244    HE   ARG  32           HE       ARG  32  14.223   8.980 -11.117
  245   HH11  ARG  32          2HH1      ARG  32  13.495   9.448  -7.745
  246   HH12  ARG  32          1HH1      ARG  32  15.156   9.452  -7.252
  247   HH21  ARG  32          2HH2      ARG  32  16.413   8.983 -10.481
  248   HH22  ARG  32          1HH2      ARG  32  16.815   9.188  -8.810
  249    H    CYS  33           H        CYS  33  10.014   4.755 -10.136
  250    HA   CYS  33           HA       CYS  33  11.616   2.449 -10.878
  251    HB2  CYS  33           1HB      CYS  33  10.567   1.432  -8.829
  252    HB3  CYS  33           2HB      CYS  33  11.497   2.896  -8.530
  253    H    SER  34           H        SER  34   8.388   3.610 -11.239
  254    HA   SER  34           HA       SER  34   6.588   2.798 -12.373
  255    HB2  SER  34           1HB      SER  34   8.419   0.563 -13.274
  256    HB3  SER  34           2HB      SER  34   6.907   1.063 -14.032
  257    HG   SER  34           HG       SER  34   7.860   2.931 -14.704
  258    H    ARG  35           H        ARG  35   6.688   2.231  -9.720
  259    HA   ARG  35           HA       ARG  35   5.565  -0.490  -9.593
  260    HB2  ARG  35           1HB      ARG  35   7.295   0.951  -7.588
  261    HB3  ARG  35           2HB      ARG  35   6.317  -0.446  -7.157
  262    HG2  ARG  35           1HG      ARG  35   7.552  -1.575  -9.155
  263    HG3  ARG  35           2HG      ARG  35   8.731  -0.286  -8.898
  264    HD2  ARG  35           1HD      ARG  35   8.488  -1.066  -6.381
  265    HD3  ARG  35           2HD      ARG  35   7.994  -2.575  -7.148
  266    HE   ARG  35           HE       ARG  35  10.151  -2.850  -7.964
  267   HH11  ARG  35          2HH1      ARG  35   9.804   0.220  -6.360
  268   HH12  ARG  35          1HH1      ARG  35  11.509   0.519  -6.282
  269   HH21  ARG  35          2HH2      ARG  35  12.397  -2.468  -7.868
  270   HH22  ARG  35          1HH2      ARG  35  12.983  -1.010  -7.141
  271    H    ASN  36           H        ASN  36   3.807  -0.805  -8.159
  272    HA   ASN  36           HA       ASN  36   2.013   1.407  -8.040
  273    HB2  ASN  36           1HB      ASN  36   1.470  -1.111  -8.296
  274    HB3  ASN  36           2HB      ASN  36   1.615  -1.172  -6.542
  275   HD21  ASN  36          1HD2      ASN  36   0.082  -0.171  -5.270
  276   HD22  ASN  36          2HD2      ASN  36  -1.425   0.391  -5.899
  277    H    PHE  37           H        PHE  37   1.222   2.515  -6.259
  278    HA   PHE  37           HA       PHE  37   2.162   1.962  -3.602
  279    HB2  PHE  37           1HB      PHE  37   3.097   4.501  -4.958
  280    HB3  PHE  37           2HB      PHE  37   3.362   4.068  -3.272
  281    HD1  PHE  37           2HD      PHE  37   4.651   1.859  -2.848
  282    HD2  PHE  37           1HD      PHE  37   4.690   3.976  -6.541
  283    HE1  PHE  37           2HE      PHE  37   6.750   0.734  -3.468
  284    HE2  PHE  37           1HE      PHE  37   6.788   2.854  -7.166
  285    HZ   PHE  37           HZ       PHE  37   7.821   1.231  -5.628
  286    H    CYS  38           H        CYS  38   1.412   3.731  -2.059
  287    HA   CYS  38           HA       CYS  38  -1.300   4.488  -2.843
  288    HB2  CYS  38           1HB      CYS  38  -1.734   4.764  -0.475
  289    HB3  CYS  38           2HB      CYS  38  -0.945   3.212  -0.740
  290    H    ILE  39           H        ILE  39  -2.128   6.590  -2.499
  291    HA   ILE  39           HA       ILE  39  -0.813   8.710  -3.476
  292    HB   ILE  39           HB       ILE  39  -2.851   8.702  -1.259
  293   HG12  ILE  39          1HG1      ILE  39  -3.075   9.475  -4.175
  294   HG13  ILE  39          2HG1      ILE  39  -3.500   7.891  -3.535
  295   HG21  ILE  39          1HG2      ILE  39  -1.854  11.098  -2.795
  296   HG22  ILE  39          2HG2      ILE  39  -3.146  11.084  -1.596
  297   HG23  ILE  39          3HG2      ILE  39  -1.487  10.744  -1.107
  298   HD11  ILE  39          1HD1      ILE  39  -5.457   9.313  -3.864
  299   HD12  ILE  39          2HD1      ILE  39  -5.233   8.890  -2.166
  300   HD13  ILE  39          3HD1      ILE  39  -4.783  10.495  -2.742
  301    H    LYS  40           H        LYS  40  -0.637   7.609  -0.128
  302    HA   LYS  40           HA       LYS  40   0.879   9.768   0.873
  303    HB2  LYS  40           1HB      LYS  40   0.295   6.984   1.775
  304    HB3  LYS  40           2HB      LYS  40   1.606   7.856   2.559
  305    HG2  LYS  40           1HG      LYS  40  -0.153   8.377   3.926
  306    HG3  LYS  40           2HG      LYS  40  -0.183   9.742   2.807
  307    HD2  LYS  40           1HD      LYS  40  -2.419   9.051   2.960
  308    HD3  LYS  40           2HD      LYS  40  -1.844   8.357   1.442
  309    HE2  LYS  40           1HE      LYS  40  -3.025   6.621   2.484
  310    HE3  LYS  40           2HE      LYS  40  -1.328   6.258   2.794
  311    HZ1  LYS  40           1HZ      LYS  40  -1.749   6.278   4.952
  312    HZ2  LYS  40           2HZ      LYS  40  -3.382   6.603   4.653
  313    HZ3  LYS  40           3HZ      LYS  40  -2.292   7.879   4.869
  314    H    HIS  41           H        HIS  41   1.805   6.650  -0.520
  315    HA   HIS  41           HA       HIS  41   4.615   7.521  -0.482
  316    HB2  HIS  41           1HB      HIS  41   3.465   4.740  -0.792
  317    HB3  HIS  41           2HB      HIS  41   5.181   5.138  -0.796
  318    HD2  HIS  41           2HD      HIS  41   5.216   7.058   1.876
  319    HE1  HIS  41           1HE      HIS  41   3.607   3.641   3.809
  320    HE2  HIS  41           2HE      HIS  41   4.687   5.895   4.125
  321    H    ARG  42           H        ARG  42   2.354   8.133  -2.435
  322    HA   ARG  42           HA       ARG  42   3.033   6.824  -4.877
  323    HB2  ARG  42           1HB      ARG  42   0.880   7.628  -4.963
  324    HB3  ARG  42           2HB      ARG  42   1.279   9.096  -4.081
  325    HG2  ARG  42           1HG      ARG  42   0.761   9.763  -6.277
  326    HG3  ARG  42           2HG      ARG  42   2.519   9.854  -6.141
  327    HD2  ARG  42           1HD      ARG  42   2.465   7.440  -7.083
  328    HD3  ARG  42           2HD      ARG  42   0.832   7.858  -7.601
  329    HE   ARG  42           HE       ARG  42   3.280   8.738  -8.773
  330   HH11  ARG  42          2HH1      ARG  42  -0.027   9.640  -8.165
  331   HH12  ARG  42          1HH1      ARG  42  -0.116  10.722  -9.515
  332   HH21  ARG  42          2HH2      ARG  42   3.175  10.160 -10.554
  333   HH22  ARG  42          1HH2      ARG  42   1.705  11.016 -10.874
  334    H    HIS  43           H        HIS  43   4.041   9.776  -3.282
  335    HA   HIS  43           HA       HIS  43   5.472  10.789  -5.562
  336    HB2  HIS  43           1HB      HIS  43   4.460  12.038  -3.446
  337    HB3  HIS  43           2HB      HIS  43   6.070  11.740  -2.799
  338    HD1  HIS  43           1HD      HIS  43   8.051  12.980  -3.928
  339    HD2  HIS  43           2HD      HIS  43   4.317  13.957  -5.465
  340    HE1  HIS  43           1HE      HIS  43   8.414  15.048  -5.312
  341    HA   PRO  44           HA       PRO  44   9.193   8.491  -5.035
  342    HB2  PRO  44           1HB      PRO  44  10.882  10.131  -6.387
  343    HB3  PRO  44           2HB      PRO  44   9.692   9.102  -7.193
  344    HG2  PRO  44           1HG      PRO  44   9.540  12.019  -6.542
  345    HG3  PRO  44           2HG      PRO  44   9.062  11.178  -8.028
  346    HD2  PRO  44           1HD      PRO  44   7.271  11.937  -6.144
  347    HD3  PRO  44           2HD      PRO  44   7.053  10.482  -7.138
  348    H    LEU  45           H        LEU  45   8.457  11.206  -3.375
  349    HA   LEU  45           HA       LEU  45  11.140  11.509  -2.212
  350    HB2  LEU  45           1HB      LEU  45   8.723  13.298  -2.192
  351    HB3  LEU  45           2HB      LEU  45  10.122  13.571  -1.156
  352    HG   LEU  45           HG       LEU  45  10.208  13.530  -4.171
  353   HD11  LEU  45          1HD1      LEU  45  10.272  15.904  -2.317
  354   HD12  LEU  45          2HD1      LEU  45   8.868  15.404  -3.260
  355   HD13  LEU  45          3HD1      LEU  45  10.340  15.927  -4.079
  356   HD21  LEU  45          1HD2      LEU  45  12.224  13.779  -2.027
  357   HD22  LEU  45          2HD2      LEU  45  12.384  14.887  -3.390
  358   HD23  LEU  45          3HD2      LEU  45  12.378  13.144  -3.666
  359    H    ASP  46           H        ASP  46   7.887  10.511  -1.564
  360    HA   ASP  46           HA       ASP  46   8.490  10.214   1.295
  361    HB2  ASP  46           1HB      ASP  46   5.911  10.278  -0.258
  362    HB3  ASP  46           2HB      ASP  46   5.976   9.661   1.390
  363    H    HIS  47           H        HIS  47   9.458   8.485  -0.954
  364    HA   HIS  47           HA       HIS  47   8.985   5.967   0.341
  365    HB2  HIS  47           1HB      HIS  47   7.764   4.844  -1.260
  366    HB3  HIS  47           2HB      HIS  47   7.051   6.449  -1.387
  367    HD1  HIS  47           1HD      HIS  47   6.720   7.089  -3.739
  368    HD2  HIS  47           2HD      HIS  47  10.116   4.745  -3.255
  369    HE1  HIS  47           1HE      HIS  47   7.704   6.849  -6.040
  370    H    ASP  48           H        ASP  48  10.698   4.648   0.098
  371    HA   ASP  48           HA       ASP  48  13.081   5.568  -1.019
  372    HB2  ASP  48           1HB      ASP  48  13.364   3.937   0.617
  373    HB3  ASP  48           2HB      ASP  48  12.135   2.884  -0.077
  374    H    CYS  49           H        CYS  49  12.461   6.261  -3.149
  375    HA   CYS  49           HA       CYS  49  11.501   4.492  -5.131
  376    HB2  CYS  49           1HB      CYS  49  11.505   7.051  -5.162
  377    HB3  CYS  49           2HB      CYS  49  13.185   6.932  -5.674
  378    H    SER  50           H        SER  50  12.497   2.964  -6.267
  379    HA   SER  50           HA       SER  50  15.307   2.468  -5.841
  380    HB2  SER  50           1HB      SER  50  13.445   0.699  -6.007
  381    HB3  SER  50           2HB      SER  50  13.533   0.954  -7.750
  382    HG   SER  50           HG       SER  50  16.006   0.650  -6.827
  383    H    GLY  51           H        GLY  51  13.356   2.661  -8.828
  384    HA2  GLY  51           1HA      GLY  51  14.007   4.368 -10.492
  385    HA3  GLY  51           2HA      GLY  51  15.675   3.973 -10.107
  386    H    GLU  52           H        GLU  52  15.347   1.137 -10.021
  387    HA   GLU  52           HA       GLU  52  15.887  -0.489 -11.580
  388    HB2  GLU  52           1HB      GLU  52  13.059   0.145 -12.431
  389    HB3  GLU  52           2HB      GLU  52  13.889  -1.398 -12.578
  390    HG2  GLU  52           1HG      GLU  52  14.091  -1.153  -9.965
  391    HG3  GLU  52           2HG      GLU  52  12.691  -0.106 -10.190
  392    H    GLY  53           H        GLY  53  16.802   2.025 -12.500
  393    HA2  GLY  53           1HA      GLY  53  16.263   1.815 -15.398
  394    HA3  GLY  53           2HA      GLY  53  16.686   3.316 -14.588
  395    H    HIS  54           H        HIS  54  18.780   2.317 -12.966
  396    HA   HIS  54           HA       HIS  54  20.802   1.785 -15.039
  397    HB2  HIS  54           1HB      HIS  54  22.416   2.876 -13.565
  398    HB3  HIS  54           2HB      HIS  54  21.054   3.946 -13.883
  399    HD1  HIS  54           1HD      HIS  54  19.625   4.654 -11.900
  400    HD2  HIS  54           2HD      HIS  54  22.551   1.875 -10.911
  401    HE1  HIS  54           1HE      HIS  54  19.664   4.584  -9.386
  402    HA   PRO  55           HA       PRO  55  21.699  -2.107 -13.200
  403    HB2  PRO  55           1HB      PRO  55  24.273  -2.404 -14.010
  404    HB3  PRO  55           2HB      PRO  55  22.896  -2.568 -15.106
  405    HG2  PRO  55           1HG      PRO  55  24.716  -0.228 -14.686
  406    HG3  PRO  55           2HG      PRO  55  24.092  -0.902 -16.203
  407    HD2  PRO  55           1HD      PRO  55  23.030   1.303 -15.043
  408    HD3  PRO  55           2HD      PRO  55  22.055   0.153 -15.981
  409    H    THR  56           H        THR  56  22.655  -2.994 -11.396
  410    HA   THR  56           HA       THR  56  24.442  -1.227  -9.853
  411    HB   THR  56           HB       THR  56  22.316  -3.063  -8.731
  412    HG1  THR  56           1HG      THR  56  21.549  -1.078  -9.724
  413   HG21  THR  56          1HG2      THR  56  23.286  -1.130  -6.874
  414   HG22  THR  56          2HG2      THR  56  24.665  -1.991  -7.557
  415   HG23  THR  56          3HG2      THR  56  23.364  -2.888  -6.775
  416    H    SER  57           H        SER  57  26.312  -2.089  -9.209
  417    HA   SER  57           HA       SER  57  27.986  -3.583  -8.837
  418    HB2  SER  57           1HB      SER  57  25.657  -5.454  -8.352
  419    HB3  SER  57           2HB      SER  57  27.341  -5.857  -8.015
  420    HG   SER  57           HG       SER  57  26.150  -3.541  -6.932
  421    H    SER  58           H        SER  58  27.242  -3.091 -11.493
  422    HA   SER  58           HA       SER  58  27.073  -5.563 -12.943
  423    HB2  SER  58           1HB      SER  58  26.257  -3.195 -13.660
  424    HB3  SER  58           2HB      SER  58  27.927  -2.959 -14.175
  425    HG   SER  58           HG       SER  58  25.970  -4.271 -15.427
  426    H    GLY  59           H        GLY  59  28.802  -6.874 -12.587
  427    HA2  GLY  59           1HA      GLY  59  31.334  -5.999 -13.741
  428    HA3  GLY  59           2HA      GLY  59  31.371  -6.482 -12.052
  429    HA   PRO  60           HA       PRO  60  31.475 -10.148 -15.172
  430    HB2  PRO  60           1HB      PRO  60  34.145 -10.398 -15.595
  431    HB3  PRO  60           2HB      PRO  60  33.092  -9.437 -16.641
  432    HG2  PRO  60           1HG      PRO  60  34.893  -8.537 -14.426
  433    HG3  PRO  60           2HG      PRO  60  34.641  -7.816 -16.027
  434    HD2  PRO  60           1HD      PRO  60  33.466  -6.844 -13.790
  435    HD3  PRO  60           2HD      PRO  60  32.692  -6.765 -15.386
  436    H    SER  61           H        SER  61  32.305  -9.288 -12.161
  437    HA   SER  61           HA       SER  61  33.925 -11.511 -11.356
  438    HB2  SER  61           1HB      SER  61  33.646  -9.167 -10.228
  439    HB3  SER  61           2HB      SER  61  32.258  -9.913  -9.438
  440    HG   SER  61           HG       SER  61  34.248 -10.102  -8.250
  441    H    SER  62           H        SER  62  31.965 -12.674 -12.726
  442    HA   SER  62           HA       SER  62  30.748 -14.389 -10.792
  443    HB2  SER  62           1HB      SER  62  29.126 -12.558 -10.700
  444    HB3  SER  62           2HB      SER  62  28.937 -12.618 -12.453
  445    HG   SER  62           HG       SER  62  27.398 -13.978 -11.997
  446    H    GLY  63           H        GLY  63  30.612 -16.372 -11.633
  447    HA2  GLY  63           1HA      GLY  63  29.972 -17.920 -13.335
  448    HA3  GLY  63           2HA      GLY  63  30.244 -16.665 -14.534
  Start of MODEL    3
    1    H1   GLY   1           H        GLY   1  -0.176 -29.367   4.480
    2    HA2  GLY   1           1HA      GLY   1  -1.689 -29.880   2.358
    3    HA3  GLY   1           2HA      GLY   1  -2.789 -30.356   3.644
    4    H    SER   2           H        SER   2  -3.403 -28.335   1.837
    5    HA   SER   2           HA       SER   2  -3.927 -26.172   3.654
    6    HB2  SER   2           1HB      SER   2  -1.704 -25.495   2.947
    7    HB3  SER   2           2HB      SER   2  -2.145 -25.699   1.252
    8    HG   SER   2           HG       SER   2  -2.995 -23.731   3.082
    9    H    SER   3           H        SER   3  -5.745 -25.078   3.104
   10    HA   SER   3           HA       SER   3  -6.792 -25.316   0.386
   11    HB2  SER   3           1HB      SER   3  -8.150 -26.346   2.868
   12    HB3  SER   3           2HB      SER   3  -9.081 -25.859   1.451
   13    HG   SER   3           HG       SER   3  -8.461 -27.606   0.452
   14    H    GLY   4           H        GLY   4  -7.092 -23.273  -0.208
   15    HA2  GLY   4           1HA      GLY   4  -8.901 -21.578   1.217
   16    HA3  GLY   4           2HA      GLY   4  -7.237 -21.040   1.390
   17    H    SER   5           H        SER   5  -9.198 -19.472   0.187
   18    HA   SER   5           HA       SER   5  -8.151 -19.339  -2.554
   19    HB2  SER   5           1HB      SER   5 -10.389 -18.737  -3.394
   20    HB3  SER   5           2HB      SER   5 -10.382 -20.351  -2.683
   21    HG   SER   5           HG       SER   5 -11.286 -17.963  -1.441
   22    H    SER   6           H        SER   6  -7.489 -17.369  -3.147
   23    HA   SER   6           HA       SER   6  -8.165 -15.113  -1.378
   24    HB2  SER   6           1HB      SER   6  -6.024 -14.113  -2.055
   25    HB3  SER   6           2HB      SER   6  -5.778 -15.713  -1.355
   26    HG   SER   6           HG       SER   6  -4.703 -16.031  -3.140
   27    H    GLY   7           H        GLY   7  -9.106 -13.342  -2.213
   28    HA2  GLY   7           1HA      GLY   7  -9.397 -13.232  -5.153
   29    HA3  GLY   7           2HA      GLY   7 -10.678 -12.772  -4.040
   30    H    ARG   8           H        ARG   8  -7.863 -11.760  -5.713
   31    HA   ARG   8           HA       ARG   8  -7.818  -9.201  -4.280
   32    HB2  ARG   8           1HB      ARG   8  -5.865 -10.317  -6.301
   33    HB3  ARG   8           2HB      ARG   8  -5.682  -8.806  -5.421
   34    HG2  ARG   8           1HG      ARG   8  -5.349  -9.914  -3.374
   35    HG3  ARG   8           2HG      ARG   8  -5.929 -11.449  -4.023
   36    HD2  ARG   8           1HD      ARG   8  -3.988 -11.743  -5.332
   37    HD3  ARG   8           2HD      ARG   8  -3.487 -10.069  -5.099
   38    HE   ARG   8           HE       ARG   8  -3.144 -12.273  -3.240
   39   HH11  ARG   8          2HH1      ARG   8  -3.004  -8.839  -3.794
   40   HH12  ARG   8          1HH1      ARG   8  -1.959  -8.532  -2.447
   41   HH21  ARG   8          2HH2      ARG   8  -1.769 -11.882  -1.463
   42   HH22  ARG   8          1HH2      ARG   8  -1.257 -10.264  -1.121
   43    H    LYS   9           H        LYS   9  -9.706  -8.320  -5.192
   44    HA   LYS   9           HA       LYS   9 -10.405  -8.204  -7.861
   45    HB2  LYS   9           1HB      LYS   9 -10.809  -6.067  -5.759
   46    HB3  LYS   9           2HB      LYS   9 -11.678  -6.168  -7.285
   47    HG2  LYS   9           1HG      LYS   9 -11.737  -8.476  -5.394
   48    HG3  LYS   9           2HG      LYS   9 -12.762  -7.068  -5.103
   49    HD2  LYS   9           1HD      LYS   9 -14.056  -7.458  -6.949
   50    HD3  LYS   9           2HD      LYS   9 -12.749  -8.249  -7.833
   51    HE2  LYS   9           1HE      LYS   9 -13.038 -10.267  -6.662
   52    HE3  LYS   9           2HE      LYS   9 -14.011  -9.497  -5.409
   53    HZ1  LYS   9           1HZ      LYS   9 -15.658  -9.034  -7.261
   54    HZ2  LYS   9           2HZ      LYS   9 -15.526 -10.640  -6.745
   55    HZ3  LYS   9           3HZ      LYS   9 -14.788 -10.151  -8.187
   56    H    ILE  10           H        ILE  10  -9.156  -7.600  -9.503
   57    HA   ILE  10           HA       ILE  10  -6.848  -6.223  -9.571
   58    HB   ILE  10           HB       ILE  10  -9.052  -5.939 -11.617
   59   HG12  ILE  10          1HG1      ILE  10  -8.458  -8.272 -11.202
   60   HG13  ILE  10          2HG1      ILE  10  -7.873  -7.766 -12.783
   61   HG21  ILE  10          1HG2      ILE  10  -7.667  -4.776 -12.928
   62   HG22  ILE  10          2HG2      ILE  10  -6.722  -4.492 -11.467
   63   HG23  ILE  10          3HG2      ILE  10  -6.295  -5.817 -12.550
   64   HD11  ILE  10          1HD1      ILE  10  -6.401  -8.677 -10.437
   65   HD12  ILE  10          2HD1      ILE  10  -5.956  -8.703 -12.144
   66   HD13  ILE  10          3HD1      ILE  10  -5.726  -7.235 -11.194
   67    H    PHE  11           H        PHE  11 -10.068  -4.728  -9.698
   68    HA   PHE  11           HA       PHE  11  -9.516  -2.112 -10.098
   69    HB2  PHE  11           1HB      PHE  11 -11.371  -3.067  -7.911
   70    HB3  PHE  11           2HB      PHE  11 -11.473  -1.551  -8.802
   71    HD1  PHE  11           1HD      PHE  11 -11.474  -1.997 -11.488
   72    HD2  PHE  11           2HD      PHE  11 -12.919  -4.644  -8.485
   73    HE1  PHE  11           1HE      PHE  11 -12.946  -3.067 -13.144
   74    HE2  PHE  11           2HE      PHE  11 -14.392  -5.719 -10.136
   75    HZ   PHE  11           HZ       PHE  11 -14.407  -4.931 -12.469
   76    H    THR  12           H        THR  12  -9.595  -3.548  -6.832
   77    HA   THR  12           HA       THR  12  -8.256  -1.278  -5.687
   78    HB   THR  12           HB       THR  12  -8.301  -2.543  -3.586
   79    HG1  THR  12           1HG      THR  12  -8.814  -4.650  -3.534
   80   HG21  THR  12          1HG2      THR  12 -10.639  -1.963  -5.217
   81   HG22  THR  12          2HG2      THR  12 -10.342  -1.627  -3.511
   82   HG23  THR  12          3HG2      THR  12 -10.955  -3.205  -4.006
   83    H    ASN  13           H        ASN  13  -6.145  -0.938  -5.817
   84    HA   ASN  13           HA       ASN  13  -4.348  -3.190  -6.313
   85    HB2  ASN  13           1HB      ASN  13  -3.468  -0.321  -6.246
   86    HB3  ASN  13           2HB      ASN  13  -2.816  -1.661  -7.184
   87   HD21  ASN  13          1HD2      ASN  13  -5.223   0.805  -6.999
   88   HD22  ASN  13          2HD2      ASN  13  -5.840   0.618  -8.602
   89    H    LYS  14           H        LYS  14  -2.138  -2.994  -5.227
   90    HA   LYS  14           HA       LYS  14  -2.494  -2.235  -2.401
   91    HB2  LYS  14           1HB      LYS  14  -1.395  -4.174  -1.678
   92    HB3  LYS  14           2HB      LYS  14  -2.451  -4.743  -2.965
   93    HG2  LYS  14           1HG      LYS  14  -0.526  -4.654  -4.521
   94    HG3  LYS  14           2HG      LYS  14   0.507  -4.219  -3.157
   95    HD2  LYS  14           1HD      LYS  14  -1.191  -6.698  -3.134
   96    HD3  LYS  14           2HD      LYS  14   0.425  -6.683  -3.844
   97    HE2  LYS  14           1HE      LYS  14   0.955  -7.323  -1.720
   98    HE3  LYS  14           2HE      LYS  14   1.039  -5.573  -1.522
   99    HZ1  LYS  14           1HZ      LYS  14  -1.606  -6.400  -1.096
  100    HZ2  LYS  14           2HZ      LYS  14  -0.534  -5.700   0.009
  101    HZ3  LYS  14           3HZ      LYS  14  -0.594  -7.382  -0.161
  102    H    CYS  15           H        CYS  15  -0.835  -1.179  -1.399
  103    HA   CYS  15           HA       CYS  15   1.069   0.145  -3.063
  104    HB2  CYS  15           1HB      CYS  15   0.014   1.175  -1.049
  105    HB3  CYS  15           2HB      CYS  15   0.947   0.072  -0.042
  106    H    GLU  16           H        GLU  16   3.260  -0.131  -3.223
  107    HA   GLU  16           HA       GLU  16   4.284  -2.691  -2.226
  108    HB2  GLU  16           1HB      GLU  16   5.393  -0.867  -4.368
  109    HB3  GLU  16           2HB      GLU  16   6.036  -2.443  -3.928
  110    HG2  GLU  16           1HG      GLU  16   3.560  -3.196  -4.481
  111    HG3  GLU  16           2HG      GLU  16   3.612  -1.745  -5.481
  112    H    ARG  17           H        ARG  17   4.062  -0.098  -0.705
  113    HA   ARG  17           HA       ARG  17   6.858   0.572  -0.230
  114    HB2  ARG  17           1HB      ARG  17   4.795   2.206  -0.318
  115    HB3  ARG  17           2HB      ARG  17   4.603   1.723   1.361
  116    HG2  ARG  17           1HG      ARG  17   7.296   2.597   0.479
  117    HG3  ARG  17           2HG      ARG  17   6.040   3.825   0.655
  118    HD2  ARG  17           1HD      ARG  17   5.635   2.630   2.954
  119    HD3  ARG  17           2HD      ARG  17   7.291   2.071   2.718
  120    HE   ARG  17           HE       ARG  17   7.512   4.717   2.301
  121   HH11  ARG  17          2HH1      ARG  17   6.034   2.858   4.847
  122   HH12  ARG  17          1HH1      ARG  17   6.322   4.055   6.066
  123   HH21  ARG  17          2HH2      ARG  17   7.897   6.300   3.897
  124   HH22  ARG  17          1HH2      ARG  17   7.382   6.013   5.524
  125    H    ALA  18           H        ALA  18   7.941   0.206   1.681
  126    HA   ALA  18           HA       ALA  18   7.291  -2.114   3.128
  127    HB1  ALA  18           1HB      ALA  18   9.105  -0.103   4.347
  128    HB2  ALA  18           2HB      ALA  18   9.296  -1.849   4.181
  129    HB3  ALA  18           3HB      ALA  18   9.560  -0.797   2.790
  130    H    GLY  19           H        GLY  19   6.416  -2.449   5.143
  131    HA2  GLY  19           1HA      GLY  19   5.002  -2.057   6.909
  132    HA3  GLY  19           2HA      GLY  19   5.898  -0.558   7.107
  133    H    CYS  20           H        CYS  20   3.924  -1.466   4.327
  134    HA   CYS  20           HA       CYS  20   1.886   0.475   5.140
  135    HB2  CYS  20           1HB      CYS  20   3.661   1.481   3.568
  136    HB3  CYS  20           2HB      CYS  20   2.951   0.457   2.324
  137    H    ARG  21           H        ARG  21  -0.165  -0.047   4.550
  138    HA   ARG  21           HA       ARG  21  -0.543  -2.313   2.721
  139    HB2  ARG  21           1HB      ARG  21  -1.746  -2.007   5.474
  140    HB3  ARG  21           2HB      ARG  21  -2.341  -3.149   4.276
  141    HG2  ARG  21           1HG      ARG  21   0.162  -3.934   4.243
  142    HG3  ARG  21           2HG      ARG  21   0.186  -3.186   5.841
  143    HD2  ARG  21           1HD      ARG  21  -2.049  -5.032   5.167
  144    HD3  ARG  21           2HD      ARG  21  -0.464  -5.723   5.512
  145    HE   ARG  21           HE       ARG  21  -0.680  -5.076   7.721
  146   HH11  ARG  21          2HH1      ARG  21  -3.274  -3.760   5.808
  147   HH12  ARG  21          1HH1      ARG  21  -4.211  -3.268   7.180
  148   HH21  ARG  21          2HH2      ARG  21  -1.904  -4.433   9.535
  149   HH22  ARG  21          1HH2      ARG  21  -3.430  -3.650   9.299
  150    H    GLN  22           H        GLN  22  -0.861   0.463   2.198
  151    HA   GLN  22           HA       GLN  22  -3.543   1.312   2.452
  152    HB2  GLN  22           1HB      GLN  22  -1.170   2.170   0.882
  153    HB3  GLN  22           2HB      GLN  22  -2.743   2.715   0.317
  154    HG2  GLN  22           1HG      GLN  22  -1.383   3.293   2.919
  155    HG3  GLN  22           2HG      GLN  22  -1.985   4.423   1.707
  156   HE21  GLN  22          1HE2      GLN  22  -4.429   4.132   1.301
  157   HE22  GLN  22          2HE2      GLN  22  -5.407   4.039   2.723
  158    H    ARG  23           H        ARG  23  -5.213   1.385   0.912
  159    HA   ARG  23           HA       ARG  23  -4.923  -0.421  -1.388
  160    HB2  ARG  23           1HB      ARG  23  -7.295  -0.380   0.487
  161    HB3  ARG  23           2HB      ARG  23  -7.118  -1.390  -0.942
  162    HG2  ARG  23           1HG      ARG  23  -5.015  -2.302   0.228
  163    HG3  ARG  23           2HG      ARG  23  -5.701  -1.581   1.684
  164    HD2  ARG  23           1HD      ARG  23  -7.395  -3.340  -0.035
  165    HD3  ARG  23           2HD      ARG  23  -6.224  -4.066   1.066
  166    HE   ARG  23           HE       ARG  23  -8.042  -2.115   2.218
  167   HH11  ARG  23          2HH1      ARG  23  -7.290  -5.466   1.646
  168   HH12  ARG  23          1HH1      ARG  23  -8.307  -6.047   2.922
  169   HH21  ARG  23          2HH2      ARG  23  -9.384  -2.868   3.901
  170   HH22  ARG  23          1HH2      ARG  23  -9.498  -4.568   4.204
  171    H    GLU  24           H        GLU  24  -4.716   1.552  -2.602
  172    HA   GLU  24           HA       GLU  24  -6.880   3.441  -2.651
  173    HB2  GLU  24           1HB      GLU  24  -4.291   3.106  -4.075
  174    HB3  GLU  24           2HB      GLU  24  -5.529   4.070  -4.868
  175    HG2  GLU  24           1HG      GLU  24  -4.592   4.564  -2.056
  176    HG3  GLU  24           2HG      GLU  24  -3.896   5.350  -3.471
  177    H    MET  25           H        MET  25  -8.675   3.360  -3.833
  178    HA   MET  25           HA       MET  25  -9.533   1.139  -5.220
  179    HB2  MET  25           1HB      MET  25 -10.357   4.029  -5.411
  180    HB3  MET  25           2HB      MET  25 -11.165   2.770  -6.336
  181    HG2  MET  25           1HG      MET  25 -11.875   1.665  -4.344
  182    HG3  MET  25           2HG      MET  25 -10.895   2.734  -3.343
  183    HE1  MET  25           1HE      MET  25 -14.013   1.712  -4.033
  184    HE2  MET  25           2HE      MET  25 -15.134   3.065  -3.883
  185    HE3  MET  25           3HE      MET  25 -14.455   2.651  -5.459
  186    H    MET  26           H        MET  26  -7.827   3.975  -6.442
  187    HA   MET  26           HA       MET  26  -7.828   2.846  -9.141
  188    HB2  MET  26           1HB      MET  26  -7.099   4.980  -9.910
  189    HB3  MET  26           2HB      MET  26  -8.382   5.271  -8.743
  190    HG2  MET  26           1HG      MET  26  -6.916   6.077  -7.139
  191    HG3  MET  26           2HG      MET  26  -5.518   5.316  -7.895
  192    HE1  MET  26           1HE      MET  26  -8.049   8.615  -8.444
  193    HE2  MET  26           2HE      MET  26  -7.147   8.192  -6.989
  194    HE3  MET  26           3HE      MET  26  -6.584   9.505  -8.025
  195    H    LYS  27           H        LYS  27  -5.754   2.946 -10.367
  196    HA   LYS  27           HA       LYS  27  -3.630   1.804  -8.730
  197    HB2  LYS  27           1HB      LYS  27  -4.592   0.929 -11.039
  198    HB3  LYS  27           2HB      LYS  27  -3.413   2.056 -11.696
  199    HG2  LYS  27           1HG      LYS  27  -1.630   0.918 -10.494
  200    HG3  LYS  27           2HG      LYS  27  -2.805  -0.196  -9.790
  201    HD2  LYS  27           1HD      LYS  27  -1.814  -1.332 -11.619
  202    HD3  LYS  27           2HD      LYS  27  -3.425  -0.845 -12.149
  203    HE2  LYS  27           1HE      LYS  27  -2.546   0.964 -13.420
  204    HE3  LYS  27           2HE      LYS  27  -0.944   0.765 -12.711
  205    HZ1  LYS  27           1HZ      LYS  27  -0.902  -0.177 -14.872
  206    HZ2  LYS  27           2HZ      LYS  27  -2.314  -1.067 -14.599
  207    HZ3  LYS  27           3HZ      LYS  27  -0.889  -1.469 -13.780
  208    H    LEU  28           H        LEU  28  -1.846   2.871  -8.176
  209    HA   LEU  28           HA       LEU  28  -1.163   5.322  -9.662
  210    HB2  LEU  28           1HB      LEU  28  -0.961   4.821  -6.698
  211    HB3  LEU  28           2HB      LEU  28  -0.308   6.235  -7.521
  212    HG   LEU  28           HG       LEU  28  -3.221   5.624  -7.761
  213   HD11  LEU  28          1HD1      LEU  28  -1.804   6.617  -5.327
  214   HD12  LEU  28          2HD1      LEU  28  -3.161   5.500  -5.460
  215   HD13  LEU  28          3HD1      LEU  28  -3.411   7.225  -5.723
  216   HD21  LEU  28          1HD2      LEU  28  -1.925   7.457  -9.006
  217   HD22  LEU  28          2HD2      LEU  28  -1.869   8.283  -7.448
  218   HD23  LEU  28          3HD2      LEU  28  -3.424   7.907  -8.193
  219    H    THR  29           H        THR  29   0.456   4.499 -10.911
  220    HA   THR  29           HA       THR  29   2.608   2.991  -9.626
  221    HB   THR  29           HB       THR  29   2.335   3.625 -12.566
  222    HG1  THR  29           1HG      THR  29   0.530   2.432 -12.033
  223   HG21  THR  29          1HG2      THR  29   3.894   1.876 -12.914
  224   HG22  THR  29          2HG2      THR  29   3.760   1.324 -11.243
  225   HG23  THR  29          3HG2      THR  29   4.555   2.856 -11.606
  226    H    CYS  30           H        CYS  30   4.713   3.687  -9.530
  227    HA   CYS  30           HA       CYS  30   5.174   6.464  -9.379
  228    HB2  CYS  30           1HB      CYS  30   6.418   4.576  -8.173
  229    HB3  CYS  30           2HB      CYS  30   7.340   4.386  -9.661
  230    H    GLU  31           H        GLU  31   6.916   7.620 -10.577
  231    HA   GLU  31           HA       GLU  31   6.681   7.030 -13.445
  232    HB2  GLU  31           1HB      GLU  31   7.056   9.338 -13.868
  233    HB3  GLU  31           2HB      GLU  31   5.897   9.256 -12.548
  234    HG2  GLU  31           1HG      GLU  31   7.361  10.094 -11.020
  235    HG3  GLU  31           2HG      GLU  31   8.774   9.455 -11.857
  236    H    ARG  32           H        ARG  32   8.837   6.801 -10.894
  237    HA   ARG  32           HA       ARG  32  11.186   7.040 -12.643
  238    HB2  ARG  32           1HB      ARG  32  11.122   6.784  -9.633
  239    HB3  ARG  32           2HB      ARG  32  12.518   7.169 -10.631
  240    HG2  ARG  32           1HG      ARG  32  10.966   9.181 -11.375
  241    HG3  ARG  32           2HG      ARG  32  10.252   8.882  -9.789
  242    HD2  ARG  32           1HD      ARG  32  13.184   9.354 -10.319
  243    HD3  ARG  32           2HD      ARG  32  12.051  10.568  -9.725
  244    HE   ARG  32           HE       ARG  32  12.084   8.239  -8.080
  245   HH11  ARG  32          2HH1      ARG  32  13.782  11.194  -8.792
  246   HH12  ARG  32          1HH1      ARG  32  14.487  11.322  -7.215
  247   HH21  ARG  32          2HH2      ARG  32  13.007   8.397  -6.000
  248   HH22  ARG  32          1HH2      ARG  32  14.046   9.730  -5.627
  249    H    CYS  33           H        CYS  33   9.894   4.916 -10.085
  250    HA   CYS  33           HA       CYS  33  11.542   2.724 -11.090
  251    HB2  CYS  33           1HB      CYS  33  10.772   1.526  -9.060
  252    HB3  CYS  33           2HB      CYS  33  11.555   3.058  -8.686
  253    H    SER  34           H        SER  34   8.332   3.895 -11.237
  254    HA   SER  34           HA       SER  34   6.459   3.140 -12.286
  255    HB2  SER  34           1HB      SER  34   8.314   2.439 -13.986
  256    HB3  SER  34           2HB      SER  34   7.982   0.806 -13.407
  257    HG   SER  34           HG       SER  34   6.336   0.828 -14.695
  258    H    ARG  35           H        ARG  35   6.644   2.456  -9.687
  259    HA   ARG  35           HA       ARG  35   5.619  -0.306  -9.620
  260    HB2  ARG  35           1HB      ARG  35   7.291   1.194  -7.616
  261    HB3  ARG  35           2HB      ARG  35   6.341  -0.214  -7.157
  262    HG2  ARG  35           1HG      ARG  35   7.585  -1.370  -9.121
  263    HG3  ARG  35           2HG      ARG  35   8.733  -0.043  -8.932
  264    HD2  ARG  35           1HD      ARG  35   8.700  -0.682  -6.429
  265    HD3  ARG  35           2HD      ARG  35   8.002  -2.201  -6.988
  266    HE   ARG  35           HE       ARG  35  10.425  -1.443  -8.347
  267   HH11  ARG  35          2HH1      ARG  35   9.055  -3.112  -5.616
  268   HH12  ARG  35          1HH1      ARG  35  10.433  -4.136  -5.385
  269   HH21  ARG  35          2HH2      ARG  35  12.245  -2.786  -8.054
  270   HH22  ARG  35          1HH2      ARG  35  12.248  -3.949  -6.772
  271    H    ASN  36           H        ASN  36   3.889  -0.736  -8.163
  272    HA   ASN  36           HA       ASN  36   1.964   1.365  -8.047
  273    HB2  ASN  36           1HB      ASN  36   1.641  -1.233  -8.261
  274    HB3  ASN  36           2HB      ASN  36   1.655  -1.183  -6.501
  275   HD21  ASN  36          1HD2      ASN  36   0.199   0.594  -5.584
  276   HD22  ASN  36          2HD2      ASN  36  -1.375   0.709  -6.287
  277    H    PHE  37           H        PHE  37   1.204   2.517  -6.317
  278    HA   PHE  37           HA       PHE  37   2.096   1.985  -3.634
  279    HB2  PHE  37           1HB      PHE  37   3.023   4.514  -5.012
  280    HB3  PHE  37           2HB      PHE  37   3.243   4.131  -3.308
  281    HD1  PHE  37           2HD      PHE  37   4.425   1.769  -2.907
  282    HD2  PHE  37           1HD      PHE  37   4.797   4.157  -6.411
  283    HE1  PHE  37           2HE      PHE  37   6.557   0.660  -3.432
  284    HE2  PHE  37           1HE      PHE  37   6.930   3.051  -6.942
  285    HZ   PHE  37           HZ       PHE  37   7.813   1.301  -5.451
  286    H    CYS  38           H        CYS  38   1.326   3.813  -2.135
  287    HA   CYS  38           HA       CYS  38  -1.394   4.508  -2.963
  288    HB2  CYS  38           1HB      CYS  38  -1.898   4.752  -0.621
  289    HB3  CYS  38           2HB      CYS  38  -1.022   3.240  -0.839
  290    H    ILE  39           H        ILE  39  -2.254   6.603  -2.619
  291    HA   ILE  39           HA       ILE  39  -0.970   8.736  -3.596
  292    HB   ILE  39           HB       ILE  39  -2.992   8.708  -1.364
  293   HG12  ILE  39          1HG1      ILE  39  -3.185   9.381  -4.309
  294   HG13  ILE  39          2HG1      ILE  39  -3.739   7.889  -3.557
  295   HG21  ILE  39          1HG2      ILE  39  -2.033  11.116  -2.905
  296   HG22  ILE  39          2HG2      ILE  39  -3.310  11.086  -1.690
  297   HG23  ILE  39          3HG2      ILE  39  -1.640  10.762  -1.223
  298   HD11  ILE  39          1HD1      ILE  39  -5.555   9.480  -4.035
  299   HD12  ILE  39          2HD1      ILE  39  -5.418   9.084  -2.322
  300   HD13  ILE  39          3HD1      ILE  39  -4.810  10.626  -2.921
  301    H    LYS  40           H        LYS  40  -0.780   7.663  -0.235
  302    HA   LYS  40           HA       LYS  40   0.742   9.833   0.733
  303    HB2  LYS  40           1HB      LYS  40   0.107   7.083   1.676
  304    HB3  LYS  40           2HB      LYS  40   1.474   7.899   2.423
  305    HG2  LYS  40           1HG      LYS  40  -0.191   8.543   3.833
  306    HG3  LYS  40           2HG      LYS  40  -0.261   9.864   2.665
  307    HD2  LYS  40           1HD      LYS  40  -2.498   9.091   3.109
  308    HD3  LYS  40           2HD      LYS  40  -2.053   8.638   1.462
  309    HE2  LYS  40           1HE      LYS  40  -1.952   6.406   1.958
  310    HE3  LYS  40           2HE      LYS  40  -1.530   6.689   3.646
  311    HZ1  LYS  40           1HZ      LYS  40  -4.206   7.377   2.603
  312    HZ2  LYS  40           2HZ      LYS  40  -3.734   7.106   4.204
  313    HZ3  LYS  40           3HZ      LYS  40  -3.849   5.808   3.126
  314    H    HIS  41           H        HIS  41   1.664   6.681  -0.591
  315    HA   HIS  41           HA       HIS  41   4.471   7.565  -0.599
  316    HB2  HIS  41           1HB      HIS  41   3.332   4.768  -0.792
  317    HB3  HIS  41           2HB      HIS  41   5.046   5.172  -0.832
  318    HD2  HIS  41           2HD      HIS  41   4.926   7.275   1.774
  319    HE1  HIS  41           1HE      HIS  41   3.666   3.788   3.837
  320    HE2  HIS  41           2HE      HIS  41   4.520   6.146   4.066
  321    H    ARG  42           H        ARG  42   2.266   8.181  -2.554
  322    HA   ARG  42           HA       ARG  42   2.819   6.751  -4.951
  323    HB2  ARG  42           1HB      ARG  42   0.740   7.729  -5.048
  324    HB3  ARG  42           2HB      ARG  42   1.270   9.188  -4.222
  325    HG2  ARG  42           1HG      ARG  42   0.790   9.831  -6.430
  326    HG3  ARG  42           2HG      ARG  42   2.550   9.759  -6.324
  327    HD2  ARG  42           1HD      ARG  42   2.110   7.268  -7.130
  328    HD3  ARG  42           2HD      ARG  42   0.653   8.009  -7.792
  329    HE   ARG  42           HE       ARG  42   3.168   9.326  -8.410
  330   HH11  ARG  42          2HH1      ARG  42   0.663   7.129  -9.421
  331   HH12  ARG  42          1HH1      ARG  42   1.053   7.254 -11.105
  332   HH21  ARG  42          2HH2      ARG  42   3.691   9.498 -10.623
  333   HH22  ARG  42          1HH2      ARG  42   2.777   8.601 -11.787
  334    H    HIS  43           H        HIS  43   4.200   9.542  -3.405
  335    HA   HIS  43           HA       HIS  43   5.690  10.323  -5.774
  336    HB2  HIS  43           1HB      HIS  43   4.705  11.819  -3.788
  337    HB3  HIS  43           2HB      HIS  43   6.300  11.504  -3.112
  338    HD1  HIS  43           1HD      HIS  43   8.311  12.621  -4.252
  339    HD2  HIS  43           2HD      HIS  43   4.675  13.446  -6.085
  340    HE1  HIS  43           1HE      HIS  43   8.778  14.501  -5.856
  341    HA   PRO  44           HA       PRO  44   9.226   7.851  -4.889
  342    HB2  PRO  44           1HB      PRO  44  11.079   9.259  -6.287
  343    HB3  PRO  44           2HB      PRO  44   9.855   8.246  -7.063
  344    HG2  PRO  44           1HG      PRO  44   9.879  11.212  -6.655
  345    HG3  PRO  44           2HG      PRO  44   9.406  10.284  -8.090
  346    HD2  PRO  44           1HD      PRO  44   7.596  11.312  -6.359
  347    HD3  PRO  44           2HD      PRO  44   7.318   9.798  -7.243
  348    H    LEU  45           H        LEU  45   8.624  10.762  -3.511
  349    HA   LEU  45           HA       LEU  45  11.276  11.043  -2.293
  350    HB2  LEU  45           1HB      LEU  45   8.882  12.841  -2.463
  351    HB3  LEU  45           2HB      LEU  45  10.175  13.141  -1.303
  352    HG   LEU  45           HG       LEU  45  10.503  13.054  -4.302
  353   HD11  LEU  45          1HD1      LEU  45  10.147  15.258  -4.386
  354   HD12  LEU  45          2HD1      LEU  45  11.020  15.552  -2.882
  355   HD13  LEU  45          3HD1      LEU  45   9.332  15.043  -2.837
  356   HD21  LEU  45          1HD2      LEU  45  12.387  13.248  -2.024
  357   HD22  LEU  45          2HD2      LEU  45  12.691  14.290  -3.415
  358   HD23  LEU  45          3HD2      LEU  45  12.608  12.540  -3.625
  359    H    ASP  46           H        ASP  46   8.046  10.025  -1.636
  360    HA   ASP  46           HA       ASP  46   8.629   9.864   1.242
  361    HB2  ASP  46           1HB      ASP  46   6.074   9.994  -0.327
  362    HB3  ASP  46           2HB      ASP  46   6.081   9.302   1.293
  363    H    HIS  47           H        HIS  47   9.623   8.039  -0.877
  364    HA   HIS  47           HA       HIS  47   9.160   5.587   0.495
  365    HB2  HIS  47           1HB      HIS  47   7.863   4.385  -1.001
  366    HB3  HIS  47           2HB      HIS  47   7.112   5.975  -1.090
  367    HD1  HIS  47           1HD      HIS  47   6.601   6.607  -3.412
  368    HD2  HIS  47           2HD      HIS  47  10.025   4.266  -3.183
  369    HE1  HIS  47           1HE      HIS  47   7.395   6.343  -5.784
  370    H    ASP  48           H        ASP  48  10.859   4.261   0.221
  371    HA   ASP  48           HA       ASP  48  13.184   5.084  -1.031
  372    HB2  ASP  48           1HB      ASP  48  12.230   2.353  -0.190
  373    HB3  ASP  48           2HB      ASP  48  13.826   2.602  -0.893
  374    H    CYS  49           H        CYS  49  12.995   5.715  -3.140
  375    HA   CYS  49           HA       CYS  49  11.801   3.941  -5.099
  376    HB2  CYS  49           1HB      CYS  49  11.633   6.515  -5.068
  377    HB3  CYS  49           2HB      CYS  49  13.269   6.494  -5.718
  378    H    SER  50           H        SER  50  12.896   3.040  -6.871
  379    HA   SER  50           HA       SER  50  15.779   2.664  -6.416
  380    HB2  SER  50           1HB      SER  50  14.216   0.652  -6.338
  381    HB3  SER  50           2HB      SER  50  13.995   0.877  -8.073
  382    HG   SER  50           HG       SER  50  15.666  -0.499  -7.946
  383    H    GLY  51           H        GLY  51  13.560   2.472  -9.209
  384    HA2  GLY  51           1HA      GLY  51  13.665   3.870 -11.122
  385    HA3  GLY  51           2HA      GLY  51  15.292   4.344 -10.654
  386    H    GLU  52           H        GLU  52  13.346   1.854 -12.167
  387    HA   GLU  52           HA       GLU  52  15.221  -0.084 -12.714
  388    HB2  GLU  52           1HB      GLU  52  12.695   0.053 -13.317
  389    HB3  GLU  52           2HB      GLU  52  13.260   0.767 -14.822
  390    HG2  GLU  52           1HG      GLU  52  14.416  -1.819 -13.893
  391    HG3  GLU  52           2HG      GLU  52  12.828  -1.791 -14.659
  392    H    GLY  53           H        GLY  53  17.252   0.407 -13.321
  393    HA2  GLY  53           1HA      GLY  53  18.596   0.621 -15.362
  394    HA3  GLY  53           2HA      GLY  53  17.556   1.963 -15.814
  395    H    HIS  54           H        HIS  54  20.546   1.274 -14.775
  396    HA   HIS  54           HA       HIS  54  20.911   3.263 -12.749
  397    HB2  HIS  54           1HB      HIS  54  23.394   2.861 -13.359
  398    HB3  HIS  54           2HB      HIS  54  22.483   1.535 -12.642
  399    HD1  HIS  54           1HD      HIS  54  22.573   2.604 -16.285
  400    HD2  HIS  54           2HD      HIS  54  23.557  -0.634 -13.874
  401    HE1  HIS  54           1HE      HIS  54  23.277   0.778 -17.865
  402    HA   PRO  55           HA       PRO  55  21.417   6.873 -15.198
  403    HB2  PRO  55           1HB      PRO  55  23.186   8.261 -13.678
  404    HB3  PRO  55           2HB      PRO  55  21.492   8.044 -13.222
  405    HG2  PRO  55           1HG      PRO  55  23.913   6.555 -12.281
  406    HG3  PRO  55           2HG      PRO  55  22.534   7.158 -11.342
  407    HD2  PRO  55           1HD      PRO  55  22.766   4.566 -12.091
  408    HD3  PRO  55           2HD      PRO  55  21.195   5.376 -11.929
  409    H    THR  56           H        THR  56  24.097   4.835 -14.450
  410    HA   THR  56           HA       THR  56  25.965   6.267 -16.141
  411    HB   THR  56           HB       THR  56  26.296   3.546 -14.865
  412    HG1  THR  56           1HG      THR  56  26.958   4.568 -13.092
  413   HG21  THR  56          1HG2      THR  56  28.159   5.458 -16.237
  414   HG22  THR  56          2HG2      THR  56  27.954   3.726 -16.499
  415   HG23  THR  56          3HG2      THR  56  28.757   4.308 -15.042
  416    H    SER  57           H        SER  57  25.732   6.130 -18.275
  417    HA   SER  57           HA       SER  57  24.568   3.759 -19.488
  418    HB2  SER  57           1HB      SER  57  24.051   6.207 -20.143
  419    HB3  SER  57           2HB      SER  57  25.593   6.155 -20.997
  420    HG   SER  57           HG       SER  57  23.242   4.682 -21.478
  421    H    SER  58           H        SER  58  27.593   5.612 -19.671
  422    HA   SER  58           HA       SER  58  28.920   3.180 -20.661
  423    HB2  SER  58           1HB      SER  58  30.388   4.690 -22.054
  424    HB3  SER  58           2HB      SER  58  28.712   4.586 -22.594
  425    HG   SER  58           HG       SER  58  30.117   6.732 -21.621
  426    H    GLY  59           H        GLY  59  30.552   2.573 -19.406
  427    HA2  GLY  59           1HA      GLY  59  31.642   4.526 -17.497
  428    HA3  GLY  59           2HA      GLY  59  31.709   2.779 -17.323
  429    HA   PRO  60           HA       PRO  60  35.428   4.712 -19.771
  430    HB2  PRO  60           1HB      PRO  60  36.914   5.934 -17.857
  431    HB3  PRO  60           2HB      PRO  60  35.707   6.787 -18.826
  432    HG2  PRO  60           1HG      PRO  60  35.479   5.696 -16.047
  433    HG3  PRO  60           2HG      PRO  60  34.912   7.248 -16.690
  434    HD2  PRO  60           1HD      PRO  60  33.261   5.134 -16.318
  435    HD3  PRO  60           2HD      PRO  60  33.023   6.315 -17.623
  436    H    SER  61           H        SER  61  34.763   2.726 -17.189
  437    HA   SER  61           HA       SER  61  35.788   0.926 -16.249
  438    HB2  SER  61           1HB      SER  61  37.432   1.187 -18.771
  439    HB3  SER  61           2HB      SER  61  37.626  -0.145 -17.633
  440    HG   SER  61           HG       SER  61  35.085   0.491 -18.663
  441    H    SER  62           H        SER  62  36.564   3.465 -15.309
  442    HA   SER  62           HA       SER  62  39.444   3.422 -14.968
  443    HB2  SER  62           1HB      SER  62  39.201   5.531 -13.882
  444    HB3  SER  62           2HB      SER  62  38.073   5.545 -15.238
  445    HG   SER  62           HG       SER  62  36.948   6.271 -13.487
  446    H    GLY  63           H        GLY  63  40.377   3.614 -12.759
  447    HA2  GLY  63           1HA      GLY  63  39.451   1.432 -11.141
  448    HA3  GLY  63           2HA      GLY  63  40.835   2.464 -10.808
  Start of MODEL    4
    1    H1   GLY   1           H        GLY   1 -23.243 -20.364 -12.110
    2    HA2  GLY   1           1HA      GLY   1 -21.857 -22.520 -12.316
    3    HA3  GLY   1           2HA      GLY   1 -21.141 -21.691 -13.690
    4    H    SER   2           H        SER   2 -21.760 -21.273 -10.213
    5    HA   SER   2           HA       SER   2 -20.621 -20.098  -8.613
    6    HB2  SER   2           1HB      SER   2 -18.601 -21.706 -10.103
    7    HB3  SER   2           2HB      SER   2 -18.009 -20.535  -8.926
    8    HG   SER   2           HG       SER   2 -19.774 -21.642  -7.563
    9    H    SER   3           H        SER   3 -21.386 -18.436 -10.693
   10    HA   SER   3           HA       SER   3 -19.064 -16.756 -11.281
   11    HB2  SER   3           1HB      SER   3 -20.882 -17.444 -13.009
   12    HB3  SER   3           2HB      SER   3 -21.860 -16.196 -12.237
   13    HG   SER   3           HG       SER   3 -19.481 -15.944 -13.709
   14    H    GLY   4           H        GLY   4 -18.707 -15.868  -9.223
   15    HA2  GLY   4           1HA      GLY   4 -18.862 -13.978  -7.871
   16    HA3  GLY   4           2HA      GLY   4 -20.392 -13.584  -8.640
   17    H    SER   5           H        SER   5 -18.954 -14.637  -5.831
   18    HA   SER   5           HA       SER   5 -21.500 -15.751  -4.848
   19    HB2  SER   5           1HB      SER   5 -18.680 -16.417  -3.971
   20    HB3  SER   5           2HB      SER   5 -20.140 -17.003  -3.174
   21    HG   SER   5           HG       SER   5 -20.584 -17.658  -5.574
   22    H    SER   6           H        SER   6 -21.324 -13.080  -4.832
   23    HA   SER   6           HA       SER   6 -21.467 -11.227  -3.520
   24    HB2  SER   6           1HB      SER   6 -21.965 -13.462  -1.596
   25    HB3  SER   6           2HB      SER   6 -21.772 -11.827  -0.964
   26    HG   SER   6           HG       SER   6 -23.810 -11.658  -1.458
   27    H    GLY   7           H        GLY   7 -18.895 -11.921  -4.248
   28    HA2  GLY   7           1HA      GLY   7 -17.301 -11.462  -1.811
   29    HA3  GLY   7           2HA      GLY   7 -16.682 -12.134  -3.312
   30    H    ARG   8           H        ARG   8 -15.917  -9.754  -1.619
   31    HA   ARG   8           HA       ARG   8 -16.538  -7.361  -2.908
   32    HB2  ARG   8           1HB      ARG   8 -15.439  -7.404  -0.742
   33    HB3  ARG   8           2HB      ARG   8 -14.014  -8.156  -1.447
   34    HG2  ARG   8           1HG      ARG   8 -13.413  -5.926  -1.212
   35    HG3  ARG   8           2HG      ARG   8 -13.870  -6.059  -2.911
   36    HD2  ARG   8           1HD      ARG   8 -15.869  -4.924  -2.594
   37    HD3  ARG   8           2HD      ARG   8 -15.894  -5.253  -0.862
   38    HE   ARG   8           HE       ARG   8 -13.706  -3.691  -1.165
   39   HH11  ARG   8          2HH1      ARG   8 -17.031  -3.372  -2.145
   40   HH12  ARG   8          1HH1      ARG   8 -17.028  -1.642  -2.053
   41   HH21  ARG   8          2HH2      ARG   8 -13.689  -1.414  -1.041
   42   HH22  ARG   8          1HH2      ARG   8 -15.126  -0.529  -1.426
   43    H    LYS   9           H        LYS   9 -15.748  -6.299  -4.655
   44    HA   LYS   9           HA       LYS   9 -14.514  -7.780  -6.717
   45    HB2  LYS   9           1HB      LYS   9 -15.324  -4.947  -6.314
   46    HB3  LYS   9           2HB      LYS   9 -14.166  -5.279  -7.595
   47    HG2  LYS   9           1HG      LYS   9 -15.694  -6.738  -8.700
   48    HG3  LYS   9           2HG      LYS   9 -16.818  -6.677  -7.340
   49    HD2  LYS   9           1HD      LYS   9 -17.779  -5.182  -8.815
   50    HD3  LYS   9           2HD      LYS   9 -16.806  -4.112  -7.802
   51    HE2  LYS   9           1HE      LYS   9 -14.978  -4.356  -9.532
   52    HE3  LYS   9           2HE      LYS   9 -16.178  -5.134 -10.563
   53    HZ1  LYS   9           1HZ      LYS   9 -17.271  -3.197 -10.914
   54    HZ2  LYS   9           2HZ      LYS   9 -15.732  -2.550 -10.642
   55    HZ3  LYS   9           3HZ      LYS   9 -16.881  -2.550  -9.400
   56    H    ILE  10           H        ILE  10 -12.438  -7.947  -7.382
   57    HA   ILE  10           HA       ILE  10 -10.387  -6.958  -5.569
   58    HB   ILE  10           HB       ILE  10  -9.907  -8.658  -8.004
   59   HG12  ILE  10          1HG1      ILE  10  -9.949 -10.491  -6.049
   60   HG13  ILE  10          2HG1      ILE  10 -11.148  -9.379  -5.399
   61   HG21  ILE  10          1HG2      ILE  10  -8.392  -8.983  -5.489
   62   HG22  ILE  10          2HG2      ILE  10  -7.841  -9.032  -7.163
   63   HG23  ILE  10          3HG2      ILE  10  -8.135  -7.481  -6.377
   64   HD11  ILE  10          1HD1      ILE  10 -12.612 -10.492  -6.642
   65   HD12  ILE  10          2HD1      ILE  10 -11.909  -9.647  -8.022
   66   HD13  ILE  10          3HD1      ILE  10 -11.345 -11.263  -7.595
   67    H    PHE  11           H        PHE  11 -11.236  -4.759  -6.605
   68    HA   PHE  11           HA       PHE  11  -9.509  -4.138  -8.908
   69    HB2  PHE  11           1HB      PHE  11 -11.043  -2.559  -9.639
   70    HB3  PHE  11           2HB      PHE  11 -12.102  -3.795  -8.969
   71    HD1  PHE  11           1HD      PHE  11 -12.945  -3.473  -6.590
   72    HD2  PHE  11           2HD      PHE  11 -11.136  -0.367  -8.868
   73    HE1  PHE  11           1HE      PHE  11 -13.966  -1.796  -5.108
   74    HE2  PHE  11           2HE      PHE  11 -12.153   1.316  -7.389
   75    HZ   PHE  11           HZ       PHE  11 -13.570   0.602  -5.505
   76    H    THR  12           H        THR  12  -8.693  -4.254  -6.097
   77    HA   THR  12           HA       THR  12  -7.916  -1.433  -5.729
   78    HB   THR  12           HB       THR  12  -7.640  -2.017  -3.287
   79    HG1  THR  12           1HG      THR  12  -9.344  -3.952  -3.022
   80   HG21  THR  12          1HG2      THR  12  -9.681  -0.894  -4.436
   81   HG22  THR  12          2HG2      THR  12  -9.839  -1.467  -2.776
   82   HG23  THR  12          3HG2      THR  12 -10.493  -2.423  -4.106
   83    H    ASN  13           H        ASN  13  -5.807  -1.013  -5.814
   84    HA   ASN  13           HA       ASN  13  -3.935  -3.209  -6.085
   85    HB2  ASN  13           1HB      ASN  13  -2.307  -1.197  -6.396
   86    HB3  ASN  13           2HB      ASN  13  -3.484  -1.552  -7.657
   87   HD21  ASN  13          1HD2      ASN  13  -5.487  -0.312  -7.624
   88   HD22  ASN  13          2HD2      ASN  13  -5.444   1.324  -7.070
   89    H    LYS  14           H        LYS  14  -2.116  -3.544  -4.788
   90    HA   LYS  14           HA       LYS  14  -2.363  -2.446  -2.073
   91    HB2  LYS  14           1HB      LYS  14  -2.526  -4.880  -2.222
   92    HB3  LYS  14           2HB      LYS  14  -0.976  -4.949  -3.050
   93    HG2  LYS  14           1HG      LYS  14  -0.127  -3.727  -0.888
   94    HG3  LYS  14           2HG      LYS  14  -1.576  -4.446  -0.181
   95    HD2  LYS  14           1HD      LYS  14  -0.846  -6.644  -0.713
   96    HD3  LYS  14           2HD      LYS  14   0.455  -6.035  -1.739
   97    HE2  LYS  14           1HE      LYS  14   1.637  -6.537   0.154
   98    HE3  LYS  14           2HE      LYS  14   1.211  -4.860   0.492
   99    HZ1  LYS  14           1HZ      LYS  14  -0.743  -6.797   1.370
  100    HZ2  LYS  14           2HZ      LYS  14  -0.110  -5.454   2.180
  101    HZ3  LYS  14           3HZ      LYS  14   0.750  -6.911   2.158
  102    H    CYS  15           H        CYS  15  -0.968  -0.924  -1.508
  103    HA   CYS  15           HA       CYS  15   1.103   0.064  -3.018
  104    HB2  CYS  15           1HB      CYS  15   0.154   1.240  -1.083
  105    HB3  CYS  15           2HB      CYS  15   0.895   0.065   0.000
  106    H    GLU  16           H        GLU  16   3.274  -0.295  -3.213
  107    HA   GLU  16           HA       GLU  16   4.222  -2.885  -2.259
  108    HB2  GLU  16           1HB      GLU  16   5.362  -0.950  -4.281
  109    HB3  GLU  16           2HB      GLU  16   6.119  -2.473  -3.836
  110    HG2  GLU  16           1HG      GLU  16   3.733  -3.418  -4.491
  111    HG3  GLU  16           2HG      GLU  16   3.708  -1.957  -5.476
  112    H    ARG  17           H        ARG  17   3.991  -0.378  -0.593
  113    HA   ARG  17           HA       ARG  17   6.773   0.192   0.049
  114    HB2  ARG  17           1HB      ARG  17   5.109   2.027  -0.034
  115    HB3  ARG  17           2HB      ARG  17   4.242   1.274   1.298
  116    HG2  ARG  17           1HG      ARG  17   5.455   2.787   2.469
  117    HG3  ARG  17           2HG      ARG  17   6.616   1.457   2.457
  118    HD2  ARG  17           1HD      ARG  17   7.899   2.446   0.763
  119    HD3  ARG  17           2HD      ARG  17   6.603   3.552   0.310
  120    HE   ARG  17           HE       ARG  17   7.217   4.956   2.040
  121   HH11  ARG  17          2HH1      ARG  17   8.971   1.954   2.231
  122   HH12  ARG  17          1HH1      ARG  17  10.095   2.535   3.414
  123   HH21  ARG  17          2HH2      ARG  17   8.692   5.732   3.598
  124   HH22  ARG  17          1HH2      ARG  17   9.935   4.684   4.192
  125    H    ALA  18           H        ALA  18   7.722  -0.218   2.054
  126    HA   ALA  18           HA       ALA  18   7.102  -2.668   3.259
  127    HB1  ALA  18           1HB      ALA  18   9.130  -2.389   4.110
  128    HB2  ALA  18           2HB      ALA  18   9.162  -0.760   3.434
  129    HB3  ALA  18           3HB      ALA  18   8.575  -1.021   5.076
  130    H    GLY  19           H        GLY  19   6.043  -3.237   5.123
  131    HA2  GLY  19           1HA      GLY  19   4.285  -3.085   6.613
  132    HA3  GLY  19           2HA      GLY  19   5.236  -1.751   7.248
  133    H    CYS  20           H        CYS  20   3.564  -1.960   4.135
  134    HA   CYS  20           HA       CYS  20   1.702   0.122   5.053
  135    HB2  CYS  20           1HB      CYS  20   3.691   0.961   3.628
  136    HB3  CYS  20           2HB      CYS  20   2.873   0.172   2.283
  137    H    ARG  21           H        ARG  21  -0.165  -0.984   5.081
  138    HA   ARG  21           HA       ARG  21  -0.819  -2.724   2.813
  139    HB2  ARG  21           1HB      ARG  21  -1.897  -2.492   5.611
  140    HB3  ARG  21           2HB      ARG  21  -2.786  -3.349   4.359
  141    HG2  ARG  21           1HG      ARG  21  -1.263  -5.056   4.249
  142    HG3  ARG  21           2HG      ARG  21   0.067  -4.052   4.830
  143    HD2  ARG  21           1HD      ARG  21  -0.388  -5.471   6.624
  144    HD3  ARG  21           2HD      ARG  21  -1.218  -3.975   7.046
  145    HE   ARG  21           HE       ARG  21  -3.054  -5.557   5.705
  146   HH11  ARG  21          2HH1      ARG  21  -1.180  -5.701   8.635
  147   HH12  ARG  21          1HH1      ARG  21  -2.339  -6.670   9.484
  148   HH21  ARG  21          2HH2      ARG  21  -4.588  -6.832   6.811
  149   HH22  ARG  21          1HH2      ARG  21  -4.277  -7.313   8.445
  150    H    GLN  22           H        GLN  22  -0.864   0.011   2.299
  151    HA   GLN  22           HA       GLN  22  -3.576   0.973   2.527
  152    HB2  GLN  22           1HB      GLN  22  -1.044   2.043   1.328
  153    HB3  GLN  22           2HB      GLN  22  -2.587   2.791   0.940
  154    HG2  GLN  22           1HG      GLN  22  -1.174   3.733   2.880
  155    HG3  GLN  22           2HG      GLN  22  -2.915   3.552   3.088
  156   HE21  GLN  22          1HE2      GLN  22  -3.352   2.927   5.069
  157   HE22  GLN  22          2HE2      GLN  22  -2.487   1.743   5.982
  158    H    ARG  23           H        ARG  23  -5.160   0.434   1.193
  159    HA   ARG  23           HA       ARG  23  -4.472  -0.589  -1.476
  160    HB2  ARG  23           1HB      ARG  23  -6.749  -1.119   0.400
  161    HB3  ARG  23           2HB      ARG  23  -6.952  -1.396  -1.324
  162    HG2  ARG  23           1HG      ARG  23  -6.276  -3.468  -0.692
  163    HG3  ARG  23           2HG      ARG  23  -4.699  -2.742  -1.008
  164    HD2  ARG  23           1HD      ARG  23  -4.836  -2.055   1.508
  165    HD3  ARG  23           2HD      ARG  23  -6.021  -3.357   1.599
  166    HE   ARG  23           HE       ARG  23  -3.526  -4.087   0.349
  167   HH11  ARG  23          2HH1      ARG  23  -5.314  -3.864   3.327
  168   HH12  ARG  23          1HH1      ARG  23  -4.359  -5.058   4.142
  169   HH21  ARG  23          2HH2      ARG  23  -2.261  -5.661   1.411
  170   HH22  ARG  23          1HH2      ARG  23  -2.622  -6.078   3.051
  171    H    GLU  24           H        GLU  24  -4.270   1.486  -2.425
  172    HA   GLU  24           HA       GLU  24  -6.286   3.462  -2.315
  173    HB2  GLU  24           1HB      GLU  24  -3.881   2.958  -3.990
  174    HB3  GLU  24           2HB      GLU  24  -5.084   4.071  -4.624
  175    HG2  GLU  24           1HG      GLU  24  -3.980   4.370  -1.857
  176    HG3  GLU  24           2HG      GLU  24  -3.152   5.034  -3.264
  177    H    MET  25           H        MET  25  -8.072   3.816  -3.521
  178    HA   MET  25           HA       MET  25  -9.280   1.682  -4.894
  179    HB2  MET  25           1HB      MET  25  -9.906   4.631  -4.805
  180    HB3  MET  25           2HB      MET  25 -10.909   3.472  -5.668
  181    HG2  MET  25           1HG      MET  25 -10.909   2.228  -3.364
  182    HG3  MET  25           2HG      MET  25 -10.506   3.827  -2.743
  183    HE1  MET  25           1HE      MET  25 -13.441   5.427  -2.101
  184    HE2  MET  25           2HE      MET  25 -13.547   3.811  -1.403
  185    HE3  MET  25           3HE      MET  25 -11.982   4.613  -1.536
  186    H    MET  26           H        MET  26  -7.526   4.526  -6.040
  187    HA   MET  26           HA       MET  26  -7.804   3.583  -8.802
  188    HB2  MET  26           1HB      MET  26  -7.141   5.763  -9.504
  189    HB3  MET  26           2HB      MET  26  -8.327   5.974  -8.223
  190    HG2  MET  26           1HG      MET  26  -6.395   6.261  -6.637
  191    HG3  MET  26           2HG      MET  26  -5.350   6.323  -8.054
  192    HE1  MET  26           1HE      MET  26  -5.118  10.045  -7.728
  193    HE2  MET  26           2HE      MET  26  -4.811   8.796  -6.521
  194    HE3  MET  26           3HE      MET  26  -4.359   8.526  -8.205
  195    H    LYS  27           H        LYS  27  -6.159   2.682  -9.872
  196    HA   LYS  27           HA       LYS  27  -3.843   1.801  -8.605
  197    HB2  LYS  27           1HB      LYS  27  -5.003   1.153 -10.905
  198    HB3  LYS  27           2HB      LYS  27  -3.791   2.250 -11.553
  199    HG2  LYS  27           1HG      LYS  27  -2.627   0.310 -11.677
  200    HG3  LYS  27           2HG      LYS  27  -2.189   0.789 -10.035
  201    HD2  LYS  27           1HD      LYS  27  -2.796  -1.476  -9.869
  202    HD3  LYS  27           2HD      LYS  27  -4.199  -0.583  -9.275
  203    HE2  LYS  27           1HE      LYS  27  -5.045  -2.266 -10.703
  204    HE3  LYS  27           2HE      LYS  27  -5.140  -0.758 -11.612
  205    HZ1  LYS  27           1HZ      LYS  27  -2.714  -1.664 -12.304
  206    HZ2  LYS  27           2HZ      LYS  27  -4.123  -1.943 -13.196
  207    HZ3  LYS  27           3HZ      LYS  27  -3.556  -3.120 -12.121
  208    H    LEU  28           H        LEU  28  -1.864   2.633  -8.272
  209    HA   LEU  28           HA       LEU  28  -1.146   5.140  -9.621
  210    HB2  LEU  28           1HB      LEU  28  -0.919   4.573  -6.671
  211    HB3  LEU  28           2HB      LEU  28  -0.184   5.955  -7.481
  212    HG   LEU  28           HG       LEU  28  -3.129   5.569  -7.715
  213   HD11  LEU  28          1HD1      LEU  28  -2.019   7.034  -5.361
  214   HD12  LEU  28          2HD1      LEU  28  -2.297   5.296  -5.267
  215   HD13  LEU  28          3HD1      LEU  28  -3.639   6.385  -5.620
  216   HD21  LEU  28          1HD2      LEU  28  -2.680   7.453  -8.852
  217   HD22  LEU  28          2HD2      LEU  28  -1.132   7.696  -8.043
  218   HD23  LEU  28          3HD2      LEU  28  -2.629   8.195  -7.252
  219    H    THR  29           H        THR  29   0.563   4.599 -10.812
  220    HA   THR  29           HA       THR  29   2.643   2.907  -9.589
  221    HB   THR  29           HB       THR  29   2.095   3.315 -12.535
  222    HG1  THR  29           1HG      THR  29   0.505   1.985 -11.846
  223   HG21  THR  29          1HG2      THR  29   4.110   1.683 -11.014
  224   HG22  THR  29          2HG2      THR  29   4.382   2.821 -12.334
  225   HG23  THR  29          3HG2      THR  29   3.626   1.261 -12.656
  226    H    CYS  30           H        CYS  30   4.647   3.702  -9.363
  227    HA   CYS  30           HA       CYS  30   5.186   6.426  -9.568
  228    HB2  CYS  30           1HB      CYS  30   6.421   4.653  -8.201
  229    HB3  CYS  30           2HB      CYS  30   7.314   4.292  -9.675
  230    H    GLU  31           H        GLU  31   6.982   7.407 -10.878
  231    HA   GLU  31           HA       GLU  31   6.674   6.578 -13.680
  232    HB2  GLU  31           1HB      GLU  31   7.205   8.848 -14.293
  233    HB3  GLU  31           2HB      GLU  31   5.940   8.874 -13.073
  234    HG2  GLU  31           1HG      GLU  31   7.294   9.788 -11.482
  235    HG3  GLU  31           2HG      GLU  31   8.761   9.101 -12.177
  236    H    ARG  32           H        ARG  32   8.874   6.566 -11.139
  237    HA   ARG  32           HA       ARG  32  11.204   6.596 -12.920
  238    HB2  ARG  32           1HB      ARG  32  11.009   6.661  -9.904
  239    HB3  ARG  32           2HB      ARG  32  12.520   6.632 -10.803
  240    HG2  ARG  32           1HG      ARG  32  12.122   8.778 -11.721
  241    HG3  ARG  32           2HG      ARG  32  10.450   8.781 -11.154
  242    HD2  ARG  32           1HD      ARG  32  11.352   8.675  -8.812
  243    HD3  ARG  32           2HD      ARG  32  12.957   8.936  -9.493
  244    HE   ARG  32           HE       ARG  32  11.011  10.911 -10.271
  245   HH11  ARG  32          2HH1      ARG  32  13.381   9.984  -7.895
  246   HH12  ARG  32          1HH1      ARG  32  13.642  11.602  -7.333
  247   HH21  ARG  32          2HH2      ARG  32  11.346  13.046  -9.541
  248   HH22  ARG  32          1HH2      ARG  32  12.484  13.343  -8.270
  249    H    CYS  33           H        CYS  33   9.943   4.664 -10.197
  250    HA   CYS  33           HA       CYS  33  11.524   2.382 -11.067
  251    HB2  CYS  33           1HB      CYS  33  10.572   1.307  -9.001
  252    HB3  CYS  33           2HB      CYS  33  11.515   2.764  -8.703
  253    H    SER  34           H        SER  34   8.322   3.586 -11.330
  254    HA   SER  34           HA       SER  34   6.466   2.807 -12.393
  255    HB2  SER  34           1HB      SER  34   8.090   2.162 -14.165
  256    HB3  SER  34           2HB      SER  34   8.269   0.588 -13.390
  257    HG   SER  34           HG       SER  34   5.685   1.439 -13.995
  258    H    ARG  35           H        ARG  35   6.706   2.175  -9.740
  259    HA   ARG  35           HA       ARG  35   5.591  -0.550  -9.610
  260    HB2  ARG  35           1HB      ARG  35   7.309   0.952  -7.646
  261    HB3  ARG  35           2HB      ARG  35   6.330  -0.424  -7.156
  262    HG2  ARG  35           1HG      ARG  35   7.510  -1.817  -8.812
  263    HG3  ARG  35           2HG      ARG  35   8.531  -0.434  -9.210
  264    HD2  ARG  35           1HD      ARG  35   9.457  -0.392  -7.011
  265    HD3  ARG  35           2HD      ARG  35   8.286  -1.578  -6.436
  266    HE   ARG  35           HE       ARG  35   9.982  -2.497  -8.583
  267   HH11  ARG  35          2HH1      ARG  35   9.565  -2.215  -5.138
  268   HH12  ARG  35          1HH1      ARG  35  10.640  -3.523  -4.770
  269   HH21  ARG  35          2HH2      ARG  35  11.399  -4.221  -8.110
  270   HH22  ARG  35          1HH2      ARG  35  11.683  -4.663  -6.461
  271    H    ASN  36           H        ASN  36   3.874  -0.903  -8.105
  272    HA   ASN  36           HA       ASN  36   2.008   1.263  -8.023
  273    HB2  ASN  36           1HB      ASN  36   1.533  -1.271  -8.271
  274    HB3  ASN  36           2HB      ASN  36   1.673  -1.318  -6.516
  275   HD21  ASN  36          1HD2      ASN  36   0.220   0.003  -5.276
  276   HD22  ASN  36          2HD2      ASN  36  -1.341   0.386  -5.907
  277    H    PHE  37           H        PHE  37   1.237   2.399  -6.269
  278    HA   PHE  37           HA       PHE  37   2.158   1.862  -3.600
  279    HB2  PHE  37           1HB      PHE  37   3.095   4.382  -4.987
  280    HB3  PHE  37           2HB      PHE  37   3.325   4.001  -3.284
  281    HD1  PHE  37           2HD      PHE  37   4.548   1.713  -2.828
  282    HD2  PHE  37           1HD      PHE  37   4.796   3.924  -6.457
  283    HE1  PHE  37           2HE      PHE  37   6.666   0.584  -3.367
  284    HE2  PHE  37           1HE      PHE  37   6.915   2.797  -7.002
  285    HZ   PHE  37           HZ       PHE  37   7.853   1.126  -5.456
  286    H    CYS  38           H        CYS  38   1.446   3.746  -2.108
  287    HA   CYS  38           HA       CYS  38  -1.295   4.420  -2.877
  288    HB2  CYS  38           1HB      CYS  38  -1.711   4.765  -0.518
  289    HB3  CYS  38           2HB      CYS  38  -0.892   3.221  -0.734
  290    H    ILE  39           H        ILE  39  -2.138   6.517  -2.654
  291    HA   ILE  39           HA       ILE  39  -0.842   8.616  -3.695
  292    HB   ILE  39           HB       ILE  39  -2.906   8.661  -1.503
  293   HG12  ILE  39          1HG1      ILE  39  -3.070   9.292  -4.458
  294   HG13  ILE  39          2HG1      ILE  39  -3.556   7.768  -3.724
  295   HG21  ILE  39          1HG2      ILE  39  -3.224  11.028  -1.923
  296   HG22  ILE  39          2HG2      ILE  39  -1.571  10.721  -1.393
  297   HG23  ILE  39          3HG2      ILE  39  -1.909  11.018  -3.098
  298   HD11  ILE  39          1HD1      ILE  39  -4.846   9.964  -2.404
  299   HD12  ILE  39          2HD1      ILE  39  -5.124  10.032  -4.145
  300   HD13  ILE  39          3HD1      ILE  39  -5.553   8.581  -3.240
  301    H    LYS  40           H        LYS  40  -0.656   7.619  -0.319
  302    HA   LYS  40           HA       LYS  40   0.814   9.846   0.617
  303    HB2  LYS  40           1HB      LYS  40   0.210   7.109   1.619
  304    HB3  LYS  40           2HB      LYS  40   1.557   7.964   2.360
  305    HG2  LYS  40           1HG      LYS  40  -0.144   8.599   3.737
  306    HG3  LYS  40           2HG      LYS  40  -0.194   9.908   2.554
  307    HD2  LYS  40           1HD      LYS  40  -2.435   9.219   2.855
  308    HD3  LYS  40           2HD      LYS  40  -1.923   8.534   1.311
  309    HE2  LYS  40           1HE      LYS  40  -2.894   6.688   2.228
  310    HE3  LYS  40           2HE      LYS  40  -1.260   6.490   2.860
  311    HZ1  LYS  40           1HZ      LYS  40  -2.936   8.113   4.533
  312    HZ2  LYS  40           2HZ      LYS  40  -1.962   6.791   4.938
  313    HZ3  LYS  40           3HZ      LYS  40  -3.525   6.538   4.344
  314    H    HIS  41           H        HIS  41   1.794   6.678  -0.626
  315    HA   HIS  41           HA       HIS  41   4.591   7.586  -0.602
  316    HB2  HIS  41           1HB      HIS  41   3.469   4.785  -0.824
  317    HB3  HIS  41           2HB      HIS  41   5.182   5.197  -0.835
  318    HD2  HIS  41           2HD      HIS  41   5.104   7.251   1.772
  319    HE1  HIS  41           1HE      HIS  41   3.664   3.820   3.810
  320    HE2  HIS  41           2HE      HIS  41   4.618   6.138   4.055
  321    H    ARG  42           H        ARG  42   2.308   8.058  -2.600
  322    HA   ARG  42           HA       ARG  42   3.036   6.690  -4.986
  323    HB2  ARG  42           1HB      ARG  42   0.865   7.481  -5.069
  324    HB3  ARG  42           2HB      ARG  42   1.283   9.013  -4.314
  325    HG2  ARG  42           1HG      ARG  42   0.700   9.413  -6.597
  326    HG3  ARG  42           2HG      ARG  42   2.435   9.673  -6.406
  327    HD2  ARG  42           1HD      ARG  42   2.496   7.104  -7.088
  328    HD3  ARG  42           2HD      ARG  42   0.974   7.541  -7.865
  329    HE   ARG  42           HE       ARG  42   3.636   8.456  -8.589
  330   HH11  ARG  42          2HH1      ARG  42   0.193   8.783  -8.991
  331   HH12  ARG  42          1HH1      ARG  42   0.317   9.607 -10.510
  332   HH21  ARG  42          2HH2      ARG  42   3.812   9.539 -10.589
  333   HH22  ARG  42          1HH2      ARG  42   2.376  10.035 -11.419
  334    H    HIS  43           H        HIS  43   4.042   9.674  -3.467
  335    HA   HIS  43           HA       HIS  43   5.477  10.624  -5.779
  336    HB2  HIS  43           1HB      HIS  43   4.436  11.931  -3.696
  337    HB3  HIS  43           2HB      HIS  43   6.063  11.695  -3.063
  338    HD1  HIS  43           1HD      HIS  43   7.983  12.976  -4.218
  339    HD2  HIS  43           2HD      HIS  43   4.231  13.721  -5.841
  340    HE1  HIS  43           1HE      HIS  43   8.279  14.983  -5.703
  341    HA   PRO  44           HA       PRO  44   9.211   8.381  -5.123
  342    HB2  PRO  44           1HB      PRO  44  10.907   9.992  -6.500
  343    HB3  PRO  44           2HB      PRO  44   9.738   8.928  -7.291
  344    HG2  PRO  44           1HG      PRO  44   9.553  11.864  -6.734
  345    HG3  PRO  44           2HG      PRO  44   9.105  10.973  -8.200
  346    HD2  PRO  44           1HD      PRO  44   7.280  11.775  -6.368
  347    HD3  PRO  44           2HD      PRO  44   7.088  10.289  -7.320
  348    H    LEU  45           H        LEU  45   8.435  11.159  -3.575
  349    HA   LEU  45           HA       LEU  45  11.097  11.534  -2.391
  350    HB2  LEU  45           1HB      LEU  45   8.639  13.260  -2.464
  351    HB3  LEU  45           2HB      LEU  45   9.980  13.582  -1.366
  352    HG   LEU  45           HG       LEU  45  10.218  13.502  -4.372
  353   HD11  LEU  45          1HD1      LEU  45  10.114  15.839  -4.408
  354   HD12  LEU  45          2HD1      LEU  45  10.261  15.962  -2.655
  355   HD13  LEU  45          3HD1      LEU  45   8.771  15.351  -3.374
  356   HD21  LEU  45          1HD2      LEU  45  12.317  14.908  -3.579
  357   HD22  LEU  45          2HD2      LEU  45  12.360  13.148  -3.681
  358   HD23  LEU  45          3HD2      LEU  45  12.108  13.936  -2.123
  359    H    ASP  46           H        ASP  46   7.885  10.432  -1.743
  360    HA   ASP  46           HA       ASP  46   8.477  10.222   1.128
  361    HB2  ASP  46           1HB      ASP  46   5.908  10.204  -0.438
  362    HB3  ASP  46           2HB      ASP  46   5.974   9.593   1.213
  363    H    HIS  47           H        HIS  47   9.480   8.475  -1.106
  364    HA   HIS  47           HA       HIS  47   9.090   5.973   0.247
  365    HB2  HIS  47           1HB      HIS  47   7.870   4.789  -1.304
  366    HB3  HIS  47           2HB      HIS  47   7.131   6.377  -1.483
  367    HD1  HIS  47           1HD      HIS  47   6.812   6.978  -3.847
  368    HD2  HIS  47           2HD      HIS  47  10.185   4.613  -3.311
  369    HE1  HIS  47           1HE      HIS  47   7.785   6.663  -6.145
  370    H    ASP  48           H        ASP  48  10.875   4.762   0.071
  371    HA   ASP  48           HA       ASP  48  13.202   5.706  -1.116
  372    HB2  ASP  48           1HB      ASP  48  13.260   4.061   0.669
  373    HB3  ASP  48           2HB      ASP  48  12.462   2.873  -0.357
  374    H    CYS  49           H        CYS  49  12.743   6.304  -3.260
  375    HA   CYS  49           HA       CYS  49  11.790   4.415  -5.184
  376    HB2  CYS  49           1HB      CYS  49  11.627   6.993  -5.249
  377    HB3  CYS  49           2HB      CYS  49  13.276   6.941  -5.862
  378    H    SER  50           H        SER  50  12.909   3.264  -6.711
  379    HA   SER  50           HA       SER  50  15.807   3.049  -6.260
  380    HB2  SER  50           1HB      SER  50  15.549   0.809  -7.398
  381    HB3  SER  50           2HB      SER  50  14.710   0.956  -5.854
  382    HG   SER  50           HG       SER  50  13.687   0.723  -8.426
  383    H    GLY  51           H        GLY  51  13.402   2.909  -8.890
  384    HA2  GLY  51           1HA      GLY  51  13.614   3.332 -11.143
  385    HA3  GLY  51           2HA      GLY  51  14.549   4.716 -10.597
  386    H    GLU  52           H        GLU  52  14.817   1.267 -11.378
  387    HA   GLU  52           HA       GLU  52  17.684   1.590 -11.835
  388    HB2  GLU  52           1HB      GLU  52  17.736  -0.844 -12.045
  389    HB3  GLU  52           2HB      GLU  52  16.947  -0.362 -10.550
  390    HG2  GLU  52           1HG      GLU  52  15.297  -0.905 -12.972
  391    HG3  GLU  52           2HG      GLU  52  15.935  -2.249 -12.026
  392    H    GLY  53           H        GLY  53  14.691   1.191 -13.555
  393    HA2  GLY  53           1HA      GLY  53  14.263   0.792 -15.810
  394    HA3  GLY  53           2HA      GLY  53  15.318   2.191 -15.945
  395    H    HIS  54           H        HIS  54  16.745   1.883 -17.511
  396    HA   HIS  54           HA       HIS  54  18.406  -0.498 -17.477
  397    HB2  HIS  54           1HB      HIS  54  17.921  -1.273 -19.624
  398    HB3  HIS  54           2HB      HIS  54  16.330  -0.862 -18.990
  399    HD1  HIS  54           1HD      HIS  54  15.519   1.676 -19.727
  400    HD2  HIS  54           2HD      HIS  54  18.427  -0.178 -22.044
  401    HE1  HIS  54           1HE      HIS  54  15.508   2.899 -21.925
  402    HA   PRO  55           HA       PRO  55  21.313   2.722 -18.404
  403    HB2  PRO  55           1HB      PRO  55  23.488   1.116 -18.648
  404    HB3  PRO  55           2HB      PRO  55  22.785   1.550 -17.085
  405    HG2  PRO  55           1HG      PRO  55  22.435  -0.952 -18.691
  406    HG3  PRO  55           2HG      PRO  55  22.685  -0.769 -16.945
  407    HD2  PRO  55           1HD      PRO  55  20.244  -1.216 -18.028
  408    HD3  PRO  55           2HD      PRO  55  20.472  -0.252 -16.555
  409    H    THR  56           H        THR  56  21.481  -0.306 -20.284
  410    HA   THR  56           HA       THR  56  22.881   0.381 -22.469
  411    HB   THR  56           HB       THR  56  20.209  -1.021 -22.663
  412    HG1  THR  56           1HG      THR  56  22.709  -1.823 -21.672
  413   HG21  THR  56          1HG2      THR  56  22.681  -1.449 -24.332
  414   HG22  THR  56          2HG2      THR  56  21.401  -0.326 -24.792
  415   HG23  THR  56          3HG2      THR  56  21.048  -2.045 -24.629
  416    H    SER  57           H        SER  57  22.897   2.164 -23.660
  417    HA   SER  57           HA       SER  57  20.483   3.744 -23.990
  418    HB2  SER  57           1HB      SER  57  22.003   5.370 -25.105
  419    HB3  SER  57           2HB      SER  57  22.542   4.934 -23.483
  420    HG   SER  57           HG       SER  57  24.069   3.563 -24.397
  421    H    SER  58           H        SER  58  20.302   1.260 -25.229
  422    HA   SER  58           HA       SER  58  20.989   1.367 -27.986
  423    HB2  SER  58           1HB      SER  58  19.705  -0.649 -28.218
  424    HB3  SER  58           2HB      SER  58  20.538  -0.735 -26.666
  425    HG   SER  58           HG       SER  58  18.677  -0.532 -25.633
  426    H    GLY  59           H        GLY  59  19.156   1.049 -29.671
  427    HA2  GLY  59           1HA      GLY  59  17.148   1.760 -30.626
  428    HA3  GLY  59           2HA      GLY  59  16.775   2.624 -29.141
  429    HA   PRO  60           HA       PRO  60  18.815   5.331 -32.589
  430    HB2  PRO  60           1HB      PRO  60  16.704   5.930 -34.187
  431    HB3  PRO  60           2HB      PRO  60  17.789   4.569 -34.498
  432    HG2  PRO  60           1HG      PRO  60  15.087   4.582 -33.208
  433    HG3  PRO  60           2HG      PRO  60  15.752   3.450 -34.401
  434    HD2  PRO  60           1HD      PRO  60  15.638   2.879 -31.756
  435    HD3  PRO  60           2HD      PRO  60  16.930   2.270 -32.810
  436    H    SER  61           H        SER  61  16.401   5.371 -30.310
  437    HA   SER  61           HA       SER  61  15.748   8.199 -30.622
  438    HB2  SER  61           1HB      SER  61  14.152   7.824 -28.791
  439    HB3  SER  61           2HB      SER  61  13.923   6.641 -30.078
  440    HG   SER  61           HG       SER  61  14.009   5.884 -27.781
  441    H    SER  62           H        SER  62  16.611   9.783 -29.428
  442    HA   SER  62           HA       SER  62  18.311  10.745 -28.193
  443    HB2  SER  62           1HB      SER  62  17.833  10.620 -25.813
  444    HB3  SER  62           2HB      SER  62  16.315  10.661 -26.709
  445    HG   SER  62           HG       SER  62  17.541   8.255 -25.857
  446    H    GLY  63           H        GLY  63  19.443   8.635 -29.481
  447    HA2  GLY  63           1HA      GLY  63  20.616   6.632 -27.939
  448    HA3  GLY  63           2HA      GLY  63  21.298   7.286 -29.421
  Start of MODEL    5
    1    H1   GLY   1           H        GLY   1  -2.322 -25.820  -4.190
    2    HA2  GLY   1           1HA      GLY   1  -4.387 -24.508  -5.818
    3    HA3  GLY   1           2HA      GLY   1  -4.373 -26.263  -5.721
    4    H    SER   2           H        SER   2  -5.449 -23.394  -4.293
    5    HA   SER   2           HA       SER   2  -5.926 -24.564  -1.677
    6    HB2  SER   2           1HB      SER   2  -6.631 -21.856  -2.830
    7    HB3  SER   2           2HB      SER   2  -6.967 -22.348  -1.170
    8    HG   SER   2           HG       SER   2  -4.779 -21.259  -2.041
    9    H    SER   3           H        SER   3  -8.256 -23.979  -0.794
   10    HA   SER   3           HA       SER   3 -10.077 -25.541  -2.399
   11    HB2  SER   3           1HB      SER   3  -9.785 -25.604   0.181
   12    HB3  SER   3           2HB      SER   3 -10.820 -24.177   0.176
   13    HG   SER   3           HG       SER   3 -11.442 -26.815  -0.318
   14    H    GLY   4           H        GLY   4  -9.955 -22.228  -1.121
   15    HA2  GLY   4           1HA      GLY   4 -12.161 -21.533  -2.956
   16    HA3  GLY   4           2HA      GLY   4 -11.799 -20.674  -1.466
   17    H    SER   5           H        SER   5 -11.819 -18.751  -2.806
   18    HA   SER   5           HA       SER   5  -9.696 -18.437  -4.749
   19    HB2  SER   5           1HB      SER   5 -11.817 -17.361  -5.217
   20    HB3  SER   5           2HB      SER   5 -11.756 -16.490  -3.685
   21    HG   SER   5           HG       SER   5 -11.070 -15.184  -5.427
   22    H    SER   6           H        SER   6  -7.690 -18.183  -4.019
   23    HA   SER   6           HA       SER   6  -7.207 -16.802  -1.498
   24    HB2  SER   6           1HB      SER   6  -6.074 -19.010  -2.263
   25    HB3  SER   6           2HB      SER   6  -5.059 -17.964  -3.255
   26    HG   SER   6           HG       SER   6  -5.394 -17.776  -0.441
   27    H    GLY   7           H        GLY   7  -6.019 -16.624  -4.859
   28    HA2  GLY   7           1HA      GLY   7  -4.392 -14.512  -4.894
   29    HA3  GLY   7           2HA      GLY   7  -5.630 -14.709  -6.125
   30    H    ARG   8           H        ARG   8  -4.453 -12.275  -4.906
   31    HA   ARG   8           HA       ARG   8  -6.361 -11.071  -3.194
   32    HB2  ARG   8           1HB      ARG   8  -4.122 -10.028  -4.900
   33    HB3  ARG   8           2HB      ARG   8  -5.221  -8.914  -4.097
   34    HG2  ARG   8           1HG      ARG   8  -3.740 -11.062  -2.612
   35    HG3  ARG   8           2HG      ARG   8  -3.063  -9.457  -2.895
   36    HD2  ARG   8           1HD      ARG   8  -4.035  -9.190  -0.823
   37    HD3  ARG   8           2HD      ARG   8  -5.320  -8.631  -1.893
   38    HE   ARG   8           HE       ARG   8  -5.437 -11.433  -1.186
   39   HH11  ARG   8          2HH1      ARG   8  -6.451  -8.191  -0.423
   40   HH12  ARG   8          1HH1      ARG   8  -7.843  -8.698   0.474
   41   HH21  ARG   8          2HH2      ARG   8  -7.267 -12.113  -0.007
   42   HH22  ARG   8          1HH2      ARG   8  -8.306 -10.929   0.712
   43    H    LYS   9           H        LYS   9  -7.327  -8.841  -3.978
   44    HA   LYS   9           HA       LYS   9  -9.020  -9.493  -6.279
   45    HB2  LYS   9           1HB      LYS   9  -9.342  -7.768  -3.861
   46    HB3  LYS   9           2HB      LYS   9 -10.257  -7.367  -5.309
   47    HG2  LYS   9           1HG      LYS   9 -11.685  -8.705  -4.026
   48    HG3  LYS   9           2HG      LYS   9 -11.063  -9.773  -5.286
   49    HD2  LYS   9           1HD      LYS   9  -9.220 -10.265  -3.451
   50    HD3  LYS   9           2HD      LYS   9 -10.511  -9.750  -2.363
   51    HE2  LYS   9           1HE      LYS   9 -11.923 -11.415  -3.872
   52    HE3  LYS   9           2HE      LYS   9 -10.334 -12.139  -4.121
   53    HZ1  LYS   9           1HZ      LYS   9 -10.545 -13.128  -2.169
   54    HZ2  LYS   9           2HZ      LYS   9 -12.035 -12.375  -1.897
   55    HZ3  LYS   9           3HZ      LYS   9 -10.604 -11.624  -1.397
   56    H    ILE  10           H        ILE  10  -8.850  -8.442  -8.151
   57    HA   ILE  10           HA       ILE  10  -6.777  -6.559  -8.597
   58    HB   ILE  10           HB       ILE  10  -7.694  -6.353 -10.869
   59   HG12  ILE  10          1HG1      ILE  10  -9.871  -8.228  -9.925
   60   HG13  ILE  10          2HG1      ILE  10 -10.097  -6.499 -10.171
   61   HG21  ILE  10          1HG2      ILE  10  -7.668  -9.223  -9.952
   62   HG22  ILE  10          2HG2      ILE  10  -7.295  -8.615 -11.564
   63   HG23  ILE  10          3HG2      ILE  10  -6.224  -8.245 -10.213
   64   HD11  ILE  10          1HD1      ILE  10  -9.623  -8.644 -12.195
   65   HD12  ILE  10          2HD1      ILE  10 -10.906  -7.435 -12.123
   66   HD13  ILE  10          3HD1      ILE  10  -9.267  -6.956 -12.562
   67    H    PHE  11           H        PHE  11 -10.242  -6.276  -8.082
   68    HA   PHE  11           HA       PHE  11 -10.918  -3.816  -8.907
   69    HB2  PHE  11           1HB      PHE  11 -11.498  -4.956  -6.166
   70    HB3  PHE  11           2HB      PHE  11 -12.353  -3.596  -6.887
   71    HD1  PHE  11           2HD      PHE  11 -11.663  -7.208  -7.229
   72    HD2  PHE  11           1HD      PHE  11 -14.103  -3.932  -8.423
   73    HE1  PHE  11           2HE      PHE  11 -13.228  -8.771  -8.306
   74    HE2  PHE  11           1HE      PHE  11 -15.673  -5.490  -9.502
   75    HZ   PHE  11           HZ       PHE  11 -15.235  -7.913  -9.445
   76    H    THR  12           H        THR  12  -9.504  -4.303  -5.667
   77    HA   THR  12           HA       THR  12  -8.590  -1.515  -5.720
   78    HB   THR  12           HB       THR  12  -8.339  -3.171  -3.257
   79    HG1  THR  12           1HG      THR  12 -10.560  -3.314  -4.441
   80   HG21  THR  12          1HG2      THR  12  -9.375  -0.364  -3.598
   81   HG22  THR  12          2HG2      THR  12  -7.653  -0.735  -3.509
   82   HG23  THR  12          3HG2      THR  12  -8.709  -1.115  -2.149
   83    H    ASN  13           H        ASN  13  -6.511  -1.057  -6.013
   84    HA   ASN  13           HA       ASN  13  -4.579  -3.117  -6.390
   85    HB2  ASN  13           1HB      ASN  13  -3.881  -0.213  -6.038
   86    HB3  ASN  13           2HB      ASN  13  -3.108  -1.418  -7.064
   87   HD21  ASN  13          1HD2      ASN  13  -5.443   1.027  -6.859
   88   HD22  ASN  13          2HD2      ASN  13  -6.106   0.859  -8.446
   89    H    LYS  14           H        LYS  14  -2.316  -2.731  -5.309
   90    HA   LYS  14           HA       LYS  14  -2.635  -2.204  -2.441
   91    HB2  LYS  14           1HB      LYS  14  -2.851  -4.565  -2.519
   92    HB3  LYS  14           2HB      LYS  14  -1.556  -4.721  -3.699
   93    HG2  LYS  14           1HG      LYS  14  -0.779  -5.468  -1.555
   94    HG3  LYS  14           2HG      LYS  14   0.053  -3.972  -1.986
   95    HD2  LYS  14           1HD      LYS  14  -1.302  -2.697  -0.497
   96    HD3  LYS  14           2HD      LYS  14  -2.390  -4.060  -0.225
   97    HE2  LYS  14           1HE      LYS  14   0.520  -4.269   0.450
   98    HE3  LYS  14           2HE      LYS  14  -0.604  -3.488   1.562
   99    HZ1  LYS  14           1HZ      LYS  14  -0.905  -5.553   2.325
  100    HZ2  LYS  14           2HZ      LYS  14  -0.280  -6.286   0.934
  101    HZ3  LYS  14           3HZ      LYS  14  -1.891  -5.771   0.967
  102    H    CYS  15           H        CYS  15  -1.147  -0.806  -1.795
  103    HA   CYS  15           HA       CYS  15   0.897   0.208  -3.363
  104    HB2  CYS  15           1HB      CYS  15   0.013   1.338  -1.361
  105    HB3  CYS  15           2HB      CYS  15   0.774   0.120  -0.341
  106    H    GLU  16           H        GLU  16   3.102  -0.135  -3.505
  107    HA   GLU  16           HA       GLU  16   3.968  -2.822  -2.770
  108    HB2  GLU  16           1HB      GLU  16   5.097  -0.727  -4.620
  109    HB3  GLU  16           2HB      GLU  16   5.976  -2.193  -4.210
  110    HG2  GLU  16           1HG      GLU  16   3.703  -3.319  -4.976
  111    HG3  GLU  16           2HG      GLU  16   3.576  -1.826  -5.905
  112    H    ARG  17           H        ARG  17   3.751  -0.425  -0.910
  113    HA   ARG  17           HA       ARG  17   6.537  -0.098  -0.099
  114    HB2  ARG  17           1HB      ARG  17   5.206   1.923  -0.159
  115    HB3  ARG  17           2HB      ARG  17   3.990   1.197   0.883
  116    HG2  ARG  17           1HG      ARG  17   5.200   2.591   2.298
  117    HG3  ARG  17           2HG      ARG  17   5.861   0.985   2.612
  118    HD2  ARG  17           1HD      ARG  17   7.120   2.755   0.557
  119    HD3  ARG  17           2HD      ARG  17   7.467   3.002   2.268
  120    HE   ARG  17           HE       ARG  17   7.813   0.295   1.301
  121   HH11  ARG  17          2HH1      ARG  17   9.296   3.373   1.965
  122   HH12  ARG  17          1HH1      ARG  17  10.899   2.726   2.068
  123   HH21  ARG  17          2HH2      ARG  17   9.920  -0.570   1.433
  124   HH22  ARG  17          1HH2      ARG  17  11.253   0.483   1.764
  125    H    ALA  18           H        ALA  18   7.259  -1.817   1.010
  126    HA   ALA  18           HA       ALA  18   6.030  -3.746   2.399
  127    HB1  ALA  18           1HB      ALA  18   8.131  -3.231   4.097
  128    HB2  ALA  18           2HB      ALA  18   8.205  -4.195   2.621
  129    HB3  ALA  18           3HB      ALA  18   8.649  -2.488   2.583
  130    H    GLY  19           H        GLY  19   7.239  -0.857   4.123
  131    HA2  GLY  19           1HA      GLY  19   5.602  -1.407   6.410
  132    HA3  GLY  19           2HA      GLY  19   6.589   0.025   6.155
  133    H    CYS  20           H        CYS  20   3.865  -1.314   4.300
  134    HA   CYS  20           HA       CYS  20   2.247   1.010   5.019
  135    HB2  CYS  20           1HB      CYS  20   3.577   1.432   2.862
  136    HB3  CYS  20           2HB      CYS  20   2.536   0.217   2.127
  137    H    ARG  21           H        ARG  21   0.036   0.675   4.892
  138    HA   ARG  21           HA       ARG  21  -0.855  -1.990   4.033
  139    HB2  ARG  21           1HB      ARG  21  -2.344  -2.097   6.011
  140    HB3  ARG  21           2HB      ARG  21  -0.638  -2.106   6.439
  141    HG2  ARG  21           1HG      ARG  21  -0.969   0.459   6.709
  142    HG3  ARG  21           2HG      ARG  21  -2.677   0.033   6.834
  143    HD2  ARG  21           1HD      ARG  21  -2.364  -1.179   8.784
  144    HD3  ARG  21           2HD      ARG  21  -0.644  -1.418   8.477
  145    HE   ARG  21           HE       ARG  21  -0.208   0.647   9.417
  146   HH11  ARG  21          2HH1      ARG  21  -3.639   0.193   9.036
  147   HH12  ARG  21          1HH1      ARG  21  -4.060   1.560  10.012
  148   HH21  ARG  21          2HH2      ARG  21  -0.750   2.450  10.705
  149   HH22  ARG  21          1HH2      ARG  21  -2.416   2.844  10.961
  150    H    GLN  22           H        GLN  22  -1.020   0.594   2.723
  151    HA   GLN  22           HA       GLN  22  -3.807   1.383   2.966
  152    HB2  GLN  22           1HB      GLN  22  -1.388   2.483   1.641
  153    HB3  GLN  22           2HB      GLN  22  -2.939   2.858   0.903
  154    HG2  GLN  22           1HG      GLN  22  -2.182   3.411   3.764
  155    HG3  GLN  22           2HG      GLN  22  -2.213   4.594   2.458
  156   HE21  GLN  22          1HE2      GLN  22  -4.002   2.991   4.848
  157   HE22  GLN  22          2HE2      GLN  22  -5.557   3.635   4.459
  158    H    ARG  23           H        ARG  23  -5.301   1.319   1.240
  159    HA   ARG  23           HA       ARG  23  -4.609  -0.493  -0.969
  160    HB2  ARG  23           1HB      ARG  23  -7.043  -0.621   0.811
  161    HB3  ARG  23           2HB      ARG  23  -6.953  -1.429  -0.749
  162    HG2  ARG  23           1HG      ARG  23  -5.219  -2.860  -0.013
  163    HG3  ARG  23           2HG      ARG  23  -4.966  -1.909   1.452
  164    HD2  ARG  23           1HD      ARG  23  -7.456  -3.475   0.781
  165    HD3  ARG  23           2HD      ARG  23  -6.192  -3.989   1.898
  166    HE   ARG  23           HE       ARG  23  -7.453  -1.440   2.478
  167   HH11  ARG  23          2HH1      ARG  23  -7.326  -4.865   3.090
  168   HH12  ARG  23          1HH1      ARG  23  -8.141  -4.755   4.615
  169   HH21  ARG  23          2HH2      ARG  23  -8.527  -1.282   4.485
  170   HH22  ARG  23          1HH2      ARG  23  -8.824  -2.717   5.407
  171    H    GLU  24           H        GLU  24  -4.365   1.673  -1.996
  172    HA   GLU  24           HA       GLU  24  -6.501   3.439  -2.380
  173    HB2  GLU  24           1HB      GLU  24  -3.951   2.879  -3.827
  174    HB3  GLU  24           2HB      GLU  24  -5.152   3.893  -4.613
  175    HG2  GLU  24           1HG      GLU  24  -4.128   4.429  -1.842
  176    HG3  GLU  24           2HG      GLU  24  -3.372   5.086  -3.292
  177    H    MET  25           H        MET  25  -8.205   3.485  -3.734
  178    HA   MET  25           HA       MET  25  -9.070   1.096  -4.978
  179    HB2  MET  25           1HB      MET  25 -10.474   3.055  -4.062
  180    HB3  MET  25           2HB      MET  25 -10.174   3.821  -5.616
  181    HG2  MET  25           1HG      MET  25 -11.319   2.113  -6.783
  182    HG3  MET  25           2HG      MET  25 -11.378   1.084  -5.354
  183    HE1  MET  25           1HE      MET  25 -12.158   4.347  -6.865
  184    HE2  MET  25           2HE      MET  25 -13.891   4.562  -6.618
  185    HE3  MET  25           3HE      MET  25 -12.747   5.166  -5.418
  186    H    MET  26           H        MET  26  -7.495   4.003  -6.172
  187    HA   MET  26           HA       MET  26  -7.637   3.021  -8.920
  188    HB2  MET  26           1HB      MET  26  -6.627   5.214  -9.502
  189    HB3  MET  26           2HB      MET  26  -8.149   5.361  -8.634
  190    HG2  MET  26           1HG      MET  26  -5.632   5.410  -7.062
  191    HG3  MET  26           2HG      MET  26  -6.045   6.826  -8.026
  192    HE1  MET  26           1HE      MET  26  -8.117   8.813  -6.020
  193    HE2  MET  26           2HE      MET  26  -6.519   8.454  -5.365
  194    HE3  MET  26           3HE      MET  26  -6.754   8.558  -7.111
  195    H    LYS  27           H        LYS  27  -5.789   2.663 -10.192
  196    HA   LYS  27           HA       LYS  27  -3.539   1.622  -8.710
  197    HB2  LYS  27           1HB      LYS  27  -4.252   0.276 -10.529
  198    HB3  LYS  27           2HB      LYS  27  -4.278   1.646 -11.631
  199    HG2  LYS  27           1HG      LYS  27  -1.759   1.777 -11.255
  200    HG3  LYS  27           2HG      LYS  27  -1.908   0.172 -10.536
  201    HD2  LYS  27           1HD      LYS  27  -2.396  -0.826 -12.532
  202    HD3  LYS  27           2HD      LYS  27  -3.164   0.621 -13.191
  203    HE2  LYS  27           1HE      LYS  27  -1.252   0.631 -14.427
  204    HE3  LYS  27           2HE      LYS  27  -0.688   1.551 -13.033
  205    HZ1  LYS  27           1HZ      LYS  27   0.083  -0.653 -12.118
  206    HZ2  LYS  27           2HZ      LYS  27   0.946  -0.060 -13.447
  207    HZ3  LYS  27           3HZ      LYS  27  -0.187  -1.298 -13.658
  208    H    LEU  28           H        LEU  28  -1.892   2.856  -8.118
  209    HA   LEU  28           HA       LEU  28  -1.147   5.131  -9.836
  210    HB2  LEU  28           1HB      LEU  28  -0.907   4.781  -6.855
  211    HB3  LEU  28           2HB      LEU  28  -0.142   6.094  -7.750
  212    HG   LEU  28           HG       LEU  28  -3.092   5.722  -7.982
  213   HD11  LEU  28          1HD1      LEU  28  -2.851   7.546  -5.963
  214   HD12  LEU  28          2HD1      LEU  28  -1.657   6.330  -5.513
  215   HD13  LEU  28          3HD1      LEU  28  -3.338   5.863  -5.766
  216   HD21  LEU  28          1HD2      LEU  28  -2.516   7.461  -9.318
  217   HD22  LEU  28          2HD2      LEU  28  -1.074   7.851  -8.380
  218   HD23  LEU  28          3HD2      LEU  28  -2.664   8.349  -7.802
  219    H    THR  29           H        THR  29   0.663   4.794 -10.925
  220    HA   THR  29           HA       THR  29   2.724   3.051  -9.744
  221    HB   THR  29           HB       THR  29   2.450   3.757 -12.667
  222    HG1  THR  29           1HG      THR  29   1.406   1.766 -12.891
  223   HG21  THR  29          1HG2      THR  29   4.044   2.095 -13.074
  224   HG22  THR  29          2HG2      THR  29   3.828   1.367 -11.483
  225   HG23  THR  29          3HG2      THR  29   4.658   2.915 -11.639
  226    H    CYS  30           H        CYS  30   4.847   3.716  -9.670
  227    HA   CYS  30           HA       CYS  30   5.327   6.491  -9.447
  228    HB2  CYS  30           1HB      CYS  30   6.555   4.631  -8.241
  229    HB3  CYS  30           2HB      CYS  30   7.433   4.348  -9.740
  230    H    GLU  31           H        GLU  31   7.153   7.606 -10.611
  231    HA   GLU  31           HA       GLU  31   6.832   7.156 -13.491
  232    HB2  GLU  31           1HB      GLU  31   6.244   9.364 -13.039
  233    HB3  GLU  31           2HB      GLU  31   7.503   9.556 -11.827
  234    HG2  GLU  31           1HG      GLU  31   9.122  10.003 -13.372
  235    HG3  GLU  31           2HG      GLU  31   8.319   9.084 -14.644
  236    H    ARG  32           H        ARG  32   9.081   6.829 -10.962
  237    HA   ARG  32           HA       ARG  32  11.364   6.832 -12.803
  238    HB2  ARG  32           1HB      ARG  32  11.251   6.745  -9.783
  239    HB3  ARG  32           2HB      ARG  32  12.734   6.694 -10.727
  240    HG2  ARG  32           1HG      ARG  32  12.200   8.908 -11.652
  241    HG3  ARG  32           2HG      ARG  32  10.751   8.958 -10.646
  242    HD2  ARG  32           1HD      ARG  32  12.359  10.178  -9.450
  243    HD3  ARG  32           2HD      ARG  32  12.311   8.599  -8.666
  244    HE   ARG  32           HE       ARG  32  14.450   8.172  -9.432
  245   HH11  ARG  32          2HH1      ARG  32  13.217  11.107 -10.843
  246   HH12  ARG  32          1HH1      ARG  32  14.754  11.606 -11.469
  247   HH21  ARG  32          2HH2      ARG  32  16.478   8.818 -10.252
  248   HH22  ARG  32          1HH2      ARG  32  16.608  10.303 -11.133
  249    H    CYS  33           H        CYS  33  10.147   4.835 -10.104
  250    HA   CYS  33           HA       CYS  33  11.559   2.523 -11.147
  251    HB2  CYS  33           1HB      CYS  33  10.651   1.391  -9.112
  252    HB3  CYS  33           2HB      CYS  33  11.611   2.824  -8.757
  253    H    SER  34           H        SER  34   8.443   3.911 -11.332
  254    HA   SER  34           HA       SER  34   6.510   3.266 -12.343
  255    HB2  SER  34           1HB      SER  34   8.423   1.281 -13.569
  256    HB3  SER  34           2HB      SER  34   6.713   1.325 -13.999
  257    HG   SER  34           HG       SER  34   7.115   2.980 -15.213
  258    H    ARG  35           H        ARG  35   6.920   2.396  -9.727
  259    HA   ARG  35           HA       ARG  35   5.748  -0.304  -9.723
  260    HB2  ARG  35           1HB      ARG  35   7.340   1.196  -7.649
  261    HB3  ARG  35           2HB      ARG  35   6.412  -0.245  -7.255
  262    HG2  ARG  35           1HG      ARG  35   7.719  -1.467  -8.997
  263    HG3  ARG  35           2HG      ARG  35   8.732  -0.031  -9.156
  264    HD2  ARG  35           1HD      ARG  35   8.276  -1.429  -6.532
  265    HD3  ARG  35           2HD      ARG  35   9.593  -1.855  -7.624
  266    HE   ARG  35           HE       ARG  35   9.627   0.919  -7.124
  267   HH11  ARG  35          2HH1      ARG  35  10.289  -2.126  -5.572
  268   HH12  ARG  35          1HH1      ARG  35  11.478  -1.468  -4.497
  269   HH21  ARG  35          2HH2      ARG  35  11.190   1.797  -5.713
  270   HH22  ARG  35          1HH2      ARG  35  11.988   0.764  -4.577
  271    H    ASN  36           H        ASN  36   4.013  -0.742  -8.243
  272    HA   ASN  36           HA       ASN  36   2.076   1.365  -8.183
  273    HB2  ASN  36           1HB      ASN  36   1.657  -1.155  -8.513
  274    HB3  ASN  36           2HB      ASN  36   1.801  -1.276  -6.762
  275   HD21  ASN  36          1HD2      ASN  36   0.243  -0.305  -5.454
  276   HD22  ASN  36          2HD2      ASN  36  -1.304   0.157  -6.071
  277    H    PHE  37           H        PHE  37   1.326   2.535  -6.477
  278    HA   PHE  37           HA       PHE  37   2.121   1.937  -3.771
  279    HB2  PHE  37           1HB      PHE  37   3.106   4.482  -5.078
  280    HB3  PHE  37           2HB      PHE  37   3.286   4.059  -3.379
  281    HD1  PHE  37           2HD      PHE  37   4.419   1.654  -3.025
  282    HD2  PHE  37           1HD      PHE  37   4.924   4.161  -6.427
  283    HE1  PHE  37           2HE      PHE  37   6.551   0.535  -3.529
  284    HE2  PHE  37           1HE      PHE  37   7.057   3.046  -6.937
  285    HZ   PHE  37           HZ       PHE  37   7.873   1.231  -5.486
  286    H    CYS  38           H        CYS  38   1.380   3.846  -2.296
  287    HA   CYS  38           HA       CYS  38  -1.332   4.541  -3.166
  288    HB2  CYS  38           1HB      CYS  38  -1.858   4.823  -0.819
  289    HB3  CYS  38           2HB      CYS  38  -1.056   3.272  -1.047
  290    H    ILE  39           H        ILE  39  -2.173   6.643  -2.861
  291    HA   ILE  39           HA       ILE  39  -0.829   8.761  -3.797
  292    HB   ILE  39           HB       ILE  39  -2.947   8.742  -1.660
  293   HG12  ILE  39          1HG1      ILE  39  -3.056   9.593  -4.559
  294   HG13  ILE  39          2HG1      ILE  39  -3.481   7.982  -3.993
  295   HG21  ILE  39          1HG2      ILE  39  -1.556  10.773  -1.431
  296   HG22  ILE  39          2HG2      ILE  39  -1.904  11.167  -3.113
  297   HG23  ILE  39          3HG2      ILE  39  -3.210  11.124  -1.930
  298   HD11  ILE  39          1HD1      ILE  39  -5.424   8.686  -3.028
  299   HD12  ILE  39          2HD1      ILE  39  -4.830  10.326  -2.764
  300   HD13  ILE  39          3HD1      ILE  39  -5.309   9.811  -4.381
  301    H    LYS  40           H        LYS  40  -0.709   7.621  -0.468
  302    HA   LYS  40           HA       LYS  40   0.761   9.799   0.586
  303    HB2  LYS  40           1HB      LYS  40   0.094   7.038   1.471
  304    HB3  LYS  40           2HB      LYS  40   1.447   7.833   2.265
  305    HG2  LYS  40           1HG      LYS  40  -0.240   8.474   3.645
  306    HG3  LYS  40           2HG      LYS  40  -0.287   9.806   2.487
  307    HD2  LYS  40           1HD      LYS  40  -2.530   9.108   2.789
  308    HD3  LYS  40           2HD      LYS  40  -2.024   8.477   1.220
  309    HE2  LYS  40           1HE      LYS  40  -3.011   6.611   2.093
  310    HE3  LYS  40           2HE      LYS  40  -1.361   6.375   2.668
  311    HZ1  LYS  40           1HZ      LYS  40  -2.267   7.724   4.700
  312    HZ2  LYS  40           2HZ      LYS  40  -2.524   6.056   4.585
  313    HZ3  LYS  40           3HZ      LYS  40  -3.761   7.133   4.168
  314    H    HIS  41           H        HIS  41   1.730   6.663  -0.747
  315    HA   HIS  41           HA       HIS  41   4.535   7.545  -0.650
  316    HB2  HIS  41           1HB      HIS  41   3.392   4.760  -0.948
  317    HB3  HIS  41           2HB      HIS  41   5.108   5.154  -0.934
  318    HD2  HIS  41           2HD      HIS  41   5.006   7.162   1.716
  319    HE1  HIS  41           1HE      HIS  41   3.548   3.688   3.666
  320    HE2  HIS  41           2HE      HIS  41   4.498   6.001   3.970
  321    H    ARG  42           H        ARG  42   2.300   8.096  -2.671
  322    HA   ARG  42           HA       ARG  42   3.031   6.770  -5.077
  323    HB2  ARG  42           1HB      ARG  42   0.892   7.617  -5.203
  324    HB3  ARG  42           2HB      ARG  42   1.315   9.102  -4.362
  325    HG2  ARG  42           1HG      ARG  42   0.825   9.673  -6.609
  326    HG3  ARG  42           2HG      ARG  42   2.574   9.800  -6.408
  327    HD2  ARG  42           1HD      ARG  42   2.534   7.315  -7.244
  328    HD3  ARG  42           2HD      ARG  42   0.973   7.785  -7.915
  329    HE   ARG  42           HE       ARG  42   3.522   8.468  -8.937
  330   HH11  ARG  42          2HH1      ARG  42   0.325   9.758  -8.453
  331   HH12  ARG  42          1HH1      ARG  42   0.428  10.862  -9.784
  332   HH21  ARG  42          2HH2      ARG  42   3.669   9.917 -10.692
  333   HH22  ARG  42          1HH2      ARG  42   2.330  10.951 -11.058
  334    H    HIS  43           H        HIS  43   4.081   9.704  -3.484
  335    HA   HIS  43           HA       HIS  43   5.588  10.651  -5.751
  336    HB2  HIS  43           1HB      HIS  43   4.534  11.936  -3.644
  337    HB3  HIS  43           2HB      HIS  43   6.165  11.688  -3.028
  338    HD1  HIS  43           1HD      HIS  43   8.041  13.067  -4.067
  339    HD2  HIS  43           2HD      HIS  43   4.355  13.653  -5.891
  340    HE1  HIS  43           1HE      HIS  43   8.343  15.064  -5.565
  341    HA   PRO  44           HA       PRO  44   9.266   8.337  -5.044
  342    HB2  PRO  44           1HB      PRO  44  11.036   9.958  -6.313
  343    HB3  PRO  44           2HB      PRO  44   9.874   8.942  -7.175
  344    HG2  PRO  44           1HG      PRO  44   9.724  11.862  -6.530
  345    HG3  PRO  44           2HG      PRO  44   9.309  11.026  -8.038
  346    HD2  PRO  44           1HD      PRO  44   7.439  11.805  -6.241
  347    HD3  PRO  44           2HD      PRO  44   7.252  10.353  -7.245
  348    H    LEU  45           H        LEU  45   8.498  11.098  -3.448
  349    HA   LEU  45           HA       LEU  45  11.122  11.373  -2.159
  350    HB2  LEU  45           1HB      LEU  45   8.715  13.158  -2.302
  351    HB3  LEU  45           2HB      LEU  45   9.983  13.411  -1.104
  352    HG   LEU  45           HG       LEU  45  10.453  13.409  -4.083
  353   HD11  LEU  45          1HD1      LEU  45  10.767  15.972  -2.872
  354   HD12  LEU  45          2HD1      LEU  45   9.151  15.362  -2.520
  355   HD13  LEU  45          3HD1      LEU  45   9.700  15.489  -4.191
  356   HD21  LEU  45          1HD2      LEU  45  12.339  12.886  -2.434
  357   HD22  LEU  45          2HD2      LEU  45  12.196  14.571  -1.932
  358   HD23  LEU  45          3HD2      LEU  45  12.609  14.180  -3.602
  359    H    ASP  46           H        ASP  46   7.875  10.310  -1.659
  360    HA   ASP  46           HA       ASP  46   8.373   9.993   1.222
  361    HB2  ASP  46           1HB      ASP  46   5.847  10.152  -0.404
  362    HB3  ASP  46           2HB      ASP  46   5.842   9.466   1.219
  363    H    HIS  47           H        HIS  47   9.485   8.281  -0.888
  364    HA   HIS  47           HA       HIS  47   8.905   5.758   0.303
  365    HB2  HIS  47           1HB      HIS  47   7.696   4.671  -1.324
  366    HB3  HIS  47           2HB      HIS  47   7.024   6.292  -1.478
  367    HD1  HIS  47           1HD      HIS  47   6.820   6.986  -3.830
  368    HD2  HIS  47           2HD      HIS  47  10.064   4.454  -3.257
  369    HE1  HIS  47           1HE      HIS  47   7.859   6.699  -6.102
  370    H    ASP  48           H        ASP  48  10.650   4.487   0.149
  371    HA   ASP  48           HA       ASP  48  13.051   5.375  -0.924
  372    HB2  ASP  48           1HB      ASP  48  12.119   2.600  -0.190
  373    HB3  ASP  48           2HB      ASP  48  13.770   2.945  -0.698
  374    H    CYS  49           H        CYS  49  12.762   6.056  -3.056
  375    HA   CYS  49           HA       CYS  49  11.780   4.287  -5.085
  376    HB2  CYS  49           1HB      CYS  49  11.747   6.875  -5.055
  377    HB3  CYS  49           2HB      CYS  49  13.410   6.757  -5.619
  378    H    SER  50           H        SER  50  12.963   3.366  -6.803
  379    HA   SER  50           HA       SER  50  15.806   2.909  -6.176
  380    HB2  SER  50           1HB      SER  50  14.268   0.916  -6.007
  381    HB3  SER  50           2HB      SER  50  13.992   1.064  -7.743
  382    HG   SER  50           HG       SER  50  15.674  -0.429  -7.199
  383    H    GLY  51           H        GLY  51  13.481   3.199  -8.850
  384    HA2  GLY  51           1HA      GLY  51  13.758   4.349 -10.852
  385    HA3  GLY  51           2HA      GLY  51  15.421   4.687 -10.396
  386    H    GLU  52           H        GLU  52  13.274   2.497 -12.020
  387    HA   GLU  52           HA       GLU  52  15.409   0.634 -12.665
  388    HB2  GLU  52           1HB      GLU  52  12.540   0.671 -13.619
  389    HB3  GLU  52           2HB      GLU  52  13.684  -0.651 -13.809
  390    HG2  GLU  52           1HG      GLU  52  12.834   0.393 -11.125
  391    HG3  GLU  52           2HG      GLU  52  11.980  -0.896 -11.971
  392    H    GLY  53           H        GLY  53  13.204   2.808 -14.429
  393    HA2  GLY  53           1HA      GLY  53  13.283   3.466 -16.663
  394    HA3  GLY  53           2HA      GLY  53  14.842   4.066 -16.116
  395    H    HIS  54           H        HIS  54  15.892   3.770 -18.061
  396    HA   HIS  54           HA       HIS  54  15.806   1.308 -19.501
  397    HB2  HIS  54           1HB      HIS  54  17.463   2.282 -20.941
  398    HB3  HIS  54           2HB      HIS  54  16.310   3.544 -20.519
  399    HD1  HIS  54           1HD      HIS  54  17.319   5.670 -19.758
  400    HD2  HIS  54           2HD      HIS  54  19.896   2.455 -19.223
  401    HE1  HIS  54           1HE      HIS  54  19.469   6.664 -18.914
  402    HA   PRO  55           HA       PRO  55  18.845  -1.070 -17.407
  403    HB2  PRO  55           1HB      PRO  55  19.884  -2.497 -19.470
  404    HB3  PRO  55           2HB      PRO  55  18.274  -2.800 -18.807
  405    HG2  PRO  55           1HG      PRO  55  19.057  -1.255 -21.249
  406    HG3  PRO  55           2HG      PRO  55  17.729  -2.410 -21.034
  407    HD2  PRO  55           1HD      PRO  55  17.351   0.271 -20.980
  408    HD3  PRO  55           2HD      PRO  55  16.371  -0.851 -20.015
  409    H    THR  56           H        THR  56  20.360   0.424 -16.688
  410    HA   THR  56           HA       THR  56  22.141   1.951 -18.067
  411    HB   THR  56           HB       THR  56  23.695   1.737 -16.131
  412    HG1  THR  56           1HG      THR  56  23.500  -0.293 -15.376
  413   HG21  THR  56          1HG2      THR  56  22.346   3.347 -15.371
  414   HG22  THR  56          2HG2      THR  56  21.489   2.096 -14.470
  415   HG23  THR  56          3HG2      THR  56  20.925   2.573 -16.071
  416    H    SER  57           H        SER  57  24.551   1.643 -18.267
  417    HA   SER  57           HA       SER  57  25.404  -1.082 -18.811
  418    HB2  SER  57           1HB      SER  57  25.148   1.037 -20.942
  419    HB3  SER  57           2HB      SER  57  26.255  -0.327 -21.109
  420    HG   SER  57           HG       SER  57  24.621  -1.583 -21.521
  421    H    SER  58           H        SER  58  27.667  -1.323 -18.956
  422    HA   SER  58           HA       SER  58  29.409   0.954 -18.757
  423    HB2  SER  58           1HB      SER  58  28.416   0.567 -16.406
  424    HB3  SER  58           2HB      SER  58  29.418  -0.884 -16.371
  425    HG   SER  58           HG       SER  58  30.129   1.721 -16.054
  426    H    GLY  59           H        GLY  59  31.520   0.451 -19.233
  427    HA2  GLY  59           1HA      GLY  59  33.223  -1.426 -19.069
  428    HA3  GLY  59           2HA      GLY  59  32.008  -2.381 -19.906
  429    HA   PRO  60           HA       PRO  60  33.604   0.956 -23.044
  430    HB2  PRO  60           1HB      PRO  60  35.877   2.258 -22.331
  431    HB3  PRO  60           2HB      PRO  60  34.261   2.865 -21.948
  432    HG2  PRO  60           1HG      PRO  60  36.182   1.363 -20.210
  433    HG3  PRO  60           2HG      PRO  60  35.174   2.767 -19.811
  434    HD2  PRO  60           1HD      PRO  60  34.498   0.241 -19.109
  435    HD3  PRO  60           2HD      PRO  60  33.288   1.481 -19.495
  436    H    SER  61           H        SER  61  34.052  -1.204 -23.883
  437    HA   SER  61           HA       SER  61  36.878  -1.988 -23.799
  438    HB2  SER  61           1HB      SER  61  34.925  -3.621 -23.305
  439    HB3  SER  61           2HB      SER  61  34.685  -3.624 -25.052
  440    HG   SER  61           HG       SER  61  36.447  -5.012 -23.648
  441    H    SER  62           H        SER  62  37.903  -0.754 -25.292
  442    HA   SER  62           HA       SER  62  36.742  -0.272 -27.895
  443    HB2  SER  62           1HB      SER  62  38.642   1.123 -28.310
  444    HB3  SER  62           2HB      SER  62  38.160   1.406 -26.638
  445    HG   SER  62           HG       SER  62  40.514   0.935 -27.266
  446    H    GLY  63           H        GLY  63  36.931  -2.964 -27.568
  447    HA2  GLY  63           1HA      GLY  63  38.000  -4.904 -28.290
  448    HA3  GLY  63           2HA      GLY  63  37.944  -4.009 -29.802
  Start of MODEL    6
    1    H1   GLY   1           H        GLY   1  -9.678 -29.319   7.438
    2    HA2  GLY   1           1HA      GLY   1  -7.811 -27.174   6.836
    3    HA3  GLY   1           2HA      GLY   1  -9.390 -27.421   6.105
    4    H    SER   2           H        SER   2  -8.261 -24.954   7.113
    5    HA   SER   2           HA       SER   2 -10.258 -24.362   9.197
    6    HB2  SER   2           1HB      SER   2  -7.501 -23.135   8.935
    7    HB3  SER   2           2HB      SER   2  -8.707 -22.714  10.151
    8    HG   SER   2           HG       SER   2  -7.843 -25.377   9.867
    9    H    SER   3           H        SER   3 -10.946 -22.082   9.250
   10    HA   SER   3           HA       SER   3 -11.379 -21.125   6.540
   11    HB2  SER   3           1HB      SER   3 -12.565 -20.402   9.217
   12    HB3  SER   3           2HB      SER   3 -12.893 -19.456   7.766
   13    HG   SER   3           HG       SER   3 -13.292 -22.255   7.882
   14    H    GLY   4           H        GLY   4 -11.467 -18.601   6.380
   15    HA2  GLY   4           1HA      GLY   4  -9.656 -17.059   7.910
   16    HA3  GLY   4           2HA      GLY   4  -8.847 -17.648   6.466
   17    H    SER   5           H        SER   5 -11.587 -15.753   7.627
   18    HA   SER   5           HA       SER   5 -12.609 -14.830   5.233
   19    HB2  SER   5           1HB      SER   5 -13.599 -14.388   7.472
   20    HB3  SER   5           2HB      SER   5 -12.319 -13.215   7.778
   21    HG   SER   5           HG       SER   5 -13.919 -12.995   5.474
   22    H    SER   6           H        SER   6 -11.837 -13.621   3.639
   23    HA   SER   6           HA       SER   6  -9.897 -11.527   4.158
   24    HB2  SER   6           1HB      SER   6  -8.319 -12.373   2.433
   25    HB3  SER   6           2HB      SER   6  -8.432 -13.442   3.831
   26    HG   SER   6           HG       SER   6 -10.013 -13.838   1.524
   27    H    GLY   7           H        GLY   7  -9.656 -10.049   2.400
   28    HA2  GLY   7           1HA      GLY   7 -11.783 -10.304   0.363
   29    HA3  GLY   7           2HA      GLY   7 -11.414  -8.783   1.163
   30    H    ARG   8           H        ARG   8 -11.322  -9.757  -1.715
   31    HA   ARG   8           HA       ARG   8  -8.894  -8.363  -2.400
   32    HB2  ARG   8           1HB      ARG   8  -8.014 -10.204  -3.821
   33    HB3  ARG   8           2HB      ARG   8  -7.960 -10.564  -2.101
   34    HG2  ARG   8           1HG      ARG   8  -9.801 -12.043  -2.258
   35    HG3  ARG   8           2HG      ARG   8 -10.175 -11.507  -3.897
   36    HD2  ARG   8           1HD      ARG   8  -9.090 -13.524  -4.254
   37    HD3  ARG   8           2HD      ARG   8  -7.796 -12.344  -4.460
   38    HE   ARG   8           HE       ARG   8  -7.638 -13.003  -1.836
   39   HH11  ARG   8          2HH1      ARG   8  -7.691 -14.853  -4.785
   40   HH12  ARG   8          1HH1      ARG   8  -6.720 -16.139  -4.148
   41   HH21  ARG   8          2HH2      ARG   8  -6.359 -14.690  -0.987
   42   HH22  ARG   8          1HH2      ARG   8  -5.964 -16.045  -1.988
   43    H    LYS   9           H        LYS   9  -9.294  -7.152  -4.128
   44    HA   LYS   9           HA       LYS   9 -11.075  -8.129  -6.222
   45    HB2  LYS   9           1HB      LYS   9 -11.529  -5.600  -4.642
   46    HB3  LYS   9           2HB      LYS   9 -12.238  -5.866  -6.229
   47    HG2  LYS   9           1HG      LYS   9 -12.641  -7.869  -4.049
   48    HG3  LYS   9           2HG      LYS   9 -13.615  -6.398  -4.106
   49    HD2  LYS   9           1HD      LYS   9 -14.579  -6.976  -6.155
   50    HD3  LYS   9           2HD      LYS   9 -13.320  -8.159  -6.517
   51    HE2  LYS   9           1HE      LYS   9 -15.302  -9.355  -5.929
   52    HE3  LYS   9           2HE      LYS   9 -14.156  -9.521  -4.599
   53    HZ1  LYS   9           1HZ      LYS   9 -16.454  -7.641  -4.692
   54    HZ2  LYS   9           2HZ      LYS   9 -15.342  -7.762  -3.423
   55    HZ3  LYS   9           3HZ      LYS   9 -16.368  -9.060  -3.775
   56    H    ILE  10           H        ILE  10  -9.726  -8.056  -7.907
   57    HA   ILE  10           HA       ILE  10  -7.464  -6.693  -8.358
   58    HB   ILE  10           HB       ILE  10  -9.625  -7.110 -10.426
   59   HG12  ILE  10          1HG1      ILE  10  -7.197  -8.833 -10.093
   60   HG13  ILE  10          2HG1      ILE  10  -8.583  -9.080  -9.036
   61   HG21  ILE  10          1HG2      ILE  10  -7.040  -5.844 -10.586
   62   HG22  ILE  10          2HG2      ILE  10  -7.114  -7.266 -11.626
   63   HG23  ILE  10          3HG2      ILE  10  -8.303  -5.977 -11.810
   64   HD11  ILE  10          1HD1      ILE  10  -9.196 -10.509 -10.654
   65   HD12  ILE  10          2HD1      ILE  10  -9.816  -9.046 -11.421
   66   HD13  ILE  10          3HD1      ILE  10  -8.242  -9.689 -11.890
   67    H    PHE  11           H        PHE  11 -10.711  -5.385  -8.941
   68    HA   PHE  11           HA       PHE  11 -10.307  -3.029 -10.141
   69    HB2  PHE  11           1HB      PHE  11 -11.989  -3.500  -7.674
   70    HB3  PHE  11           2HB      PHE  11 -12.090  -2.049  -8.666
   71    HD1  PHE  11           1HD      PHE  11 -12.222  -2.748 -11.325
   72    HD2  PHE  11           2HD      PHE  11 -13.689  -4.984  -8.014
   73    HE1  PHE  11           1HE      PHE  11 -13.838  -3.870 -12.803
   74    HE2  PHE  11           2HE      PHE  11 -15.306  -6.110  -9.486
   75    HZ   PHE  11           HZ       PHE  11 -15.382  -5.555 -11.884
   76    H    THR  12           H        THR  12  -9.643  -3.627  -6.708
   77    HA   THR  12           HA       THR  12  -8.537  -0.972  -6.359
   78    HB   THR  12           HB       THR  12  -8.013  -1.794  -4.036
   79    HG1  THR  12           1HG      THR  12  -9.549  -4.055  -4.844
   80   HG21  THR  12          1HG2      THR  12  -9.970  -0.614  -4.002
   81   HG22  THR  12          2HG2      THR  12 -10.597  -2.202  -3.558
   82   HG23  THR  12          3HG2      THR  12 -10.733  -1.634  -5.222
   83    H    ASN  13           H        ASN  13  -6.362  -0.711  -5.370
   84    HA   ASN  13           HA       ASN  13  -4.455  -2.685  -6.441
   85    HB2  ASN  13           1HB      ASN  13  -3.791   0.237  -6.219
   86    HB3  ASN  13           2HB      ASN  13  -3.036  -0.995  -7.226
   87   HD21  ASN  13          1HD2      ASN  13  -5.864   1.024  -6.814
   88   HD22  ASN  13          2HD2      ASN  13  -6.391   0.951  -8.457
   89    H    LYS  14           H        LYS  14  -2.280  -2.552  -5.382
   90    HA   LYS  14           HA       LYS  14  -2.556  -1.894  -2.522
   91    HB2  LYS  14           1HB      LYS  14  -1.312  -3.832  -1.933
   92    HB3  LYS  14           2HB      LYS  14  -2.544  -4.359  -3.073
   93    HG2  LYS  14           1HG      LYS  14  -0.875  -4.335  -4.870
   94    HG3  LYS  14           2HG      LYS  14   0.357  -3.846  -3.703
   95    HD2  LYS  14           1HD      LYS  14  -0.394  -5.970  -2.411
   96    HD3  LYS  14           2HD      LYS  14  -1.080  -6.461  -3.961
   97    HE2  LYS  14           1HE      LYS  14   1.137  -6.152  -5.001
   98    HE3  LYS  14           2HE      LYS  14   1.801  -5.746  -3.419
   99    HZ1  LYS  14           1HZ      LYS  14   1.253  -8.309  -4.547
  100    HZ2  LYS  14           2HZ      LYS  14   0.512  -8.127  -3.038
  101    HZ3  LYS  14           3HZ      LYS  14   2.182  -7.908  -3.191
  102    H    CYS  15           H        CYS  15  -0.654  -1.215  -1.425
  103    HA   CYS  15           HA       CYS  15   1.143   0.288  -3.135
  104    HB2  CYS  15           1HB      CYS  15   0.187   1.369  -1.153
  105    HB3  CYS  15           2HB      CYS  15   0.934   0.155  -0.119
  106    H    GLU  16           H        GLU  16   3.252  -0.135  -3.491
  107    HA   GLU  16           HA       GLU  16   4.267  -2.702  -2.564
  108    HB2  GLU  16           1HB      GLU  16   5.371  -0.737  -4.579
  109    HB3  GLU  16           2HB      GLU  16   6.086  -2.299  -4.205
  110    HG2  GLU  16           1HG      GLU  16   3.644  -3.134  -4.815
  111    HG3  GLU  16           2HG      GLU  16   3.653  -1.645  -5.759
  112    H    ARG  17           H        ARG  17   4.050  -0.464  -0.706
  113    HA   ARG  17           HA       ARG  17   6.844   0.245  -0.205
  114    HB2  ARG  17           1HB      ARG  17   5.346   2.107  -0.075
  115    HB3  ARG  17           2HB      ARG  17   4.247   1.225   0.977
  116    HG2  ARG  17           1HG      ARG  17   5.397   2.750   2.351
  117    HG3  ARG  17           2HG      ARG  17   6.108   1.168   2.676
  118    HD2  ARG  17           1HD      ARG  17   7.801   1.866   0.818
  119    HD3  ARG  17           2HD      ARG  17   7.251   3.498   1.195
  120    HE   ARG  17           HE       ARG  17   8.059   1.933   3.483
  121   HH11  ARG  17          2HH1      ARG  17   9.049   4.163   0.999
  122   HH12  ARG  17          1HH1      ARG  17  10.426   4.736   1.880
  123   HH21  ARG  17          2HH2      ARG  17   9.869   2.680   4.653
  124   HH22  ARG  17          1HH2      ARG  17  10.892   3.892   3.958
  125    H    ALA  18           H        ALA  18   7.792  -0.062   1.883
  126    HA   ALA  18           HA       ALA  18   7.283  -2.640   2.972
  127    HB1  ALA  18           1HB      ALA  18   9.255  -2.400   4.059
  128    HB2  ALA  18           2HB      ALA  18   9.467  -1.103   2.883
  129    HB3  ALA  18           3HB      ALA  18   8.927  -0.729   4.519
  130    H    GLY  19           H        GLY  19   6.168  -3.256   4.742
  131    HA2  GLY  19           1HA      GLY  19   4.618  -3.131   6.434
  132    HA3  GLY  19           2HA      GLY  19   5.579  -1.772   7.000
  133    H    CYS  20           H        CYS  20   3.737  -2.003   3.991
  134    HA   CYS  20           HA       CYS  20   1.845  -0.015   5.039
  135    HB2  CYS  20           1HB      CYS  20   3.711   1.016   3.631
  136    HB3  CYS  20           2HB      CYS  20   3.000   0.172   2.260
  137    H    ARG  21           H        ARG  21  -0.084  -0.951   4.958
  138    HA   ARG  21           HA       ARG  21  -0.708  -2.711   2.684
  139    HB2  ARG  21           1HB      ARG  21  -2.405  -3.733   4.102
  140    HB3  ARG  21           2HB      ARG  21  -0.836  -3.782   4.895
  141    HG2  ARG  21           1HG      ARG  21  -1.430  -2.063   6.398
  142    HG3  ARG  21           2HG      ARG  21  -2.870  -1.649   5.465
  143    HD2  ARG  21           1HD      ARG  21  -3.710  -2.868   7.264
  144    HD3  ARG  21           2HD      ARG  21  -3.632  -4.050   5.959
  145    HE   ARG  21           HE       ARG  21  -1.259  -4.041   7.542
  146   HH11  ARG  21          2HH1      ARG  21  -4.545  -5.185   7.417
  147   HH12  ARG  21          1HH1      ARG  21  -4.246  -6.549   8.442
  148   HH21  ARG  21          2HH2      ARG  21  -0.854  -5.833   8.892
  149   HH22  ARG  21          1HH2      ARG  21  -2.147  -6.917   9.282
  150    H    GLN  22           H        GLN  22  -0.839   0.052   2.310
  151    HA   GLN  22           HA       GLN  22  -3.568   0.924   2.642
  152    HB2  GLN  22           1HB      GLN  22  -1.103   2.117   1.419
  153    HB3  GLN  22           2HB      GLN  22  -2.678   2.842   1.125
  154    HG2  GLN  22           1HG      GLN  22  -1.255   3.760   3.041
  155    HG3  GLN  22           2HG      GLN  22  -2.962   3.439   3.346
  156   HE21  GLN  22          1HE2      GLN  22   0.055   3.105   4.572
  157   HE22  GLN  22          2HE2      GLN  22  -0.208   1.780   5.649
  158    H    ARG  23           H        ARG  23  -5.185   0.746   1.221
  159    HA   ARG  23           HA       ARG  23  -4.543  -0.302  -1.457
  160    HB2  ARG  23           1HB      ARG  23  -6.840  -0.822   0.404
  161    HB3  ARG  23           2HB      ARG  23  -7.028  -1.063  -1.327
  162    HG2  ARG  23           1HG      ARG  23  -4.890  -2.510  -1.106
  163    HG3  ARG  23           2HG      ARG  23  -5.304  -2.541   0.610
  164    HD2  ARG  23           1HD      ARG  23  -7.409  -3.170  -1.405
  165    HD3  ARG  23           2HD      ARG  23  -6.194  -4.390  -1.028
  166    HE   ARG  23           HE       ARG  23  -7.446  -3.250   1.294
  167   HH11  ARG  23          2HH1      ARG  23  -7.668  -5.704  -1.166
  168   HH12  ARG  23          1HH1      ARG  23  -8.666  -6.752  -0.214
  169   HH21  ARG  23          2HH2      ARG  23  -8.760  -4.621   2.557
  170   HH22  ARG  23          1HH2      ARG  23  -9.287  -6.135   1.904
  171    H    GLU  24           H        GLU  24  -4.674   1.254  -2.932
  172    HA   GLU  24           HA       GLU  24  -6.586   3.436  -2.572
  173    HB2  GLU  24           1HB      GLU  24  -4.084   3.060  -4.137
  174    HB3  GLU  24           2HB      GLU  24  -5.288   4.163  -4.788
  175    HG2  GLU  24           1HG      GLU  24  -4.230   4.363  -1.985
  176    HG3  GLU  24           2HG      GLU  24  -3.500   5.196  -3.356
  177    H    MET  25           H        MET  25  -8.490   3.389  -3.550
  178    HA   MET  25           HA       MET  25  -9.551   1.417  -5.070
  179    HB2  MET  25           1HB      MET  25 -10.113   4.372  -5.080
  180    HB3  MET  25           2HB      MET  25 -11.041   3.263  -6.080
  181    HG2  MET  25           1HG      MET  25 -10.747   2.945  -3.108
  182    HG3  MET  25           2HG      MET  25 -12.053   3.856  -3.862
  183    HE1  MET  25           1HE      MET  25 -12.988   2.165  -6.397
  184    HE2  MET  25           2HE      MET  25 -14.247   1.266  -5.551
  185    HE3  MET  25           3HE      MET  25 -13.944   2.955  -5.143
  186    H    MET  26           H        MET  26  -7.688   4.177  -6.262
  187    HA   MET  26           HA       MET  26  -7.809   3.081  -8.978
  188    HB2  MET  26           1HB      MET  26  -6.935   5.230  -9.713
  189    HB3  MET  26           2HB      MET  26  -8.352   5.467  -8.699
  190    HG2  MET  26           1HG      MET  26  -5.656   5.557  -7.446
  191    HG3  MET  26           2HG      MET  26  -6.206   6.933  -8.399
  192    HE1  MET  26           1HE      MET  26  -8.114   8.969  -6.436
  193    HE2  MET  26           2HE      MET  26  -6.530   8.740  -5.695
  194    HE3  MET  26           3HE      MET  26  -6.703   8.667  -7.450
  195    H    LYS  27           H        LYS  27  -5.840   2.941 -10.240
  196    HA   LYS  27           HA       LYS  27  -3.689   1.788  -8.700
  197    HB2  LYS  27           1HB      LYS  27  -4.667   1.041 -11.019
  198    HB3  LYS  27           2HB      LYS  27  -3.541   2.232 -11.658
  199    HG2  LYS  27           1HG      LYS  27  -1.673   1.067 -10.810
  200    HG3  LYS  27           2HG      LYS  27  -2.685   0.032  -9.800
  201    HD2  LYS  27           1HD      LYS  27  -2.200  -1.370 -11.567
  202    HD3  LYS  27           2HD      LYS  27  -3.743  -0.680 -12.075
  203    HE2  LYS  27           1HE      LYS  27  -1.240   0.716 -12.871
  204    HE3  LYS  27           2HE      LYS  27  -1.659  -0.782 -13.701
  205    HZ1  LYS  27           1HZ      LYS  27  -2.559   1.646 -14.398
  206    HZ2  LYS  27           2HZ      LYS  27  -3.836   1.098 -13.434
  207    HZ3  LYS  27           3HZ      LYS  27  -3.343   0.196 -14.777
  208    H    LEU  28           H        LEU  28  -1.742   2.657  -8.269
  209    HA   LEU  28           HA       LEU  28  -1.035   5.205  -9.553
  210    HB2  LEU  28           1HB      LEU  28  -0.848   4.561  -6.615
  211    HB3  LEU  28           2HB      LEU  28  -0.158   5.993  -7.375
  212    HG   LEU  28           HG       LEU  28  -3.084   5.487  -7.651
  213   HD11  LEU  28          1HD1      LEU  28  -3.291   6.917  -5.522
  214   HD12  LEU  28          2HD1      LEU  28  -1.666   6.341  -5.155
  215   HD13  LEU  28          3HD1      LEU  28  -2.987   5.189  -5.348
  216   HD21  LEU  28          1HD2      LEU  28  -1.372   7.466  -8.483
  217   HD22  LEU  28          2HD2      LEU  28  -2.092   8.156  -7.028
  218   HD23  LEU  28          3HD2      LEU  28  -3.125   7.608  -8.349
  219    H    THR  29           H        THR  29   0.615   4.517 -10.802
  220    HA   THR  29           HA       THR  29   2.747   2.936  -9.531
  221    HB   THR  29           HB       THR  29   2.299   3.347 -12.491
  222    HG1  THR  29           1HG      THR  29   0.594   2.122 -11.783
  223   HG21  THR  29          1HG2      THR  29   4.612   2.746 -11.660
  224   HG22  THR  29          2HG2      THR  29   3.898   1.619 -12.813
  225   HG23  THR  29          3HG2      THR  29   3.921   1.227 -11.094
  226    H    CYS  30           H        CYS  30   4.750   3.750  -9.317
  227    HA   CYS  30           HA       CYS  30   5.243   6.486  -9.494
  228    HB2  CYS  30           1HB      CYS  30   6.511   4.717  -8.150
  229    HB3  CYS  30           2HB      CYS  30   7.405   4.389  -9.631
  230    H    GLU  31           H        GLU  31   7.061   7.482 -10.792
  231    HA   GLU  31           HA       GLU  31   6.703   6.729 -13.607
  232    HB2  GLU  31           1HB      GLU  31   7.238   8.983 -14.180
  233    HB3  GLU  31           2HB      GLU  31   6.080   9.045 -12.859
  234    HG2  GLU  31           1HG      GLU  31   7.701   9.703 -11.312
  235    HG3  GLU  31           2HG      GLU  31   9.028   9.212 -12.362
  236    H    ARG  32           H        ARG  32   9.021   6.891 -11.081
  237    HA   ARG  32           HA       ARG  32  11.283   6.754 -12.920
  238    HB2  ARG  32           1HB      ARG  32  11.146   6.864  -9.903
  239    HB3  ARG  32           2HB      ARG  32  12.643   6.766 -10.821
  240    HG2  ARG  32           1HG      ARG  32  11.929   8.896 -11.974
  241    HG3  ARG  32           2HG      ARG  32  10.655   9.015 -10.758
  242    HD2  ARG  32           1HD      ARG  32  12.301  10.262  -9.764
  243    HD3  ARG  32           2HD      ARG  32  12.650   8.670  -9.091
  244    HE   ARG  32           HE       ARG  32  14.566   8.550 -10.405
  245   HH11  ARG  32          2HH1      ARG  32  12.742  11.435 -11.091
  246   HH12  ARG  32          1HH1      ARG  32  14.030  12.199 -11.963
  247   HH21  ARG  32          2HH2      ARG  32  16.269   9.545 -11.551
  248   HH22  ARG  32          1HH2      ARG  32  16.035  11.122 -12.225
  249    H    CYS  33           H        CYS  33  10.082   4.875 -10.132
  250    HA   CYS  33           HA       CYS  33  11.603   2.560 -10.998
  251    HB2  CYS  33           1HB      CYS  33  10.620   1.512  -8.931
  252    HB3  CYS  33           2HB      CYS  33  11.585   2.955  -8.638
  253    H    SER  34           H        SER  34   8.411   3.800 -11.273
  254    HA   SER  34           HA       SER  34   6.534   3.030 -12.303
  255    HB2  SER  34           1HB      SER  34   8.540   1.073 -13.429
  256    HB3  SER  34           2HB      SER  34   6.844   1.082 -13.910
  257    HG   SER  34           HG       SER  34   8.694   2.491 -14.985
  258    H    ARG  35           H        ARG  35   6.757   2.341  -9.687
  259    HA   ARG  35           HA       ARG  35   5.700  -0.410  -9.621
  260    HB2  ARG  35           1HB      ARG  35   7.386   1.072  -7.612
  261    HB3  ARG  35           2HB      ARG  35   6.446  -0.348  -7.172
  262    HG2  ARG  35           1HG      ARG  35   7.701  -1.429  -9.200
  263    HG3  ARG  35           2HG      ARG  35   8.857  -0.129  -8.901
  264    HD2  ARG  35           1HD      ARG  35   9.733  -1.708  -7.517
  265    HD3  ARG  35           2HD      ARG  35   8.580  -0.975  -6.402
  266    HE   ARG  35           HE       ARG  35   7.400  -2.932  -6.399
  267   HH11  ARG  35          2HH1      ARG  35   9.558  -2.915  -9.131
  268   HH12  ARG  35          1HH1      ARG  35   9.231  -4.560  -9.566
  269   HH21  ARG  35          2HH2      ARG  35   6.961  -5.099  -6.961
  270   HH22  ARG  35          1HH2      ARG  35   7.753  -5.801  -8.332
  271    H    ASN  36           H        ASN  36   4.002  -0.828  -8.102
  272    HA   ASN  36           HA       ASN  36   2.082   1.281  -7.987
  273    HB2  ASN  36           1HB      ASN  36   1.761  -1.329  -8.166
  274    HB3  ASN  36           2HB      ASN  36   1.766  -1.241  -6.407
  275   HD21  ASN  36          1HD2      ASN  36   0.321   0.592  -5.554
  276   HD22  ASN  36          2HD2      ASN  36  -1.253   0.685  -6.262
  277    H    PHE  37           H        PHE  37   1.337   2.437  -6.248
  278    HA   PHE  37           HA       PHE  37   2.269   1.922  -3.577
  279    HB2  PHE  37           1HB      PHE  37   3.165   4.461  -4.956
  280    HB3  PHE  37           2HB      PHE  37   3.445   4.040  -3.269
  281    HD1  PHE  37           2HD      PHE  37   4.699   1.754  -2.903
  282    HD2  PHE  37           1HD      PHE  37   4.827   4.051  -6.484
  283    HE1  PHE  37           2HE      PHE  37   6.811   0.657  -3.528
  284    HE2  PHE  37           1HE      PHE  37   6.938   2.957  -7.115
  285    HZ   PHE  37           HZ       PHE  37   7.933   1.258  -5.636
  286    H    CYS  38           H        CYS  38   1.504   3.725  -2.066
  287    HA   CYS  38           HA       CYS  38  -1.227   4.406  -2.844
  288    HB2  CYS  38           1HB      CYS  38  -1.672   4.699  -0.503
  289    HB3  CYS  38           2HB      CYS  38  -0.759   3.205  -0.692
  290    H    ILE  39           H        ILE  39  -2.097   6.499  -2.559
  291    HA   ILE  39           HA       ILE  39  -0.822   8.613  -3.619
  292    HB   ILE  39           HB       ILE  39  -2.854   8.663  -1.393
  293   HG12  ILE  39          1HG1      ILE  39  -3.126   9.223  -4.353
  294   HG13  ILE  39          2HG1      ILE  39  -3.509   7.682  -3.594
  295   HG21  ILE  39          1HG2      ILE  39  -2.022  10.989  -3.117
  296   HG22  ILE  39          2HG2      ILE  39  -3.203  10.996  -1.809
  297   HG23  ILE  39          3HG2      ILE  39  -1.494  10.748  -1.452
  298   HD11  ILE  39          1HD1      ILE  39  -4.822  10.245  -2.761
  299   HD12  ILE  39          2HD1      ILE  39  -5.442   9.239  -4.071
  300   HD13  ILE  39          3HD1      ILE  39  -5.334   8.589  -2.435
  301    H    LYS  40           H        LYS  40  -0.630   7.622  -0.239
  302    HA   LYS  40           HA       LYS  40   0.841   9.854   0.683
  303    HB2  LYS  40           1HB      LYS  40   0.225   7.129   1.706
  304    HB3  LYS  40           2HB      LYS  40   1.580   7.979   2.438
  305    HG2  LYS  40           1HG      LYS  40  -0.116   8.635   3.814
  306    HG3  LYS  40           2HG      LYS  40  -0.156   9.937   2.623
  307    HD2  LYS  40           1HD      LYS  40  -2.402   9.265   2.934
  308    HD3  LYS  40           2HD      LYS  40  -1.898   8.575   1.390
  309    HE2  LYS  40           1HE      LYS  40  -2.923   6.761   2.346
  310    HE3  LYS  40           2HE      LYS  40  -1.262   6.512   2.884
  311    HZ1  LYS  40           1HZ      LYS  40  -3.074   8.074   4.582
  312    HZ2  LYS  40           2HZ      LYS  40  -1.768   7.093   5.020
  313    HZ3  LYS  40           3HZ      LYS  40  -3.237   6.390   4.562
  314    H    HIS  41           H        HIS  41   1.798   6.717  -0.625
  315    HA   HIS  41           HA       HIS  41   4.604   7.605  -0.574
  316    HB2  HIS  41           1HB      HIS  41   3.492   4.800  -0.802
  317    HB3  HIS  41           2HB      HIS  41   5.201   5.223  -0.779
  318    HD2  HIS  41           2HD      HIS  41   5.005   7.296   1.829
  319    HE1  HIS  41           1HE      HIS  41   3.643   3.813   3.833
  320    HE2  HIS  41           2HE      HIS  41   4.511   6.162   4.101
  321    H    ARG  42           H        ARG  42   2.371   8.143  -2.566
  322    HA   ARG  42           HA       ARG  42   3.087   6.743  -4.953
  323    HB2  ARG  42           1HB      ARG  42   0.916   7.505  -5.072
  324    HB3  ARG  42           2HB      ARG  42   1.291   9.021  -4.265
  325    HG2  ARG  42           1HG      ARG  42   0.771   9.567  -6.495
  326    HG3  ARG  42           2HG      ARG  42   2.525   9.695  -6.355
  327    HD2  ARG  42           1HD      ARG  42   2.462   7.200  -7.151
  328    HD3  ARG  42           2HD      ARG  42   0.873   7.650  -7.767
  329    HE   ARG  42           HE       ARG  42   3.393   8.360  -8.875
  330   HH11  ARG  42          2HH1      ARG  42   0.147   9.521  -8.385
  331   HH12  ARG  42          1HH1      ARG  42   0.176  10.572  -9.761
  332   HH21  ARG  42          2HH2      ARG  42   3.442   9.741 -10.691
  333   HH22  ARG  42          1HH2      ARG  42   2.050  10.696 -11.073
  334    H    HIS  43           H        HIS  43   3.975   9.812  -3.491
  335    HA   HIS  43           HA       HIS  43   5.438  10.735  -5.786
  336    HB2  HIS  43           1HB      HIS  43   4.350  12.044  -3.722
  337    HB3  HIS  43           2HB      HIS  43   5.985  11.866  -3.090
  338    HD1  HIS  43           1HD      HIS  43   7.818  13.286  -4.146
  339    HD2  HIS  43           2HD      HIS  43   4.134  13.686  -6.024
  340    HE1  HIS  43           1HE      HIS  43   8.065  15.249  -5.699
  341    HA   PRO  44           HA       PRO  44   9.220   8.600  -5.061
  342    HB2  PRO  44           1HB      PRO  44  10.901  10.251  -6.409
  343    HB3  PRO  44           2HB      PRO  44   9.772   9.159  -7.220
  344    HG2  PRO  44           1HG      PRO  44   9.506  12.089  -6.668
  345    HG3  PRO  44           2HG      PRO  44   9.105  11.187  -8.141
  346    HD2  PRO  44           1HD      PRO  44   7.229  11.945  -6.342
  347    HD3  PRO  44           2HD      PRO  44   7.090  10.454  -7.296
  348    H    LEU  45           H        LEU  45   8.324  11.279  -3.465
  349    HA   LEU  45           HA       LEU  45  10.964  11.766  -2.268
  350    HB2  LEU  45           1HB      LEU  45   8.442  13.389  -2.368
  351    HB3  LEU  45           2HB      LEU  45   9.724  13.743  -1.213
  352    HG   LEU  45           HG       LEU  45  10.028  13.775  -4.215
  353   HD11  LEU  45          1HD1      LEU  45   9.575  15.954  -2.199
  354   HD12  LEU  45          2HD1      LEU  45   8.675  15.616  -3.678
  355   HD13  LEU  45          3HD1      LEU  45  10.314  16.260  -3.771
  356   HD21  LEU  45          1HD2      LEU  45  11.904  14.305  -1.936
  357   HD22  LEU  45          2HD2      LEU  45  12.153  15.036  -3.522
  358   HD23  LEU  45          3HD2      LEU  45  12.139  13.280  -3.352
  359    H    ASP  46           H        ASP  46   7.738  10.634  -1.627
  360    HA   ASP  46           HA       ASP  46   8.361  10.342   1.228
  361    HB2  ASP  46           1HB      ASP  46   5.776  10.322  -0.317
  362    HB3  ASP  46           2HB      ASP  46   5.868   9.708   1.332
  363    H    HIS  47           H        HIS  47   9.426   8.654  -0.976
  364    HA   HIS  47           HA       HIS  47   9.017   6.119   0.294
  365    HB2  HIS  47           1HB      HIS  47   7.826   4.964  -1.298
  366    HB3  HIS  47           2HB      HIS  47   7.084   6.553  -1.461
  367    HD1  HIS  47           1HD      HIS  47   6.792   7.175  -3.823
  368    HD2  HIS  47           2HD      HIS  47  10.191   4.853  -3.262
  369    HE1  HIS  47           1HE      HIS  47   7.810   6.910  -6.107
  370    H    ASP  48           H        ASP  48  10.804   4.907   0.102
  371    HA   ASP  48           HA       ASP  48  13.140   5.906  -1.045
  372    HB2  ASP  48           1HB      ASP  48  13.452   4.326   0.656
  373    HB3  ASP  48           2HB      ASP  48  12.333   3.179  -0.076
  374    H    CYS  49           H        CYS  49  12.598   6.509  -3.192
  375    HA   CYS  49           HA       CYS  49  11.695   4.636  -5.128
  376    HB2  CYS  49           1HB      CYS  49  11.531   7.181  -5.236
  377    HB3  CYS  49           2HB      CYS  49  13.224   7.168  -5.717
  378    H    SER  50           H        SER  50  12.784   3.160  -6.251
  379    HA   SER  50           HA       SER  50  15.701   3.416  -6.486
  380    HB2  SER  50           1HB      SER  50  15.954   1.002  -6.035
  381    HB3  SER  50           2HB      SER  50  15.265   1.852  -4.651
  382    HG   SER  50           HG       SER  50  13.983   0.111  -4.903
  383    H    GLY  51           H        GLY  51  13.874   4.125  -8.454
  384    HA2  GLY  51           1HA      GLY  51  13.432   1.968 -10.289
  385    HA3  GLY  51           2HA      GLY  51  13.212   3.679 -10.620
  386    H    GLU  52           H        GLU  52  15.153   4.951 -11.093
  387    HA   GLU  52           HA       GLU  52  17.290   3.304 -12.277
  388    HB2  GLU  52           1HB      GLU  52  17.476   5.053 -14.051
  389    HB3  GLU  52           2HB      GLU  52  15.967   4.152 -14.088
  390    HG2  GLU  52           1HG      GLU  52  14.851   6.007 -12.929
  391    HG3  GLU  52           2HG      GLU  52  16.362   6.914 -12.959
  392    H    GLY  53           H        GLY  53  19.107   3.619 -11.178
  393    HA2  GLY  53           1HA      GLY  53  20.006   6.344 -10.672
  394    HA3  GLY  53           2HA      GLY  53  19.781   5.330  -9.255
  395    H    HIS  54           H        HIS  54  21.822   5.003  -8.574
  396    HA   HIS  54           HA       HIS  54  23.749   3.928 -10.526
  397    HB2  HIS  54           1HB      HIS  54  24.254   6.137  -9.304
  398    HB3  HIS  54           2HB      HIS  54  24.498   5.139  -7.872
  399    HD1  HIS  54           1HD      HIS  54  26.550   6.815  -9.959
  400    HD2  HIS  54           2HD      HIS  54  26.306   2.758  -9.096
  401    HE1  HIS  54           1HE      HIS  54  28.805   5.867 -10.542
  402    HA   PRO  55           HA       PRO  55  23.363   0.114  -8.295
  403    HB2  PRO  55           1HB      PRO  55  25.377  -1.193  -9.562
  404    HB3  PRO  55           2HB      PRO  55  23.797  -0.916 -10.303
  405    HG2  PRO  55           1HG      PRO  55  26.355   0.595 -10.674
  406    HG3  PRO  55           2HG      PRO  55  25.171   0.083 -11.891
  407    HD2  PRO  55           1HD      PRO  55  25.270   2.612 -10.926
  408    HD3  PRO  55           2HD      PRO  55  23.752   1.841 -11.431
  409    H    THR  56           H        THR  56  24.151  -0.438  -6.366
  410    HA   THR  56           HA       THR  56  26.617   0.741  -5.421
  411    HB   THR  56           HB       THR  56  26.032  -0.299  -3.250
  412    HG1  THR  56           1HG      THR  56  23.760  -1.254  -4.689
  413   HG21  THR  56          1HG2      THR  56  23.508   0.836  -3.449
  414   HG22  THR  56          2HG2      THR  56  24.444   1.648  -4.704
  415   HG23  THR  56          3HG2      THR  56  25.002   1.673  -3.032
  416    H    SER  57           H        SER  57  28.264  -0.303  -6.529
  417    HA   SER  57           HA       SER  57  28.645  -3.135  -5.810
  418    HB2  SER  57           1HB      SER  57  29.021  -1.752  -8.442
  419    HB3  SER  57           2HB      SER  57  30.040  -3.133  -8.037
  420    HG   SER  57           HG       SER  57  28.110  -3.725  -9.154
  421    H    SER  58           H        SER  58  29.943  -2.657  -4.043
  422    HA   SER  58           HA       SER  58  32.306  -1.005  -4.420
  423    HB2  SER  58           1HB      SER  58  30.939  -0.894  -2.321
  424    HB3  SER  58           2HB      SER  58  31.453  -2.540  -1.955
  425    HG   SER  58           HG       SER  58  32.725  -0.787  -0.990
  426    H    GLY  59           H        GLY  59  32.344  -3.239  -6.053
  427    HA2  GLY  59           1HA      GLY  59  33.722  -4.961  -6.686
  428    HA3  GLY  59           2HA      GLY  59  34.866  -4.329  -5.511
  429    HA   PRO  60           HA       PRO  60  33.725  -8.555  -4.092
  430    HB2  PRO  60           1HB      PRO  60  36.232  -9.187  -3.264
  431    HB3  PRO  60           2HB      PRO  60  35.692  -9.391  -4.935
  432    HG2  PRO  60           1HG      PRO  60  37.304  -7.179  -3.722
  433    HG3  PRO  60           2HG      PRO  60  37.535  -8.013  -5.270
  434    HD2  PRO  60           1HD      PRO  60  36.362  -5.579  -5.086
  435    HD3  PRO  60           2HD      PRO  60  35.910  -6.766  -6.327
  436    H    SER  61           H        SER  61  35.344  -5.843  -2.625
  437    HA   SER  61           HA       SER  61  35.590  -5.149  -0.464
  438    HB2  SER  61           1HB      SER  61  32.881  -6.482  -0.392
  439    HB3  SER  61           2HB      SER  61  33.529  -5.570   0.970
  440    HG   SER  61           HG       SER  61  32.660  -4.676  -1.528
  441    H    SER  62           H        SER  62  37.014  -7.466  -0.967
  442    HA   SER  62           HA       SER  62  36.612  -9.098   1.447
  443    HB2  SER  62           1HB      SER  62  38.118  -9.688  -1.110
  444    HB3  SER  62           2HB      SER  62  38.119 -10.744   0.302
  445    HG   SER  62           HG       SER  62  36.114 -10.249  -1.555
  446    H    GLY  63           H        GLY  63  39.314  -7.860  -0.537
  447    HA2  GLY  63           1HA      GLY  63  41.439  -7.214   0.059
  448    HA3  GLY  63           2HA      GLY  63  40.632  -6.429   1.408
  Start of MODEL    7
    1    H1   GLY   1           H        GLY   1 -16.719 -27.779   3.503
    2    HA2  GLY   1           1HA      GLY   1 -17.363 -24.971   3.050
    3    HA3  GLY   1           2HA      GLY   1 -16.110 -25.299   4.237
    4    H    SER   2           H        SER   2 -15.616 -23.794   1.961
    5    HA   SER   2           HA       SER   2 -13.630 -25.489   0.644
    6    HB2  SER   2           1HB      SER   2 -15.789 -25.274  -0.749
    7    HB3  SER   2           2HB      SER   2 -15.303 -23.597  -0.998
    8    HG   SER   2           HG       SER   2 -14.588 -25.241  -2.598
    9    H    SER   3           H        SER   3 -12.184 -24.047  -0.803
   10    HA   SER   3           HA       SER   3 -10.737 -22.314   0.718
   11    HB2  SER   3           1HB      SER   3 -11.133 -22.395  -2.271
   12    HB3  SER   3           2HB      SER   3  -9.996 -21.282  -1.511
   13    HG   SER   3           HG       SER   3  -9.335 -23.453  -0.423
   14    H    GLY   4           H        GLY   4 -10.427 -19.944   0.506
   15    HA2  GLY   4           1HA      GLY   4 -13.036 -18.585   0.220
   16    HA3  GLY   4           2HA      GLY   4 -11.862 -18.166   1.459
   17    H    SER   5           H        SER   5 -11.906 -15.994   0.708
   18    HA   SER   5           HA       SER   5 -10.145 -15.581  -1.596
   19    HB2  SER   5           1HB      SER   5 -11.583 -13.643  -2.308
   20    HB3  SER   5           2HB      SER   5 -12.335 -15.223  -2.530
   21    HG   SER   5           HG       SER   5 -13.808 -14.713  -1.114
   22    H    SER   6           H        SER   6  -9.110 -13.477  -1.614
   23    HA   SER   6           HA       SER   6  -8.784 -12.423   1.112
   24    HB2  SER   6           1HB      SER   6  -6.801 -13.425  -0.191
   25    HB3  SER   6           2HB      SER   6  -6.869 -11.959  -1.169
   26    HG   SER   6           HG       SER   6  -5.675 -11.163   0.368
   27    H    GLY   7           H        GLY   7  -8.791 -11.323  -2.282
   28    HA2  GLY   7           1HA      GLY   7  -9.637  -8.666  -1.324
   29    HA3  GLY   7           2HA      GLY   7  -8.839  -8.977  -2.859
   30    H    ARG   8           H        ARG   8 -11.672  -8.069  -1.603
   31    HA   ARG   8           HA       ARG   8 -13.509  -9.687  -3.082
   32    HB2  ARG   8           1HB      ARG   8 -14.049  -8.406  -0.976
   33    HB3  ARG   8           2HB      ARG   8 -14.002  -6.936  -1.940
   34    HG2  ARG   8           1HG      ARG   8 -16.276  -7.592  -1.706
   35    HG3  ARG   8           2HG      ARG   8 -15.793  -7.903  -3.375
   36    HD2  ARG   8           1HD      ARG   8 -15.573 -10.071  -1.331
   37    HD3  ARG   8           2HD      ARG   8 -17.141  -9.696  -2.044
   38    HE   ARG   8           HE       ARG   8 -15.593  -9.977  -4.215
   39   HH11  ARG   8          2HH1      ARG   8 -16.003 -11.953  -1.378
   40   HH12  ARG   8          1HH1      ARG   8 -15.660 -13.437  -2.203
   41   HH21  ARG   8          2HH2      ARG   8 -15.139 -11.924  -5.312
   42   HH22  ARG   8          1HH2      ARG   8 -15.167 -13.420  -4.441
   43    H    LYS   9           H        LYS   9 -12.424  -6.308  -3.437
   44    HA   LYS   9           HA       LYS   9 -13.230  -6.443  -6.267
   45    HB2  LYS   9           1HB      LYS   9 -12.922  -4.011  -4.495
   46    HB3  LYS   9           2HB      LYS   9 -13.398  -3.988  -6.188
   47    HG2  LYS   9           1HG      LYS   9 -15.008  -5.631  -4.312
   48    HG3  LYS   9           2HG      LYS   9 -15.170  -3.875  -4.238
   49    HD2  LYS   9           1HD      LYS   9 -16.760  -4.310  -5.810
   50    HD3  LYS   9           2HD      LYS   9 -15.358  -4.172  -6.874
   51    HE2  LYS   9           1HE      LYS   9 -15.275  -6.419  -7.280
   52    HE3  LYS   9           2HE      LYS   9 -15.969  -6.838  -5.714
   53    HZ1  LYS   9           1HZ      LYS   9 -17.296  -6.220  -8.227
   54    HZ2  LYS   9           2HZ      LYS   9 -18.033  -5.610  -6.832
   55    HZ3  LYS   9           3HZ      LYS   9 -17.761  -7.273  -6.987
   56    H    ILE  10           H        ILE  10 -11.359  -7.200  -7.182
   57    HA   ILE  10           HA       ILE  10  -8.760  -6.763  -6.613
   58    HB   ILE  10           HB       ILE  10  -8.240  -6.936  -9.024
   59   HG12  ILE  10          1HG1      ILE  10 -11.241  -6.861  -9.403
   60   HG13  ILE  10          2HG1      ILE  10 -10.149  -5.542  -9.811
   61   HG21  ILE  10          1HG2      ILE  10  -8.959  -8.879  -7.498
   62   HG22  ILE  10          2HG2      ILE  10 -10.461  -8.854  -8.420
   63   HG23  ILE  10          3HG2      ILE  10  -8.928  -9.150  -9.240
   64   HD11  ILE  10          1HD1      ILE  10 -10.981  -7.404 -11.556
   65   HD12  ILE  10          2HD1      ILE  10  -9.452  -6.536 -11.699
   66   HD13  ILE  10          3HD1      ILE  10  -9.487  -8.151 -10.992
   67    H    PHE  11           H        PHE  11 -10.960  -4.454  -8.058
   68    HA   PHE  11           HA       PHE  11  -9.345  -2.556  -9.135
   69    HB2  PHE  11           1HB      PHE  11 -11.735  -2.105  -7.338
   70    HB3  PHE  11           2HB      PHE  11 -11.005  -0.863  -8.349
   71    HD1  PHE  11           1HD      PHE  11 -10.557  -1.983 -10.879
   72    HD2  PHE  11           2HD      PHE  11 -13.739  -2.816  -8.178
   73    HE1  PHE  11           1HE      PHE  11 -11.970  -2.686 -12.766
   74    HE2  PHE  11           2HE      PHE  11 -15.157  -3.521 -10.060
   75    HZ   PHE  11           HZ       PHE  11 -14.273  -3.457 -12.358
   76    H    THR  12           H        THR  12 -10.051  -2.951  -5.680
   77    HA   THR  12           HA       THR  12  -8.477  -0.764  -4.813
   78    HB   THR  12           HB       THR  12  -8.613  -1.792  -2.568
   79    HG1  THR  12           1HG      THR  12  -8.705  -4.027  -3.749
   80   HG21  THR  12          1HG2      THR  12 -10.901  -1.424  -2.265
   81   HG22  THR  12          2HG2      THR  12 -11.311  -2.070  -3.854
   82   HG23  THR  12          3HG2      THR  12 -10.526  -0.497  -3.717
   83    H    ASN  13           H        ASN  13  -6.460  -0.899  -5.824
   84    HA   ASN  13           HA       ASN  13  -4.796  -3.178  -5.761
   85    HB2  ASN  13           1HB      ASN  13  -2.979  -1.267  -6.082
   86    HB3  ASN  13           2HB      ASN  13  -4.088  -1.707  -7.377
   87   HD21  ASN  13          1HD2      ASN  13  -6.041  -0.411  -7.595
   88   HD22  ASN  13          2HD2      ASN  13  -5.976   1.268  -7.192
   89    H    LYS  14           H        LYS  14  -2.547  -3.055  -4.710
   90    HA   LYS  14           HA       LYS  14  -2.798  -2.076  -1.943
   91    HB2  LYS  14           1HB      LYS  14  -3.095  -4.437  -1.815
   92    HB3  LYS  14           2HB      LYS  14  -1.763  -4.733  -2.924
   93    HG2  LYS  14           1HG      LYS  14  -0.405  -3.475  -1.022
   94    HG3  LYS  14           2HG      LYS  14  -1.725  -4.101  -0.031
   95    HD2  LYS  14           1HD      LYS  14  -1.228  -6.341  -0.625
   96    HD3  LYS  14           2HD      LYS  14  -0.141  -5.831  -1.918
   97    HE2  LYS  14           1HE      LYS  14   0.402  -5.070   0.927
   98    HE3  LYS  14           2HE      LYS  14   0.860  -6.661   0.321
   99    HZ1  LYS  14           1HZ      LYS  14   1.698  -4.110  -0.941
  100    HZ2  LYS  14           2HZ      LYS  14   2.253  -5.664  -1.313
  101    HZ3  LYS  14           3HZ      LYS  14   2.640  -4.961   0.177
  102    H    CYS  15           H        CYS  15  -1.238  -0.721  -1.372
  103    HA   CYS  15           HA       CYS  15   0.774   0.206  -2.983
  104    HB2  CYS  15           1HB      CYS  15   0.007   1.241  -0.838
  105    HB3  CYS  15           2HB      CYS  15   0.941   0.028   0.031
  106    H    GLU  16           H        GLU  16   2.843  -0.335  -3.462
  107    HA   GLU  16           HA       GLU  16   3.695  -3.018  -2.723
  108    HB2  GLU  16           1HB      GLU  16   4.763  -1.017  -4.716
  109    HB3  GLU  16           2HB      GLU  16   5.518  -2.575  -4.408
  110    HG2  GLU  16           1HG      GLU  16   3.169  -3.532  -4.947
  111    HG3  GLU  16           2HG      GLU  16   2.906  -1.966  -5.714
  112    H    ARG  17           H        ARG  17   3.798  -0.532  -0.944
  113    HA   ARG  17           HA       ARG  17   6.667  -0.333  -0.447
  114    HB2  ARG  17           1HB      ARG  17   5.475   1.757  -0.421
  115    HB3  ARG  17           2HB      ARG  17   4.296   1.127   0.721
  116    HG2  ARG  17           1HG      ARG  17   5.618   2.369   2.109
  117    HG3  ARG  17           2HG      ARG  17   6.400   0.793   2.242
  118    HD2  ARG  17           1HD      ARG  17   7.897   1.580   0.323
  119    HD3  ARG  17           2HD      ARG  17   7.273   3.193   0.663
  120    HE   ARG  17           HE       ARG  17   8.493   3.234   2.624
  121   HH11  ARG  17          2HH1      ARG  17   8.610   0.063   1.192
  122   HH12  ARG  17          1HH1      ARG  17   9.881  -0.500   2.227
  123   HH21  ARG  17          2HH2      ARG  17  10.166   2.505   3.992
  124   HH22  ARG  17          1HH2      ARG  17  10.765   0.890   3.820
  125    H    ALA  18           H        ALA  18   7.651  -1.572   0.997
  126    HA   ALA  18           HA       ALA  18   6.512  -3.606   2.444
  127    HB1  ALA  18           1HB      ALA  18   9.082  -2.196   2.497
  128    HB2  ALA  18           2HB      ALA  18   8.655  -3.007   4.005
  129    HB3  ALA  18           3HB      ALA  18   8.732  -3.925   2.502
  130    H    GLY  19           H        GLY  19   5.535  -3.845   4.388
  131    HA2  GLY  19           1HA      GLY  19   4.751  -3.297   6.501
  132    HA3  GLY  19           2HA      GLY  19   5.633  -1.780   6.400
  133    H    CYS  20           H        CYS  20   4.515  -0.780   4.021
  134    HA   CYS  20           HA       CYS  20   2.113   0.352   5.046
  135    HB2  CYS  20           1HB      CYS  20   3.788   1.469   3.489
  136    HB3  CYS  20           2HB      CYS  20   3.076   0.517   2.191
  137    H    ARG  21           H        ARG  21   0.125  -0.437   4.947
  138    HA   ARG  21           HA       ARG  21  -0.480  -2.465   2.898
  139    HB2  ARG  21           1HB      ARG  21  -1.399  -2.145   5.738
  140    HB3  ARG  21           2HB      ARG  21  -2.371  -3.046   4.583
  141    HG2  ARG  21           1HG      ARG  21   0.522  -3.670   5.082
  142    HG3  ARG  21           2HG      ARG  21  -0.784  -4.380   6.032
  143    HD2  ARG  21           1HD      ARG  21  -0.882  -4.507   3.049
  144    HD3  ARG  21           2HD      ARG  21   0.151  -5.627   3.936
  145    HE   ARG  21           HE       ARG  21  -2.575  -5.499   4.875
  146   HH11  ARG  21          2HH1      ARG  21  -0.326  -7.039   2.709
  147   HH12  ARG  21          1HH1      ARG  21  -1.268  -8.484   2.549
  148   HH21  ARG  21          2HH2      ARG  21  -3.824  -7.397   4.673
  149   HH22  ARG  21          1HH2      ARG  21  -3.258  -8.687   3.666
  150    H    GLN  22           H        GLN  22  -0.670   0.409   2.536
  151    HA   GLN  22           HA       GLN  22  -3.299   1.355   2.812
  152    HB2  GLN  22           1HB      GLN  22  -0.917   2.126   1.216
  153    HB3  GLN  22           2HB      GLN  22  -2.471   2.749   0.677
  154    HG2  GLN  22           1HG      GLN  22  -1.039   3.243   3.256
  155    HG3  GLN  22           2HG      GLN  22  -1.641   4.407   2.076
  156   HE21  GLN  22          1HE2      GLN  22  -2.378   2.480   4.823
  157   HE22  GLN  22          2HE2      GLN  22  -3.985   3.061   5.076
  158    H    ARG  23           H        ARG  23  -4.960   1.612   1.245
  159    HA   ARG  23           HA       ARG  23  -4.825  -0.211  -1.053
  160    HB2  ARG  23           1HB      ARG  23  -6.824  -0.197   1.169
  161    HB3  ARG  23           2HB      ARG  23  -7.361  -0.617  -0.452
  162    HG2  ARG  23           1HG      ARG  23  -5.691  -2.407  -0.533
  163    HG3  ARG  23           2HG      ARG  23  -5.183  -1.994   1.106
  164    HD2  ARG  23           1HD      ARG  23  -6.694  -3.884   1.160
  165    HD3  ARG  23           2HD      ARG  23  -7.457  -2.482   1.909
  166    HE   ARG  23           HE       ARG  23  -8.117  -2.702  -0.854
  167   HH11  ARG  23          2HH1      ARG  23  -8.861  -3.955   2.308
  168   HH12  ARG  23          1HH1      ARG  23 -10.478  -4.413   1.889
  169   HH21  ARG  23          2HH2      ARG  23 -10.245  -3.301  -1.418
  170   HH22  ARG  23          1HH2      ARG  23 -11.264  -4.042  -0.231
  171    H    GLU  24           H        GLU  24  -4.612   1.536  -2.455
  172    HA   GLU  24           HA       GLU  24  -6.583   3.661  -2.416
  173    HB2  GLU  24           1HB      GLU  24  -4.205   3.083  -4.177
  174    HB3  GLU  24           2HB      GLU  24  -5.309   4.415  -4.486
  175    HG2  GLU  24           1HG      GLU  24  -3.203   4.987  -3.240
  176    HG3  GLU  24           2HG      GLU  24  -4.711   5.511  -2.493
  177    H    MET  25           H        MET  25  -8.364   3.774  -3.635
  178    HA   MET  25           HA       MET  25  -9.368   1.551  -4.999
  179    HB2  MET  25           1HB      MET  25 -10.675   3.500  -4.044
  180    HB3  MET  25           2HB      MET  25 -10.219   4.406  -5.481
  181    HG2  MET  25           1HG      MET  25 -11.247   2.436  -6.780
  182    HG3  MET  25           2HG      MET  25 -12.010   2.025  -5.246
  183    HE1  MET  25           1HE      MET  25 -14.283   2.262  -6.896
  184    HE2  MET  25           2HE      MET  25 -14.710   3.790  -7.666
  185    HE3  MET  25           3HE      MET  25 -13.286   2.898  -8.205
  186    H    MET  26           H        MET  26  -7.726   4.446  -6.197
  187    HA   MET  26           HA       MET  26  -7.845   3.417  -8.929
  188    HB2  MET  26           1HB      MET  26  -7.151   5.571  -9.648
  189    HB3  MET  26           2HB      MET  26  -8.343   5.835  -8.382
  190    HG2  MET  26           1HG      MET  26  -6.794   6.633  -6.896
  191    HG3  MET  26           2HG      MET  26  -5.461   5.762  -7.651
  192    HE1  MET  26           1HE      MET  26  -6.649  10.040  -8.290
  193    HE2  MET  26           2HE      MET  26  -7.823   8.831  -7.770
  194    HE3  MET  26           3HE      MET  26  -6.372   9.122  -6.809
  195    H    LYS  27           H        LYS  27  -6.025   2.939 -10.150
  196    HA   LYS  27           HA       LYS  27  -3.802   1.895  -8.700
  197    HB2  LYS  27           1HB      LYS  27  -4.830   1.064 -10.925
  198    HB3  LYS  27           2HB      LYS  27  -3.840   2.308 -11.678
  199    HG2  LYS  27           1HG      LYS  27  -1.855   1.259 -11.104
  200    HG3  LYS  27           2HG      LYS  27  -2.613   0.308  -9.824
  201    HD2  LYS  27           1HD      LYS  27  -2.177  -1.187 -11.615
  202    HD3  LYS  27           2HD      LYS  27  -3.915  -0.874 -11.632
  203    HE2  LYS  27           1HE      LYS  27  -3.383  -0.661 -13.863
  204    HE3  LYS  27           2HE      LYS  27  -3.275   1.011 -13.314
  205    HZ1  LYS  27           1HZ      LYS  27  -1.101   1.077 -13.735
  206    HZ2  LYS  27           2HZ      LYS  27  -1.342  -0.322 -14.654
  207    HZ3  LYS  27           3HZ      LYS  27  -0.809  -0.443 -13.053
  208    H    LEU  28           H        LEU  28  -1.883   2.790  -8.259
  209    HA   LEU  28           HA       LEU  28  -1.149   5.284  -9.636
  210    HB2  LEU  28           1HB      LEU  28  -0.973   4.702  -6.685
  211    HB3  LEU  28           2HB      LEU  28  -0.205   6.081  -7.469
  212    HG   LEU  28           HG       LEU  28  -3.150   5.720  -7.765
  213   HD11  LEU  28          1HD1      LEU  28  -1.714   6.484  -5.260
  214   HD12  LEU  28          2HD1      LEU  28  -3.145   5.477  -5.470
  215   HD13  LEU  28          3HD1      LEU  28  -3.264   7.226  -5.656
  216   HD21  LEU  28          1HD2      LEU  28  -3.132   7.908  -8.339
  217   HD22  LEU  28          2HD2      LEU  28  -1.453   7.547  -8.739
  218   HD23  LEU  28          3HD2      LEU  28  -1.849   8.313  -7.199
  219    H    THR  29           H        THR  29   0.413   4.411 -10.923
  220    HA   THR  29           HA       THR  29   2.538   2.833  -9.659
  221    HB   THR  29           HB       THR  29   2.096   3.328 -12.608
  222    HG1  THR  29           1HG      THR  29   1.514   0.916 -11.246
  223   HG21  THR  29          1HG2      THR  29   3.772   1.268 -11.167
  224   HG22  THR  29          2HG2      THR  29   4.394   2.703 -11.982
  225   HG23  THR  29          3HG2      THR  29   3.599   1.435 -12.913
  226    H    CYS  30           H        CYS  30   4.549   3.598  -9.390
  227    HA   CYS  30           HA       CYS  30   5.112   6.330  -9.554
  228    HB2  CYS  30           1HB      CYS  30   6.279   4.580  -8.126
  229    HB3  CYS  30           2HB      CYS  30   7.197   4.149  -9.566
  230    H    GLU  31           H        GLU  31   6.950   7.300 -10.802
  231    HA   GLU  31           HA       GLU  31   6.720   6.489 -13.614
  232    HB2  GLU  31           1HB      GLU  31   7.211   8.721 -14.220
  233    HB3  GLU  31           2HB      GLU  31   6.085   8.833 -12.874
  234    HG2  GLU  31           1HG      GLU  31   8.989   8.891 -12.270
  235    HG3  GLU  31           2HG      GLU  31   8.259  10.318 -13.005
  236    H    ARG  32           H        ARG  32   8.866   6.471 -11.000
  237    HA   ARG  32           HA       ARG  32  11.240   6.413 -12.712
  238    HB2  ARG  32           1HB      ARG  32  10.861   6.572  -9.726
  239    HB3  ARG  32           2HB      ARG  32  12.430   6.258 -10.455
  240    HG2  ARG  32           1HG      ARG  32  12.414   8.377 -11.564
  241    HG3  ARG  32           2HG      ARG  32  10.749   8.677 -11.062
  242    HD2  ARG  32           1HD      ARG  32  11.603   8.495  -8.673
  243    HD3  ARG  32           2HD      ARG  32  13.225   8.586  -9.359
  244    HE   ARG  32           HE       ARG  32  11.292  10.731  -9.153
  245   HH11  ARG  32          2HH1      ARG  32  14.233   9.583 -10.622
  246   HH12  ARG  32          1HH1      ARG  32  14.803  11.168 -11.027
  247   HH21  ARG  32          2HH2      ARG  32  12.033  12.823  -9.680
  248   HH22  ARG  32          1HH2      ARG  32  13.551  13.010 -10.489
  249    H    CYS  33           H        CYS  33   9.860   4.481 -10.046
  250    HA   CYS  33           HA       CYS  33  11.386   2.164 -10.923
  251    HB2  CYS  33           1HB      CYS  33  10.363   1.089  -8.891
  252    HB3  CYS  33           2HB      CYS  33  11.345   2.511  -8.554
  253    H    SER  34           H        SER  34   8.247   3.481 -11.269
  254    HA   SER  34           HA       SER  34   6.374   2.769 -12.345
  255    HB2  SER  34           1HB      SER  34   8.253   0.642 -13.399
  256    HB3  SER  34           2HB      SER  34   6.624   0.933 -14.008
  257    HG   SER  34           HG       SER  34   7.282   3.008 -14.626
  258    H    ARG  35           H        ARG  35   6.291   2.154  -9.789
  259    HA   ARG  35           HA       ARG  35   5.152  -0.558  -9.744
  260    HB2  ARG  35           1HB      ARG  35   7.004   0.716  -7.744
  261    HB3  ARG  35           2HB      ARG  35   5.923  -0.593  -7.287
  262    HG2  ARG  35           1HG      ARG  35   6.957  -1.982  -9.076
  263    HG3  ARG  35           2HG      ARG  35   8.124  -0.684  -9.334
  264    HD2  ARG  35           1HD      ARG  35   8.941  -0.905  -7.081
  265    HD3  ARG  35           2HD      ARG  35   7.683  -2.079  -6.699
  266    HE   ARG  35           HE       ARG  35   9.147  -3.067  -8.856
  267   HH11  ARG  35          2HH1      ARG  35   9.612  -2.314  -5.489
  268   HH12  ARG  35          1HH1      ARG  35  10.839  -3.515  -5.255
  269   HH21  ARG  35          2HH2      ARG  35  10.762  -4.651  -8.561
  270   HH22  ARG  35          1HH2      ARG  35  11.493  -4.843  -7.003
  271    H    ASN  36           H        ASN  36   3.412  -0.871  -8.273
  272    HA   ASN  36           HA       ASN  36   1.694   1.392  -8.054
  273    HB2  ASN  36           1HB      ASN  36   0.956  -0.997  -8.429
  274    HB3  ASN  36           2HB      ASN  36   1.321  -1.300  -6.733
  275   HD21  ASN  36          1HD2      ASN  36  -0.086  -0.661  -5.193
  276   HD22  ASN  36          2HD2      ASN  36  -1.598   0.107  -5.521
  277    H    PHE  37           H        PHE  37   0.999   2.494  -6.241
  278    HA   PHE  37           HA       PHE  37   1.942   1.821  -3.612
  279    HB2  PHE  37           1HB      PHE  37   2.985   4.338  -4.928
  280    HB3  PHE  37           2HB      PHE  37   3.228   3.880  -3.245
  281    HD1  PHE  37           2HD      PHE  37   4.381   1.570  -2.864
  282    HD2  PHE  37           1HD      PHE  37   4.585   3.793  -6.488
  283    HE1  PHE  37           2HE      PHE  37   6.425   0.354  -3.491
  284    HE2  PHE  37           1HE      PHE  37   6.630   2.579  -7.122
  285    HZ   PHE  37           HZ       PHE  37   7.553   0.858  -5.622
  286    H    CYS  38           H        CYS  38   1.435   3.830  -2.099
  287    HA   CYS  38           HA       CYS  38  -1.313   4.613  -2.760
  288    HB2  CYS  38           1HB      CYS  38  -1.652   4.930  -0.392
  289    HB3  CYS  38           2HB      CYS  38  -0.894   3.360  -0.643
  290    H    ILE  39           H        ILE  39  -2.046   6.758  -2.344
  291    HA   ILE  39           HA       ILE  39  -0.744   8.813  -3.457
  292    HB   ILE  39           HB       ILE  39  -2.567   8.901  -1.063
  293   HG12  ILE  39          1HG1      ILE  39  -3.018   9.704  -3.943
  294   HG13  ILE  39          2HG1      ILE  39  -3.444   8.131  -3.280
  295   HG21  ILE  39          1HG2      ILE  39  -2.781  11.296  -1.375
  296   HG22  ILE  39          2HG2      ILE  39  -1.104  10.876  -1.029
  297   HG23  ILE  39          3HG2      ILE  39  -1.596  11.253  -2.680
  298   HD11  ILE  39          1HD1      ILE  39  -5.286   8.916  -2.281
  299   HD12  ILE  39          2HD1      ILE  39  -4.512  10.427  -1.803
  300   HD13  ILE  39          3HD1      ILE  39  -5.127  10.232  -3.444
  301    H    LYS  40           H        LYS  40  -0.308   7.751  -0.117
  302    HA   LYS  40           HA       LYS  40   1.418   9.850   0.669
  303    HB2  LYS  40           1HB      LYS  40   0.786   7.124   1.734
  304    HB3  LYS  40           2HB      LYS  40   2.148   8.015   2.400
  305    HG2  LYS  40           1HG      LYS  40   0.503   8.667   3.832
  306    HG3  LYS  40           2HG      LYS  40   0.364   9.935   2.612
  307    HD2  LYS  40           1HD      LYS  40  -1.842   9.205   3.040
  308    HD3  LYS  40           2HD      LYS  40  -1.386   8.479   1.497
  309    HE2  LYS  40           1HE      LYS  40  -2.289   6.656   2.538
  310    HE3  LYS  40           2HE      LYS  40  -0.610   6.496   3.051
  311    HZ1  LYS  40           1HZ      LYS  40  -2.803   6.619   4.682
  312    HZ2  LYS  40           2HZ      LYS  40  -2.106   8.153   4.824
  313    HZ3  LYS  40           3HZ      LYS  40  -1.189   6.773   5.162
  314    H    HIS  41           H        HIS  41   2.008   6.619  -0.650
  315    HA   HIS  41           HA       HIS  41   4.865   7.282  -0.876
  316    HB2  HIS  41           1HB      HIS  41   3.472   4.598  -0.969
  317    HB3  HIS  41           2HB      HIS  41   5.203   4.839  -1.189
  318    HD2  HIS  41           2HD      HIS  41   5.570   6.921   1.404
  319    HE1  HIS  41           1HE      HIS  41   4.182   3.572   3.607
  320    HE2  HIS  41           2HE      HIS  41   5.293   5.829   3.732
  321    H    ARG  42           H        ARG  42   2.562   8.074  -2.665
  322    HA   ARG  42           HA       ARG  42   2.969   6.637  -5.117
  323    HB2  ARG  42           1HB      ARG  42   0.850   7.502  -5.112
  324    HB3  ARG  42           2HB      ARG  42   1.325   8.944  -4.225
  325    HG2  ARG  42           1HG      ARG  42   0.681   9.626  -6.401
  326    HG3  ARG  42           2HG      ARG  42   2.438   9.757  -6.312
  327    HD2  ARG  42           1HD      ARG  42   2.291   7.282  -7.252
  328    HD3  ARG  42           2HD      ARG  42   0.742   7.868  -7.855
  329    HE   ARG  42           HE       ARG  42   3.361   8.613  -8.783
  330   HH11  ARG  42          2HH1      ARG  42   0.015   9.551  -8.569
  331   HH12  ARG  42          1HH1      ARG  42   0.091  10.613  -9.936
  332   HH21  ARG  42          2HH2      ARG  42   3.473  10.008 -10.584
  333   HH22  ARG  42          1HH2      ARG  42   2.057  10.872 -11.082
  334    H    HIS  43           H        HIS  43   4.150   9.618  -3.690
  335    HA   HIS  43           HA       HIS  43   5.472  10.488  -6.096
  336    HB2  HIS  43           1HB      HIS  43   4.601  11.827  -3.929
  337    HB3  HIS  43           2HB      HIS  43   6.289  11.610  -3.475
  338    HD1  HIS  43           1HD      HIS  43   8.004  13.056  -4.638
  339    HD2  HIS  43           2HD      HIS  43   4.209  13.389  -6.296
  340    HE1  HIS  43           1HE      HIS  43   8.139  14.987  -6.243
  341    HA   PRO  44           HA       PRO  44   9.198   8.190  -5.629
  342    HB2  PRO  44           1HB      PRO  44  10.859   9.776  -7.076
  343    HB3  PRO  44           2HB      PRO  44   9.633   8.741  -7.816
  344    HG2  PRO  44           1HG      PRO  44   9.535  11.675  -7.235
  345    HG3  PRO  44           2HG      PRO  44   8.999  10.804  -8.683
  346    HD2  PRO  44           1HD      PRO  44   7.280  11.631  -6.762
  347    HD3  PRO  44           2HD      PRO  44   7.012  10.155  -7.711
  348    H    LEU  45           H        LEU  45   8.612  11.115  -4.158
  349    HA   LEU  45           HA       LEU  45  11.262  11.136  -2.870
  350    HB2  LEU  45           1HB      LEU  45   9.351  13.453  -2.946
  351    HB3  LEU  45           2HB      LEU  45  11.057  13.462  -2.504
  352    HG   LEU  45           HG       LEU  45   9.936  13.061  -5.277
  353   HD11  LEU  45          1HD1      LEU  45  10.825  15.401  -3.754
  354   HD12  LEU  45          2HD1      LEU  45   9.792  15.295  -5.179
  355   HD13  LEU  45          3HD1      LEU  45  11.546  15.247  -5.356
  356   HD21  LEU  45          1HD2      LEU  45  12.134  12.879  -6.069
  357   HD22  LEU  45          2HD2      LEU  45  12.078  11.818  -4.662
  358   HD23  LEU  45          3HD2      LEU  45  12.825  13.411  -4.536
  359    H    ASP  46           H        ASP  46   8.581   9.730  -2.300
  360    HA   ASP  46           HA       ASP  46   8.435  10.535   0.531
  361    HB2  ASP  46           1HB      ASP  46   6.232   9.861  -1.394
  362    HB3  ASP  46           2HB      ASP  46   6.016   9.580   0.332
  363    H    HIS  47           H        HIS  47   8.762   8.019  -1.788
  364    HA   HIS  47           HA       HIS  47   8.741   6.013   0.372
  365    HB2  HIS  47           1HB      HIS  47   8.085   4.344  -1.227
  366    HB3  HIS  47           2HB      HIS  47   6.984   5.708  -1.392
  367    HD1  HIS  47           1HD      HIS  47   6.938   6.917  -3.623
  368    HD2  HIS  47           2HD      HIS  47   9.910   4.023  -3.390
  369    HE1  HIS  47           1HE      HIS  47   7.818   6.666  -5.966
  370    H    ASP  48           H        ASP  48  10.975   7.677  -0.291
  371    HA   ASP  48           HA       ASP  48  13.165   7.613  -1.001
  372    HB2  ASP  48           1HB      ASP  48  12.639   5.129   0.582
  373    HB3  ASP  48           2HB      ASP  48  14.226   5.357  -0.147
  374    H    CYS  49           H        CYS  49  11.625   7.099  -3.182
  375    HA   CYS  49           HA       CYS  49  11.799   4.796  -4.596
  376    HB2  CYS  49           1HB      CYS  49  10.786   6.955  -5.380
  377    HB3  CYS  49           2HB      CYS  49  12.407   7.504  -5.794
  378    H    SER  50           H        SER  50  13.262   3.885  -6.104
  379    HA   SER  50           HA       SER  50  16.075   4.606  -5.601
  380    HB2  SER  50           1HB      SER  50  14.713   1.955  -5.880
  381    HB3  SER  50           2HB      SER  50  16.398   2.108  -6.378
  382    HG   SER  50           HG       SER  50  16.527   3.197  -4.146
  383    H    GLY  51           H        GLY  51  13.826   3.308  -8.025
  384    HA2  GLY  51           1HA      GLY  51  13.746   4.070 -10.268
  385    HA3  GLY  51           2HA      GLY  51  15.394   4.659 -10.099
  386    H    GLU  52           H        GLU  52  13.740   2.602 -11.841
  387    HA   GLU  52           HA       GLU  52  15.181   0.157 -11.530
  388    HB2  GLU  52           1HB      GLU  52  12.857   0.563 -12.609
  389    HB3  GLU  52           2HB      GLU  52  13.772   0.968 -14.055
  390    HG2  GLU  52           1HG      GLU  52  13.081  -1.330 -14.149
  391    HG3  GLU  52           2HG      GLU  52  14.834  -1.245 -13.983
  392    H    GLY  53           H        GLY  53  16.777  -0.725 -12.883
  393    HA2  GLY  53           1HA      GLY  53  18.177   1.230 -14.598
  394    HA3  GLY  53           2HA      GLY  53  19.052   0.218 -13.458
  395    H    HIS  54           H        HIS  54  17.568   0.407 -16.557
  396    HA   HIS  54           HA       HIS  54  17.671  -2.415 -17.105
  397    HB2  HIS  54           1HB      HIS  54  16.021  -0.931 -18.198
  398    HB3  HIS  54           2HB      HIS  54  17.336  -0.090 -19.012
  399    HD1  HIS  54           1HD      HIS  54  16.023  -3.657 -18.773
  400    HD2  HIS  54           2HD      HIS  54  17.827  -1.072 -21.479
  401    HE1  HIS  54           1HE      HIS  54  16.141  -4.927 -20.940
  402    HA   PRO  55           HA       PRO  55  22.005  -2.459 -18.068
  403    HB2  PRO  55           1HB      PRO  55  22.083  -5.010 -18.993
  404    HB3  PRO  55           2HB      PRO  55  21.995  -4.615 -17.273
  405    HG2  PRO  55           1HG      PRO  55  19.805  -5.434 -19.142
  406    HG3  PRO  55           2HG      PRO  55  20.109  -5.960 -17.476
  407    HD2  PRO  55           1HD      PRO  55  18.247  -4.095 -18.099
  408    HD3  PRO  55           2HD      PRO  55  19.151  -4.068 -16.572
  409    H    THR  56           H        THR  56  22.329  -1.116 -19.792
  410    HA   THR  56           HA       THR  56  21.322  -1.814 -22.422
  411    HB   THR  56           HB       THR  56  22.399   0.293 -23.158
  412    HG1  THR  56           1HG      THR  56  23.948   1.030 -21.930
  413   HG21  THR  56          1HG2      THR  56  20.962   1.822 -21.855
  414   HG22  THR  56          2HG2      THR  56  20.668   0.527 -20.693
  415   HG23  THR  56          3HG2      THR  56  20.107   0.365 -22.357
  416    H    SER  57           H        SER  57  22.404  -3.566 -23.200
  417    HA   SER  57           HA       SER  57  25.248  -3.851 -22.951
  418    HB2  SER  57           1HB      SER  57  24.034  -5.885 -23.020
  419    HB3  SER  57           2HB      SER  57  23.125  -5.387 -24.447
  420    HG   SER  57           HG       SER  57  24.663  -6.706 -25.236
  421    H    SER  58           H        SER  58  26.105  -1.989 -23.915
  422    HA   SER  58           HA       SER  58  25.820  -1.867 -26.846
  423    HB2  SER  58           1HB      SER  58  26.451   0.365 -24.900
  424    HB3  SER  58           2HB      SER  58  26.447   0.532 -26.656
  425    HG   SER  58           HG       SER  58  24.230  -0.048 -26.620
  426    H    GLY  59           H        GLY  59  27.513  -3.003 -27.611
  427    HA2  GLY  59           1HA      GLY  59  30.168  -1.942 -27.126
  428    HA3  GLY  59           2HA      GLY  59  29.924  -3.594 -26.580
  429    HA   PRO  60           HA       PRO  60  31.379  -3.758 -30.968
  430    HB2  PRO  60           1HB      PRO  60  33.149  -5.773 -30.544
  431    HB3  PRO  60           2HB      PRO  60  33.554  -4.071 -30.295
  432    HG2  PRO  60           1HG      PRO  60  32.771  -6.146 -28.284
  433    HG3  PRO  60           2HG      PRO  60  34.047  -4.918 -28.186
  434    HD2  PRO  60           1HD      PRO  60  31.645  -4.624 -26.971
  435    HD3  PRO  60           2HD      PRO  60  32.568  -3.247 -27.607
  436    H    SER  61           H        SER  61  31.563  -5.811 -32.356
  437    HA   SER  61           HA       SER  61  29.354  -7.609 -31.613
  438    HB2  SER  61           1HB      SER  61  30.297  -6.507 -34.233
  439    HB3  SER  61           2HB      SER  61  29.464  -8.061 -34.205
  440    HG   SER  61           HG       SER  61  28.438  -5.584 -33.997
  441    H    SER  62           H        SER  62  32.534  -7.536 -33.188
  442    HA   SER  62           HA       SER  62  32.975 -10.136 -33.799
  443    HB2  SER  62           1HB      SER  62  34.896  -8.204 -32.486
  444    HB3  SER  62           2HB      SER  62  35.386  -9.747 -33.185
  445    HG   SER  62           HG       SER  62  33.854  -8.078 -34.793
  446    H    GLY  63           H        GLY  63  33.357 -12.038 -32.780
  447    HA2  GLY  63           1HA      GLY  63  34.325 -12.535 -30.273
  448    HA3  GLY  63           2HA      GLY  63  32.612 -12.237 -30.013
  Start of MODEL    8
    1    H1   GLY   1           H        GLY   1 -14.059 -23.153   3.040
    2    HA2  GLY   1           1HA      GLY   1 -13.158 -22.152   0.973
    3    HA3  GLY   1           2HA      GLY   1 -13.093 -23.781   0.318
    4    H    SER   2           H        SER   2 -15.501 -21.640   1.851
    5    HA   SER   2           HA       SER   2 -17.697 -22.825   0.504
    6    HB2  SER   2           1HB      SER   2 -17.782 -21.495   2.666
    7    HB3  SER   2           2HB      SER   2 -17.633 -20.042   1.679
    8    HG   SER   2           HG       SER   2 -19.706 -20.191   1.433
    9    H    SER   3           H        SER   3 -19.206 -21.469  -0.882
   10    HA   SER   3           HA       SER   3 -17.612 -20.248  -3.023
   11    HB2  SER   3           1HB      SER   3 -20.437 -21.337  -3.089
   12    HB3  SER   3           2HB      SER   3 -19.551 -20.699  -4.474
   13    HG   SER   3           HG       SER   3 -19.223 -23.105  -3.096
   14    H    GLY   4           H        GLY   4 -17.920 -18.185  -3.685
   15    HA2  GLY   4           1HA      GLY   4 -18.818 -16.062  -3.807
   16    HA3  GLY   4           2HA      GLY   4 -20.271 -16.681  -3.036
   17    H    SER   5           H        SER   5 -16.877 -16.470  -1.977
   18    HA   SER   5           HA       SER   5 -17.781 -14.820   0.286
   19    HB2  SER   5           1HB      SER   5 -16.264 -17.380   0.314
   20    HB3  SER   5           2HB      SER   5 -15.768 -16.137   1.463
   21    HG   SER   5           HG       SER   5 -17.347 -17.400   2.416
   22    H    SER   6           H        SER   6 -16.733 -13.760  -2.044
   23    HA   SER   6           HA       SER   6 -13.954 -13.088  -1.358
   24    HB2  SER   6           1HB      SER   6 -13.750 -12.287  -3.673
   25    HB3  SER   6           2HB      SER   6 -14.298 -13.963  -3.632
   26    HG   SER   6           HG       SER   6 -16.498 -12.721  -3.640
   27    H    GLY   7           H        GLY   7 -14.292 -11.528   0.210
   28    HA2  GLY   7           1HA      GLY   7 -16.150  -9.408  -0.009
   29    HA3  GLY   7           2HA      GLY   7 -14.765  -9.452   1.072
   30    H    ARG   8           H        ARG   8 -12.597  -9.142  -0.145
   31    HA   ARG   8           HA       ARG   8 -12.649  -6.564  -1.297
   32    HB2  ARG   8           1HB      ARG   8 -10.471  -8.645  -1.115
   33    HB3  ARG   8           2HB      ARG   8 -10.211  -7.038  -1.780
   34    HG2  ARG   8           1HG      ARG   8 -10.942  -6.080   0.388
   35    HG3  ARG   8           2HG      ARG   8 -11.034  -7.720   1.033
   36    HD2  ARG   8           1HD      ARG   8  -8.538  -6.569  -0.194
   37    HD3  ARG   8           2HD      ARG   8  -8.907  -6.450   1.526
   38    HE   ARG   8           HE       ARG   8  -9.128  -9.100   1.026
   39   HH11  ARG   8          2HH1      ARG   8  -6.645  -6.742   0.398
   40   HH12  ARG   8          1HH1      ARG   8  -5.348  -7.884   0.517
   41   HH21  ARG   8          2HH2      ARG   8  -7.429 -10.613   1.185
   42   HH22  ARG   8          1HH2      ARG   8  -5.795 -10.086   0.964
   43    H    LYS   9           H        LYS   9 -13.360  -6.097  -3.264
   44    HA   LYS   9           HA       LYS   9 -13.664  -7.994  -5.339
   45    HB2  LYS   9           1HB      LYS   9 -13.793  -4.985  -5.272
   46    HB3  LYS   9           2HB      LYS   9 -14.036  -5.894  -6.758
   47    HG2  LYS   9           1HG      LYS   9 -16.194  -5.661  -6.076
   48    HG3  LYS   9           2HG      LYS   9 -15.792  -7.188  -5.287
   49    HD2  LYS   9           1HD      LYS   9 -15.292  -5.978  -3.215
   50    HD3  LYS   9           2HD      LYS   9 -15.705  -4.455  -4.007
   51    HE2  LYS   9           1HE      LYS   9 -17.592  -5.154  -2.717
   52    HE3  LYS   9           2HE      LYS   9 -17.986  -5.375  -4.421
   53    HZ1  LYS   9           1HZ      LYS   9 -18.608  -7.402  -3.747
   54    HZ2  LYS   9           2HZ      LYS   9 -17.694  -7.344  -2.325
   55    HZ3  LYS   9           3HZ      LYS   9 -16.956  -7.765  -3.788
   56    H    ILE  10           H        ILE  10 -12.742  -7.500  -7.603
   57    HA   ILE  10           HA       ILE  10  -9.832  -7.409  -7.328
   58    HB   ILE  10           HB       ILE  10  -9.761  -8.350  -9.590
   59   HG12  ILE  10          1HG1      ILE  10 -12.773  -8.507  -9.460
   60   HG13  ILE  10          2HG1      ILE  10 -11.920  -7.223 -10.310
   61   HG21  ILE  10          1HG2      ILE  10 -10.970 -10.524  -9.045
   62   HG22  ILE  10          2HG2      ILE  10  -9.763  -9.967  -7.887
   63   HG23  ILE  10          3HG2      ILE  10 -11.479  -9.735  -7.553
   64   HD11  ILE  10          1HD1      ILE  10 -12.498  -8.809 -11.938
   65   HD12  ILE  10          2HD1      ILE  10 -10.778  -9.053 -11.630
   66   HD13  ILE  10          3HD1      ILE  10 -11.963 -10.156 -10.932
   67    H    PHE  11           H        PHE  11 -11.157  -4.943  -7.103
   68    HA   PHE  11           HA       PHE  11 -10.404  -3.621  -9.626
   69    HB2  PHE  11           1HB      PHE  11 -12.597  -3.072  -7.665
   70    HB3  PHE  11           2HB      PHE  11 -11.921  -1.737  -8.592
   71    HD1  PHE  11           2HD      PHE  11 -13.645  -4.990  -8.862
   72    HD2  PHE  11           1HD      PHE  11 -12.482  -1.414 -10.857
   73    HE1  PHE  11           2HE      PHE  11 -15.098  -5.579 -10.758
   74    HE2  PHE  11           1HE      PHE  11 -13.934  -1.997 -12.756
   75    HZ   PHE  11           HZ       PHE  11 -15.243  -4.083 -12.709
   76    H    THR  12           H        THR  12 -10.387  -3.338  -6.098
   77    HA   THR  12           HA       THR  12  -8.903  -0.966  -5.914
   78    HB   THR  12           HB       THR  12  -8.351  -1.673  -3.617
   79    HG1  THR  12           1HG      THR  12  -8.364  -4.043  -4.466
   80   HG21  THR  12          1HG2      THR  12 -10.849  -1.112  -4.648
   81   HG22  THR  12          2HG2      THR  12 -10.413  -1.119  -2.938
   82   HG23  THR  12          3HG2      THR  12 -11.128  -2.554  -3.673
   83    H    ASN  13           H        ASN  13  -6.662  -0.908  -4.864
   84    HA   ASN  13           HA       ASN  13  -4.902  -2.928  -6.079
   85    HB2  ASN  13           1HB      ASN  13  -4.269   0.025  -5.999
   86    HB3  ASN  13           2HB      ASN  13  -3.369  -1.242  -6.827
   87   HD21  ASN  13          1HD2      ASN  13  -5.685   1.137  -7.138
   88   HD22  ASN  13          2HD2      ASN  13  -6.329   0.680  -8.675
   89    H    LYS  14           H        LYS  14  -2.678  -2.887  -5.133
   90    HA   LYS  14           HA       LYS  14  -2.792  -2.199  -2.269
   91    HB2  LYS  14           1HB      LYS  14  -2.842  -4.619  -2.616
   92    HB3  LYS  14           2HB      LYS  14  -1.385  -4.524  -3.596
   93    HG2  LYS  14           1HG      LYS  14  -0.317  -3.488  -1.480
   94    HG3  LYS  14           2HG      LYS  14  -1.698  -4.201  -0.642
   95    HD2  LYS  14           1HD      LYS  14  -1.062  -6.377  -1.201
   96    HD3  LYS  14           2HD      LYS  14  -0.007  -5.833  -2.507
   97    HE2  LYS  14           1HE      LYS  14   1.415  -4.740  -0.726
   98    HE3  LYS  14           2HE      LYS  14   0.450  -5.616   0.461
   99    HZ1  LYS  14           1HZ      LYS  14   2.240  -6.733  -1.614
  100    HZ2  LYS  14           2HZ      LYS  14   1.090  -7.680  -0.814
  101    HZ3  LYS  14           3HZ      LYS  14   2.329  -6.935   0.063
  102    H    CYS  15           H        CYS  15  -0.992  -1.287  -1.318
  103    HA   CYS  15           HA       CYS  15   0.774   0.125  -3.091
  104    HB2  CYS  15           1HB      CYS  15  -0.117   1.154  -1.024
  105    HB3  CYS  15           2HB      CYS  15   0.783  -0.019  -0.068
  106    H    GLU  16           H        GLU  16   3.064   0.014  -3.095
  107    HA   GLU  16           HA       GLU  16   4.098  -2.632  -2.321
  108    HB2  GLU  16           1HB      GLU  16   5.101  -0.771  -4.482
  109    HB3  GLU  16           2HB      GLU  16   5.753  -2.360  -4.108
  110    HG2  GLU  16           1HG      GLU  16   3.342  -3.182  -4.584
  111    HG3  GLU  16           2HG      GLU  16   3.170  -1.638  -5.416
  112    H    ARG  17           H        ARG  17   3.941  -0.216  -0.636
  113    HA   ARG  17           HA       ARG  17   6.763   0.497  -0.323
  114    HB2  ARG  17           1HB      ARG  17   4.675   2.129  -0.279
  115    HB3  ARG  17           2HB      ARG  17   4.621   1.641   1.410
  116    HG2  ARG  17           1HG      ARG  17   7.255   2.477   0.380
  117    HG3  ARG  17           2HG      ARG  17   6.026   3.736   0.517
  118    HD2  ARG  17           1HD      ARG  17   5.661   2.675   2.890
  119    HD3  ARG  17           2HD      ARG  17   7.303   2.082   2.644
  120    HE   ARG  17           HE       ARG  17   6.482   4.827   3.068
  121   HH11  ARG  17          2HH1      ARG  17   9.002   2.650   2.052
  122   HH12  ARG  17          1HH1      ARG  17  10.276   3.794   2.316
  123   HH21  ARG  17          2HH2      ARG  17   8.150   6.342   3.419
  124   HH22  ARG  17          1HH2      ARG  17   9.791   5.893   3.094
  125    H    ALA  18           H        ALA  18   7.942   0.033   1.492
  126    HA   ALA  18           HA       ALA  18   7.433  -2.298   2.901
  127    HB1  ALA  18           1HB      ALA  18   9.098  -1.053   4.603
  128    HB2  ALA  18           2HB      ALA  18   9.627  -1.797   3.093
  129    HB3  ALA  18           3HB      ALA  18   9.336  -0.059   3.165
  130    H    GLY  19           H        GLY  19   6.633  -2.774   4.934
  131    HA2  GLY  19           1HA      GLY  19   5.058  -2.581   6.608
  132    HA3  GLY  19           2HA      GLY  19   5.965  -1.128   7.004
  133    H    CYS  20           H        CYS  20   3.948  -1.819   4.168
  134    HA   CYS  20           HA       CYS  20   2.023   0.193   5.087
  135    HB2  CYS  20           1HB      CYS  20   3.784   1.148   3.478
  136    HB3  CYS  20           2HB      CYS  20   3.007   0.167   2.240
  137    H    ARG  21           H        ARG  21  -0.004  -0.490   4.884
  138    HA   ARG  21           HA       ARG  21  -0.595  -2.568   2.882
  139    HB2  ARG  21           1HB      ARG  21  -2.144  -3.608   4.466
  140    HB3  ARG  21           2HB      ARG  21  -0.508  -3.578   5.110
  141    HG2  ARG  21           1HG      ARG  21  -1.105  -1.599   6.455
  142    HG3  ARG  21           2HG      ARG  21  -2.760  -1.722   5.853
  143    HD2  ARG  21           1HD      ARG  21  -2.724  -4.110   6.758
  144    HD3  ARG  21           2HD      ARG  21  -1.262  -3.634   7.621
  145    HE   ARG  21           HE       ARG  21  -2.545  -2.376   9.057
  146   HH11  ARG  21          2HH1      ARG  21  -4.468  -3.390   6.338
  147   HH12  ARG  21          1HH1      ARG  21  -5.967  -2.879   7.040
  148   HH21  ARG  21          2HH2      ARG  21  -4.512  -1.699   9.993
  149   HH22  ARG  21          1HH2      ARG  21  -5.990  -1.916   9.119
  150    H    GLN  22           H        GLN  22  -0.915   0.207   2.491
  151    HA   GLN  22           HA       GLN  22  -3.622   0.980   3.001
  152    HB2  GLN  22           1HB      GLN  22  -1.344   2.121   1.432
  153    HB3  GLN  22           2HB      GLN  22  -2.966   2.747   1.170
  154    HG2  GLN  22           1HG      GLN  22  -1.461   3.935   2.862
  155    HG3  GLN  22           2HG      GLN  22  -3.128   3.592   3.321
  156   HE21  GLN  22          1HE2      GLN  22  -0.025   3.510   4.361
  157   HE22  GLN  22          2HE2      GLN  22  -0.159   2.313   5.598
  158    H    ARG  23           H        ARG  23  -5.230   1.414   1.360
  159    HA   ARG  23           HA       ARG  23  -4.972  -0.295  -1.023
  160    HB2  ARG  23           1HB      ARG  23  -7.281  -0.094   0.903
  161    HB3  ARG  23           2HB      ARG  23  -7.476  -0.719  -0.729
  162    HG2  ARG  23           1HG      ARG  23  -7.190  -2.634   0.527
  163    HG3  ARG  23           2HG      ARG  23  -5.566  -2.333  -0.095
  164    HD2  ARG  23           1HD      ARG  23  -4.826  -1.474   1.971
  165    HD3  ARG  23           2HD      ARG  23  -6.472  -1.315   2.583
  166    HE   ARG  23           HE       ARG  23  -4.868  -3.733   2.484
  167   HH11  ARG  23          2HH1      ARG  23  -8.001  -2.298   2.982
  168   HH12  ARG  23          1HH1      ARG  23  -8.628  -3.656   3.856
  169   HH21  ARG  23          2HH2      ARG  23  -5.682  -5.526   3.634
  170   HH22  ARG  23          1HH2      ARG  23  -7.308  -5.491   4.227
  171    H    GLU  24           H        GLU  24  -5.055   0.937  -2.774
  172    HA   GLU  24           HA       GLU  24  -6.657   3.401  -2.702
  173    HB2  GLU  24           1HB      GLU  24  -4.304   2.581  -4.401
  174    HB3  GLU  24           2HB      GLU  24  -5.286   3.994  -4.758
  175    HG2  GLU  24           1HG      GLU  24  -3.328   4.683  -3.571
  176    HG3  GLU  24           2HG      GLU  24  -4.734   4.898  -2.529
  177    H    MET  25           H        MET  25  -8.366   3.660  -4.011
  178    HA   MET  25           HA       MET  25  -9.493   1.452  -5.353
  179    HB2  MET  25           1HB      MET  25 -10.129   4.394  -5.340
  180    HB3  MET  25           2HB      MET  25 -11.038   3.260  -6.330
  181    HG2  MET  25           1HG      MET  25 -12.269   3.547  -4.347
  182    HG3  MET  25           2HG      MET  25 -11.503   1.965  -4.229
  183    HE1  MET  25           1HE      MET  25 -12.804   2.913  -2.063
  184    HE2  MET  25           2HE      MET  25 -11.610   2.121  -1.034
  185    HE3  MET  25           3HE      MET  25 -11.999   3.824  -0.784
  186    H    MET  26           H        MET  26  -7.723   4.287  -6.516
  187    HA   MET  26           HA       MET  26  -7.842   3.261  -9.252
  188    HB2  MET  26           1HB      MET  26  -7.003   5.408  -9.945
  189    HB3  MET  26           2HB      MET  26  -8.324   5.665  -8.813
  190    HG2  MET  26           1HG      MET  26  -6.926   6.422  -7.143
  191    HG3  MET  26           2HG      MET  26  -5.510   5.627  -7.827
  192    HE1  MET  26           1HE      MET  26  -6.428   9.371  -7.242
  193    HE2  MET  26           2HE      MET  26  -5.331   8.136  -6.622
  194    HE3  MET  26           3HE      MET  26  -4.726   9.388  -7.708
  195    H    LYS  27           H        LYS  27  -5.815   3.328 -10.544
  196    HA   LYS  27           HA       LYS  27  -3.705   1.988  -9.079
  197    HB2  LYS  27           1HB      LYS  27  -4.348   1.010 -11.178
  198    HB3  LYS  27           2HB      LYS  27  -4.122   2.538 -12.019
  199    HG2  LYS  27           1HG      LYS  27  -1.738   2.427 -11.670
  200    HG3  LYS  27           2HG      LYS  27  -1.920   0.961 -10.703
  201    HD2  LYS  27           1HD      LYS  27  -1.385   0.021 -12.714
  202    HD3  LYS  27           2HD      LYS  27  -3.139   0.108 -12.895
  203    HE2  LYS  27           1HE      LYS  27  -1.526   2.451 -13.754
  204    HE3  LYS  27           2HE      LYS  27  -1.484   1.006 -14.762
  205    HZ1  LYS  27           1HZ      LYS  27  -3.340   2.923 -14.953
  206    HZ2  LYS  27           2HZ      LYS  27  -4.126   1.835 -13.925
  207    HZ3  LYS  27           3HZ      LYS  27  -3.582   1.322 -15.442
  208    H    LEU  28           H        LEU  28  -1.823   2.860  -8.476
  209    HA   LEU  28           HA       LEU  28  -1.026   5.437  -9.649
  210    HB2  LEU  28           1HB      LEU  28  -0.972   4.677  -6.733
  211    HB3  LEU  28           2HB      LEU  28  -0.222   6.123  -7.406
  212    HG   LEU  28           HG       LEU  28  -3.147   5.674  -7.807
  213   HD11  LEU  28          1HD1      LEU  28  -3.456   7.017  -5.670
  214   HD12  LEU  28          2HD1      LEU  28  -1.811   6.533  -5.259
  215   HD13  LEU  28          3HD1      LEU  28  -3.057   5.308  -5.491
  216   HD21  LEU  28          1HD2      LEU  28  -1.740   8.244  -7.198
  217   HD22  LEU  28          2HD2      LEU  28  -3.231   7.971  -8.099
  218   HD23  LEU  28          3HD2      LEU  28  -1.676   7.548  -8.817
  219    H    THR  29           H        THR  29   0.524   4.459 -10.945
  220    HA   THR  29           HA       THR  29   2.643   2.938  -9.605
  221    HB   THR  29           HB       THR  29   2.218   3.354 -12.570
  222    HG1  THR  29           1HG      THR  29   1.180   1.519 -10.744
  223   HG21  THR  29          1HG2      THR  29   4.517   2.629 -11.369
  224   HG22  THR  29          2HG2      THR  29   4.020   2.032 -12.953
  225   HG23  THR  29          3HG2      THR  29   3.740   1.053 -11.513
  226    H    CYS  30           H        CYS  30   4.663   3.704  -9.360
  227    HA   CYS  30           HA       CYS  30   5.220   6.427  -9.505
  228    HB2  CYS  30           1HB      CYS  30   6.435   4.535  -8.213
  229    HB3  CYS  30           2HB      CYS  30   7.388   4.352  -9.682
  230    H    GLU  31           H        GLU  31   7.178   7.319 -10.755
  231    HA   GLU  31           HA       GLU  31   6.820   6.608 -13.589
  232    HB2  GLU  31           1HB      GLU  31   7.304   8.856 -14.163
  233    HB3  GLU  31           2HB      GLU  31   6.182   8.932 -12.811
  234    HG2  GLU  31           1HG      GLU  31   7.753   9.746 -11.366
  235    HG3  GLU  31           2HG      GLU  31   9.097   9.013 -12.240
  236    H    ARG  32           H        ARG  32   9.030   6.587 -11.019
  237    HA   ARG  32           HA       ARG  32  11.352   6.518 -12.805
  238    HB2  ARG  32           1HB      ARG  32  11.107   6.718  -9.804
  239    HB3  ARG  32           2HB      ARG  32  12.643   6.485 -10.628
  240    HG2  ARG  32           1HG      ARG  32  12.518   8.597 -11.670
  241    HG3  ARG  32           2HG      ARG  32  10.819   8.793 -11.232
  242    HD2  ARG  32           1HD      ARG  32  11.763  10.087  -9.614
  243    HD3  ARG  32           2HD      ARG  32  11.805   8.530  -8.788
  244    HE   ARG  32           HE       ARG  32  14.102   8.510  -8.982
  245   HH11  ARG  32          2HH1      ARG  32  12.765  11.100 -10.885
  246   HH12  ARG  32          1HH1      ARG  32  14.299  11.849 -11.181
  247   HH21  ARG  32          2HH2      ARG  32  16.127   9.486  -9.364
  248   HH22  ARG  32          1HH2      ARG  32  16.211  10.929 -10.316
  249    H    CYS  33           H        CYS  33  10.010   4.653 -10.076
  250    HA   CYS  33           HA       CYS  33  11.579   2.334 -10.842
  251    HB2  CYS  33           1HB      CYS  33  10.487   1.294  -8.831
  252    HB3  CYS  33           2HB      CYS  33  11.424   2.745  -8.487
  253    H    SER  34           H        SER  34   8.352   3.540 -11.177
  254    HA   SER  34           HA       SER  34   6.569   2.789 -12.380
  255    HB2  SER  34           1HB      SER  34   8.374   2.086 -14.013
  256    HB3  SER  34           2HB      SER  34   8.304   0.483 -13.281
  257    HG   SER  34           HG       SER  34   6.906   1.094 -15.234
  258    H    ARG  35           H        ARG  35   6.638   2.175  -9.726
  259    HA   ARG  35           HA       ARG  35   5.457  -0.524  -9.656
  260    HB2  ARG  35           1HB      ARG  35   7.197   0.865  -7.628
  261    HB3  ARG  35           2HB      ARG  35   6.156  -0.482  -7.188
  262    HG2  ARG  35           1HG      ARG  35   7.366  -1.677  -9.175
  263    HG3  ARG  35           2HG      ARG  35   8.601  -0.450  -8.885
  264    HD2  ARG  35           1HD      ARG  35   8.807  -1.152  -6.579
  265    HD3  ARG  35           2HD      ARG  35   7.490  -2.306  -6.784
  266    HE   ARG  35           HE       ARG  35   9.747  -2.683  -8.553
  267   HH11  ARG  35          2HH1      ARG  35   8.249  -3.513  -5.522
  268   HH12  ARG  35          1HH1      ARG  35   9.114  -5.004  -5.353
  269   HH21  ARG  35          2HH2      ARG  35  10.892  -4.645  -8.342
  270   HH22  ARG  35          1HH2      ARG  35  10.618  -5.647  -6.958
  271    H    ASN  36           H        ASN  36   3.695  -0.829  -8.196
  272    HA   ASN  36           HA       ASN  36   1.918   1.405  -8.110
  273    HB2  ASN  36           1HB      ASN  36   1.442  -1.189  -8.315
  274    HB3  ASN  36           2HB      ASN  36   1.373  -1.090  -6.558
  275   HD21  ASN  36          1HD2      ASN  36  -0.786  -1.791  -8.209
  276   HD22  ASN  36          2HD2      ASN  36  -2.004  -0.577  -8.047
  277    H    PHE  37           H        PHE  37   1.110   2.507  -6.331
  278    HA   PHE  37           HA       PHE  37   2.008   1.929  -3.666
  279    HB2  PHE  37           1HB      PHE  37   2.991   4.463  -4.995
  280    HB3  PHE  37           2HB      PHE  37   3.226   4.021  -3.307
  281    HD1  PHE  37           2HD      PHE  37   4.493   1.810  -2.865
  282    HD2  PHE  37           1HD      PHE  37   4.593   3.914  -6.563
  283    HE1  PHE  37           2HE      PHE  37   6.587   0.663  -3.456
  284    HE2  PHE  37           1HE      PHE  37   6.688   2.770  -7.161
  285    HZ   PHE  37           HZ       PHE  37   7.688   1.143  -5.607
  286    H    CYS  38           H        CYS  38   1.242   3.671  -2.116
  287    HA   CYS  38           HA       CYS  38  -1.453   4.446  -2.913
  288    HB2  CYS  38           1HB      CYS  38  -1.892   4.747  -0.559
  289    HB3  CYS  38           2HB      CYS  38  -1.065   3.208  -0.783
  290    H    ILE  39           H        ILE  39  -2.276   6.549  -2.653
  291    HA   ILE  39           HA       ILE  39  -0.953   8.649  -3.656
  292    HB   ILE  39           HB       ILE  39  -3.019   8.691  -1.466
  293   HG12  ILE  39          1HG1      ILE  39  -3.195   9.366  -4.410
  294   HG13  ILE  39          2HG1      ILE  39  -3.659   7.819  -3.711
  295   HG21  ILE  39          1HG2      ILE  39  -2.007  11.048  -3.049
  296   HG22  ILE  39          2HG2      ILE  39  -3.315  11.062  -1.867
  297   HG23  ILE  39          3HG2      ILE  39  -1.661  10.738  -1.348
  298   HD11  ILE  39          1HD1      ILE  39  -5.669   8.936  -3.922
  299   HD12  ILE  39          2HD1      ILE  39  -5.238   9.221  -2.236
  300   HD13  ILE  39          3HD1      ILE  39  -4.977  10.484  -3.438
  301    H    LYS  40           H        LYS  40  -0.801   7.606  -0.292
  302    HA   LYS  40           HA       LYS  40   0.692   9.797   0.684
  303    HB2  LYS  40           1HB      LYS  40   0.051   7.053   1.639
  304    HB3  LYS  40           2HB      LYS  40   1.410   7.873   2.396
  305    HG2  LYS  40           1HG      LYS  40  -0.273   8.522   3.784
  306    HG3  LYS  40           2HG      LYS  40  -0.321   9.841   2.611
  307    HD2  LYS  40           1HD      LYS  40  -2.567   9.047   3.059
  308    HD3  LYS  40           2HD      LYS  40  -2.114   8.664   1.397
  309    HE2  LYS  40           1HE      LYS  40  -1.974   6.409   1.813
  310    HE3  LYS  40           2HE      LYS  40  -1.614   6.638   3.523
  311    HZ1  LYS  40           1HZ      LYS  40  -3.758   5.908   3.625
  312    HZ2  LYS  40           2HZ      LYS  40  -4.208   6.616   2.157
  313    HZ3  LYS  40           3HZ      LYS  40  -4.037   7.574   3.540
  314    H    HIS  41           H        HIS  41   1.644   6.643  -0.612
  315    HA   HIS  41           HA       HIS  41   4.450   7.524  -0.565
  316    HB2  HIS  41           1HB      HIS  41   3.301   4.737  -0.816
  317    HB3  HIS  41           2HB      HIS  41   5.018   5.129  -0.832
  318    HD2  HIS  41           2HD      HIS  41   4.917   7.185   1.799
  319    HE1  HIS  41           1HE      HIS  41   3.553   3.704   3.805
  320    HE2  HIS  41           2HE      HIS  41   4.461   6.038   4.073
  321    H    ARG  42           H        ARG  42   2.195   8.064  -2.561
  322    HA   ARG  42           HA       ARG  42   2.892   6.707  -4.963
  323    HB2  ARG  42           1HB      ARG  42   0.748   7.553  -5.059
  324    HB3  ARG  42           2HB      ARG  42   1.189   9.053  -4.255
  325    HG2  ARG  42           1HG      ARG  42   0.623   9.495  -6.551
  326    HG3  ARG  42           2HG      ARG  42   2.346   9.782  -6.301
  327    HD2  ARG  42           1HD      ARG  42   2.478   7.235  -7.051
  328    HD3  ARG  42           2HD      ARG  42   0.971   7.663  -7.860
  329    HE   ARG  42           HE       ARG  42   3.631   8.702  -8.451
  330   HH11  ARG  42          2HH1      ARG  42   0.203   8.778  -9.055
  331   HH12  ARG  42          1HH1      ARG  42   0.357   9.598 -10.573
  332   HH21  ARG  42          2HH2      ARG  42   3.846   9.783 -10.448
  333   HH22  ARG  42          1HH2      ARG  42   2.430  10.169 -11.365
  334    H    HIS  43           H        HIS  43   4.130   9.483  -3.314
  335    HA   HIS  43           HA       HIS  43   5.580  10.435  -5.652
  336    HB2  HIS  43           1HB      HIS  43   4.494  11.808  -3.623
  337    HB3  HIS  43           2HB      HIS  43   6.108  11.574  -2.957
  338    HD1  HIS  43           1HD      HIS  43   8.030  12.877  -4.027
  339    HD2  HIS  43           2HD      HIS  43   4.374  13.462  -5.912
  340    HE1  HIS  43           1HE      HIS  43   8.380  14.819  -5.587
  341    HA   PRO  44           HA       PRO  44   9.240   8.141  -4.797
  342    HB2  PRO  44           1HB      PRO  44  11.029   9.699  -6.117
  343    HB3  PRO  44           2HB      PRO  44   9.875   8.647  -6.946
  344    HG2  PRO  44           1HG      PRO  44   9.726  11.593  -6.436
  345    HG3  PRO  44           2HG      PRO  44   9.326  10.691  -7.910
  346    HD2  PRO  44           1HD      PRO  44   7.437  11.555  -6.172
  347    HD3  PRO  44           2HD      PRO  44   7.257  10.060  -7.112
  348    H    LEU  45           H        LEU  45   8.458  10.968  -3.333
  349    HA   LEU  45           HA       LEU  45  11.074  11.361  -2.070
  350    HB2  LEU  45           1HB      LEU  45   8.576  13.011  -2.222
  351    HB3  LEU  45           2HB      LEU  45   9.809  13.340  -1.006
  352    HG   LEU  45           HG       LEU  45  10.216  13.424  -3.996
  353   HD11  LEU  45          1HD1      LEU  45   9.663  15.576  -3.957
  354   HD12  LEU  45          2HD1      LEU  45  10.637  15.875  -2.517
  355   HD13  LEU  45          3HD1      LEU  45   8.983  15.286  -2.356
  356   HD21  LEU  45          1HD2      LEU  45  12.376  14.541  -3.280
  357   HD22  LEU  45          2HD2      LEU  45  12.273  12.798  -3.030
  358   HD23  LEU  45          3HD2      LEU  45  12.059  13.900  -1.668
  359    H    ASP  46           H        ASP  46   7.902  10.128  -1.484
  360    HA   ASP  46           HA       ASP  46   8.494   9.861   1.385
  361    HB2  ASP  46           1HB      ASP  46   5.932  10.000  -0.167
  362    HB3  ASP  46           2HB      ASP  46   5.962   9.205   1.404
  363    H    HIS  47           H        HIS  47   9.558   8.180  -0.802
  364    HA   HIS  47           HA       HIS  47   9.167   5.648   0.436
  365    HB2  HIS  47           1HB      HIS  47   7.906   4.485  -1.114
  366    HB3  HIS  47           2HB      HIS  47   7.117   6.059  -1.153
  367    HD1  HIS  47           1HD      HIS  47   6.660   6.829  -3.446
  368    HD2  HIS  47           2HD      HIS  47  10.054   4.439  -3.282
  369    HE1  HIS  47           1HE      HIS  47   7.477   6.658  -5.818
  370    H    ASP  48           H        ASP  48  10.922   4.412   0.121
  371    HA   ASP  48           HA       ASP  48  13.218   5.370  -1.081
  372    HB2  ASP  48           1HB      ASP  48  13.009   3.462   0.582
  373    HB3  ASP  48           2HB      ASP  48  12.591   2.432  -0.785
  374    H    CYS  49           H        CYS  49  13.152   6.047  -3.158
  375    HA   CYS  49           HA       CYS  49  12.122   4.212  -5.202
  376    HB2  CYS  49           1HB      CYS  49  11.379   6.664  -5.049
  377    HB3  CYS  49           2HB      CYS  49  12.982   7.064  -5.656
  378    H    SER  50           H        SER  50  13.499   3.018  -6.322
  379    HA   SER  50           HA       SER  50  16.341   3.723  -6.298
  380    HB2  SER  50           1HB      SER  50  15.006   1.146  -7.162
  381    HB3  SER  50           2HB      SER  50  16.741   1.413  -6.995
  382    HG   SER  50           HG       SER  50  16.028   2.048  -4.711
  383    H    GLY  51           H        GLY  51  13.807   2.700  -8.581
  384    HA2  GLY  51           1HA      GLY  51  13.470   3.663 -10.712
  385    HA3  GLY  51           2HA      GLY  51  15.099   4.319 -10.647
  386    H    GLU  52           H        GLU  52  13.205   1.403 -11.188
  387    HA   GLU  52           HA       GLU  52  15.514   0.263 -12.623
  388    HB2  GLU  52           1HB      GLU  52  14.614  -1.962 -12.113
  389    HB3  GLU  52           2HB      GLU  52  14.962  -1.058 -10.646
  390    HG2  GLU  52           1HG      GLU  52  12.559  -0.476 -10.494
  391    HG3  GLU  52           2HG      GLU  52  12.259  -1.517 -11.884
  392    H    GLY  53           H        GLY  53  15.265   0.025 -14.743
  393    HA2  GLY  53           1HA      GLY  53  14.119  -0.714 -16.680
  394    HA3  GLY  53           2HA      GLY  53  12.596  -0.495 -15.831
  395    H    HIS  54           H        HIS  54  15.379   1.519 -16.796
  396    HA   HIS  54           HA       HIS  54  14.073   3.949 -16.915
  397    HB2  HIS  54           1HB      HIS  54  15.927   4.766 -18.052
  398    HB3  HIS  54           2HB      HIS  54  16.587   3.340 -17.258
  399    HD1  HIS  54           1HD      HIS  54  16.209   1.083 -19.007
  400    HD2  HIS  54           2HD      HIS  54  16.799   4.877 -20.594
  401    HE1  HIS  54           1HE      HIS  54  17.018   0.710 -21.359
  402    HA   PRO  55           HA       PRO  55  11.185   3.195 -20.226
  403    HB2  PRO  55           1HB      PRO  55  10.081   5.675 -20.192
  404    HB3  PRO  55           2HB      PRO  55   9.690   4.433 -18.997
  405    HG2  PRO  55           1HG      PRO  55  11.581   6.744 -18.778
  406    HG3  PRO  55           2HG      PRO  55  10.414   6.137 -17.589
  407    HD2  PRO  55           1HD      PRO  55  13.058   5.567 -17.457
  408    HD3  PRO  55           2HD      PRO  55  11.808   4.435 -16.902
  409    H    THR  56           H        THR  56  11.174   3.579 -22.393
  410    HA   THR  56           HA       THR  56  12.901   5.735 -23.412
  411    HB   THR  56           HB       THR  56  13.538   4.198 -25.295
  412    HG1  THR  56           1HG      THR  56  13.185   1.981 -24.985
  413   HG21  THR  56          1HG2      THR  56  14.416   3.015 -22.680
  414   HG22  THR  56          2HG2      THR  56  14.890   4.649 -23.144
  415   HG23  THR  56          3HG2      THR  56  15.353   3.277 -24.150
  416    H    SER  57           H        SER  57  11.663   7.122 -24.481
  417    HA   SER  57           HA       SER  57   9.243   6.165 -25.820
  418    HB2  SER  57           1HB      SER  57  10.192   8.882 -24.938
  419    HB3  SER  57           2HB      SER  57   8.864   8.711 -26.085
  420    HG   SER  57           HG       SER  57   8.910   7.380 -23.587
  421    H    SER  58           H        SER  58   8.725   6.933 -27.972
  422    HA   SER  58           HA       SER  58   9.314   6.781 -30.198
  423    HB2  SER  58           1HB      SER  58  10.455   9.297 -29.066
  424    HB3  SER  58           2HB      SER  58  10.850   8.881 -30.734
  425    HG   SER  58           HG       SER  58   8.728   8.985 -31.272
  426    H    GLY  59           H        GLY  59  10.879   4.997 -28.756
  427    HA2  GLY  59           1HA      GLY  59  13.600   5.364 -29.808
  428    HA3  GLY  59           2HA      GLY  59  13.136   4.233 -28.546
  429    HA   PRO  60           HA       PRO  60  13.541   2.020 -32.655
  430    HB2  PRO  60           1HB      PRO  60  15.388   0.215 -31.818
  431    HB3  PRO  60           2HB      PRO  60  15.821   1.792 -32.489
  432    HG2  PRO  60           1HG      PRO  60  15.658   0.931 -29.626
  433    HG3  PRO  60           2HG      PRO  60  16.892   1.919 -30.429
  434    HD2  PRO  60           1HD      PRO  60  14.918   2.996 -28.920
  435    HD3  PRO  60           2HD      PRO  60  15.608   3.831 -30.327
  436    H    SER  61           H        SER  61  12.463   1.475 -29.551
  437    HA   SER  61           HA       SER  61  12.005  -1.335 -29.627
  438    HB2  SER  61           1HB      SER  61  12.063   0.124 -27.549
  439    HB3  SER  61           2HB      SER  61  10.453   0.684 -28.000
  440    HG   SER  61           HG       SER  61  10.857  -1.320 -26.541
  441    H    SER  62           H        SER  62   9.971   1.495 -30.296
  442    HA   SER  62           HA       SER  62   8.250  -0.207 -31.943
  443    HB2  SER  62           1HB      SER  62   6.227   0.576 -30.964
  444    HB3  SER  62           2HB      SER  62   7.260   0.100 -29.616
  445    HG   SER  62           HG       SER  62   6.332   2.592 -30.342
  446    H    GLY  63           H        GLY  63   7.811   0.688 -33.856
  447    HA2  GLY  63           1HA      GLY  63   8.986   3.037 -34.751
  448    HA3  GLY  63           2HA      GLY  63   7.627   2.244 -35.535
  Start of MODEL    9
    1    H1   GLY   1           H        GLY   1  11.748  -7.031 -19.851
    2    HA2  GLY   1           1HA      GLY   1  13.544  -6.424 -17.661
    3    HA3  GLY   1           2HA      GLY   1  11.936  -5.735 -17.495
    4    H    SER   2           H        SER   2  10.113  -7.357 -17.833
    5    HA   SER   2           HA       SER   2   9.006  -9.110 -16.873
    6    HB2  SER   2           1HB      SER   2  10.037 -10.141 -18.907
    7    HB3  SER   2           2HB      SER   2  11.381 -10.681 -17.901
    8    HG   SER   2           HG       SER   2   9.033 -11.860 -18.272
    9    H    SER   3           H        SER   3  10.501  -7.709 -15.004
   10    HA   SER   3           HA       SER   3  11.766  -9.759 -13.333
   11    HB2  SER   3           1HB      SER   3  12.889  -7.509 -13.830
   12    HB3  SER   3           2HB      SER   3  11.686  -6.799 -12.754
   13    HG   SER   3           HG       SER   3  12.496  -8.594 -11.270
   14    H    GLY   4           H        GLY   4   9.010  -9.977 -13.585
   15    HA2  GLY   4           1HA      GLY   4   7.454 -10.618 -11.918
   16    HA3  GLY   4           2HA      GLY   4   8.210  -9.483 -10.810
   17    H    SER   5           H        SER   5   6.598  -9.350 -13.992
   18    HA   SER   5           HA       SER   5   5.087  -7.022 -12.998
   19    HB2  SER   5           1HB      SER   5   4.997  -6.191 -15.275
   20    HB3  SER   5           2HB      SER   5   6.678  -6.521 -14.855
   21    HG   SER   5           HG       SER   5   4.952  -7.967 -16.547
   22    H    SER   6           H        SER   6   4.188  -9.597 -12.465
   23    HA   SER   6           HA       SER   6   1.854  -9.799 -14.254
   24    HB2  SER   6           1HB      SER   6   3.646 -11.732 -14.167
   25    HB3  SER   6           2HB      SER   6   2.801 -12.164 -12.681
   26    HG   SER   6           HG       SER   6   1.567 -13.188 -14.069
   27    H    GLY   7           H        GLY   7  -0.142  -9.911 -13.335
   28    HA2  GLY   7           1HA      GLY   7  -1.422 -10.636 -11.310
   29    HA3  GLY   7           2HA      GLY   7  -0.222  -9.745 -10.385
   30    H    ARG   8           H        ARG   8  -2.867  -9.436 -12.689
   31    HA   ARG   8           HA       ARG   8  -3.220  -6.655 -11.780
   32    HB2  ARG   8           1HB      ARG   8  -3.379  -7.842 -14.518
   33    HB3  ARG   8           2HB      ARG   8  -4.430  -6.489 -14.120
   34    HG2  ARG   8           1HG      ARG   8  -2.552  -5.088 -13.636
   35    HG3  ARG   8           2HG      ARG   8  -1.439  -6.447 -13.803
   36    HD2  ARG   8           1HD      ARG   8  -1.321  -5.170 -15.812
   37    HD3  ARG   8           2HD      ARG   8  -2.187  -6.661 -16.179
   38    HE   ARG   8           HE       ARG   8  -4.088  -4.742 -15.527
   39   HH11  ARG   8          2HH1      ARG   8  -1.677  -5.286 -17.978
   40   HH12  ARG   8          1HH1      ARG   8  -2.542  -4.421 -19.205
   41   HH21  ARG   8          2HH2      ARG   8  -5.236  -3.600 -17.133
   42   HH22  ARG   8          1HH2      ARG   8  -4.565  -3.461 -18.723
   43    H    LYS   9           H        LYS   9  -5.069  -6.283 -10.760
   44    HA   LYS   9           HA       LYS   9  -7.347  -8.081 -11.275
   45    HB2  LYS   9           1HB      LYS   9  -6.270  -7.010  -8.684
   46    HB3  LYS   9           2HB      LYS   9  -7.959  -7.477  -8.827
   47    HG2  LYS   9           1HG      LYS   9  -7.138  -9.726  -9.630
   48    HG3  LYS   9           2HG      LYS   9  -5.526  -9.213  -9.125
   49    HD2  LYS   9           1HD      LYS   9  -7.917  -9.206  -7.292
   50    HD3  LYS   9           2HD      LYS   9  -6.811 -10.574  -7.438
   51    HE2  LYS   9           1HE      LYS   9  -6.043  -7.769  -6.633
   52    HE3  LYS   9           2HE      LYS   9  -6.249  -9.131  -5.533
   53    HZ1  LYS   9           1HZ      LYS   9  -4.501 -10.228  -7.087
   54    HZ2  LYS   9           2HZ      LYS   9  -4.000  -9.154  -5.881
   55    HZ3  LYS   9           3HZ      LYS   9  -4.113  -8.631  -7.485
   56    H    ILE  10           H        ILE  10  -9.292  -7.157 -11.643
   57    HA   ILE  10           HA       ILE  10  -9.366  -4.319 -12.110
   58    HB   ILE  10           HB       ILE  10 -11.641  -4.689 -12.914
   59   HG12  ILE  10          1HG1      ILE  10 -11.303  -7.614 -12.271
   60   HG13  ILE  10          2HG1      ILE  10 -12.092  -6.503 -11.156
   61   HG21  ILE  10          1HG2      ILE  10  -9.347  -6.274 -13.868
   62   HG22  ILE  10          2HG2      ILE  10 -10.924  -6.730 -14.512
   63   HG23  ILE  10          3HG2      ILE  10 -10.334  -5.080 -14.711
   64   HD11  ILE  10          1HD1      ILE  10 -13.983  -6.534 -12.319
   65   HD12  ILE  10          2HD1      ILE  10 -13.143  -6.311 -13.854
   66   HD13  ILE  10          3HD1      ILE  10 -13.306  -7.925 -13.164
   67    H    PHE  11           H        PHE  11  -8.895  -4.777  -9.425
   68    HA   PHE  11           HA       PHE  11 -11.250  -3.519  -8.257
   69    HB2  PHE  11           1HB      PHE  11  -9.942  -5.960  -7.039
   70    HB3  PHE  11           2HB      PHE  11 -11.215  -5.001  -6.292
   71    HD1  PHE  11           1HD      PHE  11 -13.233  -4.603  -8.166
   72    HD2  PHE  11           2HD      PHE  11 -10.682  -7.988  -7.784
   73    HE1  PHE  11           1HE      PHE  11 -14.933  -6.004  -9.264
   74    HE2  PHE  11           2HE      PHE  11 -12.376  -9.394  -8.881
   75    HZ   PHE  11           HZ       PHE  11 -14.505  -8.403  -9.623
   76    H    THR  12           H        THR  12 -10.607  -3.137  -5.748
   77    HA   THR  12           HA       THR  12  -8.840  -1.087  -5.625
   78    HB   THR  12           HB       THR  12  -8.556  -1.579  -3.188
   79    HG1  THR  12           1HG      THR  12 -10.265  -3.799  -3.677
   80   HG21  THR  12          1HG2      THR  12 -11.441  -2.004  -3.821
   81   HG22  THR  12          2HG2      THR  12 -10.652  -0.530  -4.382
   82   HG23  THR  12          3HG2      THR  12 -10.694  -0.908  -2.660
   83    H    ASN  13           H        ASN  13  -6.683  -0.774  -5.478
   84    HA   ASN  13           HA       ASN  13  -4.982  -3.132  -5.803
   85    HB2  ASN  13           1HB      ASN  13  -3.987  -0.313  -6.036
   86    HB3  ASN  13           2HB      ASN  13  -3.422  -1.763  -6.861
   87   HD21  ASN  13          1HD2      ASN  13  -5.199   1.024  -7.158
   88   HD22  ASN  13          2HD2      ASN  13  -6.072   0.639  -8.599
   89    H    LYS  14           H        LYS  14  -2.591  -2.418  -4.905
   90    HA   LYS  14           HA       LYS  14  -2.910  -1.534  -2.126
   91    HB2  LYS  14           1HB      LYS  14  -1.547  -3.383  -1.311
   92    HB3  LYS  14           2HB      LYS  14  -2.982  -3.992  -2.124
   93    HG2  LYS  14           1HG      LYS  14  -1.756  -4.693  -3.999
   94    HG3  LYS  14           2HG      LYS  14  -0.342  -3.747  -3.528
   95    HD2  LYS  14           1HD      LYS  14  -1.396  -5.972  -1.808
   96    HD3  LYS  14           2HD      LYS  14  -0.275  -6.281  -3.136
   97    HE2  LYS  14           1HE      LYS  14   1.436  -5.044  -2.130
   98    HE3  LYS  14           2HE      LYS  14   0.322  -4.219  -1.041
   99    HZ1  LYS  14           1HZ      LYS  14   1.674  -6.722  -0.709
  100    HZ2  LYS  14           2HZ      LYS  14   0.013  -6.846  -0.415
  101    HZ3  LYS  14           3HZ      LYS  14   0.944  -5.729   0.450
  102    H    CYS  15           H        CYS  15  -0.735  -1.173  -1.073
  103    HA   CYS  15           HA       CYS  15   0.954   0.273  -2.960
  104    HB2  CYS  15           1HB      CYS  15   0.195   1.443  -0.938
  105    HB3  CYS  15           2HB      CYS  15   0.979   0.227   0.066
  106    H    GLU  16           H        GLU  16   3.144  -0.087  -3.224
  107    HA   GLU  16           HA       GLU  16   4.046  -2.758  -2.456
  108    HB2  GLU  16           1HB      GLU  16   5.090  -0.761  -4.465
  109    HB3  GLU  16           2HB      GLU  16   5.905  -2.274  -4.093
  110    HG2  GLU  16           1HG      GLU  16   3.574  -3.317  -4.663
  111    HG3  GLU  16           2HG      GLU  16   3.347  -1.803  -5.537
  112    H    ARG  17           H        ARG  17   3.963  -0.408  -0.615
  113    HA   ARG  17           HA       ARG  17   6.822  -0.051  -0.060
  114    HB2  ARG  17           1HB      ARG  17   5.460   1.990  -0.196
  115    HB3  ARG  17           2HB      ARG  17   4.422   1.385   1.088
  116    HG2  ARG  17           1HG      ARG  17   5.771   2.736   2.312
  117    HG3  ARG  17           2HG      ARG  17   6.722   1.251   2.387
  118    HD2  ARG  17           1HD      ARG  17   7.179   3.161   0.143
  119    HD3  ARG  17           2HD      ARG  17   7.837   3.536   1.735
  120    HE   ARG  17           HE       ARG  17   8.701   1.441  -0.063
  121   HH11  ARG  17          2HH1      ARG  17   8.743   2.697   3.184
  122   HH12  ARG  17          1HH1      ARG  17  10.186   1.848   3.633
  123   HH21  ARG  17          2HH2      ARG  17  10.600   0.318   0.516
  124   HH22  ARG  17          1HH2      ARG  17  11.242   0.496   2.114
  125    H    ALA  18           H        ALA  18   7.779  -1.052   1.591
  126    HA   ALA  18           HA       ALA  18   6.679  -3.145   2.994
  127    HB1  ALA  18           1HB      ALA  18   8.960  -3.152   3.110
  128    HB2  ALA  18           2HB      ALA  18   9.061  -1.418   3.419
  129    HB3  ALA  18           3HB      ALA  18   8.580  -2.517   4.711
  130    H    GLY  19           H        GLY  19   5.606  -3.420   4.896
  131    HA2  GLY  19           1HA      GLY  19   4.536  -2.876   6.873
  132    HA3  GLY  19           2HA      GLY  19   5.312  -1.300   6.813
  133    H    CYS  20           H        CYS  20   4.380  -0.386   4.352
  134    HA   CYS  20           HA       CYS  20   1.820   0.581   5.085
  135    HB2  CYS  20           1HB      CYS  20   3.574   1.734   3.625
  136    HB3  CYS  20           2HB      CYS  20   2.996   0.713   2.312
  137    H    ARG  21           H        ARG  21  -0.129  -0.258   4.759
  138    HA   ARG  21           HA       ARG  21  -0.436  -2.331   2.687
  139    HB2  ARG  21           1HB      ARG  21  -1.505  -2.263   5.502
  140    HB3  ARG  21           2HB      ARG  21  -2.236  -3.269   4.258
  141    HG2  ARG  21           1HG      ARG  21   0.314  -4.021   3.974
  142    HG3  ARG  21           2HG      ARG  21   0.331  -3.571   5.680
  143    HD2  ARG  21           1HD      ARG  21  -1.394  -5.119   6.193
  144    HD3  ARG  21           2HD      ARG  21  -1.738  -5.400   4.487
  145    HE   ARG  21           HE       ARG  21   0.923  -6.113   5.421
  146   HH11  ARG  21          2HH1      ARG  21  -2.299  -7.146   4.600
  147   HH12  ARG  21          1HH1      ARG  21  -1.855  -8.808   4.396
  148   HH21  ARG  21          2HH2      ARG  21   1.520  -8.298   5.155
  149   HH22  ARG  21          1HH2      ARG  21   0.317  -9.463   4.713
  150    H    GLN  22           H        GLN  22  -0.921   0.501   2.438
  151    HA   GLN  22           HA       GLN  22  -3.619   1.192   2.743
  152    HB2  GLN  22           1HB      GLN  22  -1.338   2.210   1.134
  153    HB3  GLN  22           2HB      GLN  22  -2.951   2.713   0.646
  154    HG2  GLN  22           1HG      GLN  22  -1.515   3.246   3.216
  155    HG3  GLN  22           2HG      GLN  22  -2.225   4.393   2.081
  156   HE21  GLN  22          1HE2      GLN  22  -4.649   4.099   1.795
  157   HE22  GLN  22          2HE2      GLN  22  -5.563   3.860   3.242
  158    H    ARG  23           H        ARG  23  -5.320   1.318   1.210
  159    HA   ARG  23           HA       ARG  23  -5.055  -0.523  -1.073
  160    HB2  ARG  23           1HB      ARG  23  -7.361  -0.297   0.866
  161    HB3  ARG  23           2HB      ARG  23  -7.435  -1.188  -0.648
  162    HG2  ARG  23           1HG      ARG  23  -6.943  -2.880   0.794
  163    HG3  ARG  23           2HG      ARG  23  -5.313  -2.388   0.332
  164    HD2  ARG  23           1HD      ARG  23  -5.386  -2.657   2.715
  165    HD3  ARG  23           2HD      ARG  23  -5.240  -0.939   2.346
  166    HE   ARG  23           HE       ARG  23  -7.885  -1.208   2.605
  167   HH11  ARG  23          2HH1      ARG  23  -5.254  -2.328   4.591
  168   HH12  ARG  23          1HH1      ARG  23  -6.162  -2.250   6.065
  169   HH21  ARG  23          2HH2      ARG  23  -9.090  -1.101   4.538
  170   HH22  ARG  23          1HH2      ARG  23  -8.344  -1.553   6.034
  171    H    GLU  24           H        GLU  24  -4.666   1.429  -2.307
  172    HA   GLU  24           HA       GLU  24  -6.661   3.465  -2.491
  173    HB2  GLU  24           1HB      GLU  24  -4.133   2.805  -3.919
  174    HB3  GLU  24           2HB      GLU  24  -5.280   3.856  -4.738
  175    HG2  GLU  24           1HG      GLU  24  -4.374   4.405  -1.936
  176    HG3  GLU  24           2HG      GLU  24  -3.445   4.939  -3.336
  177    H    MET  25           H        MET  25  -8.344   3.671  -3.865
  178    HA   MET  25           HA       MET  25  -9.403   1.382  -5.126
  179    HB2  MET  25           1HB      MET  25 -10.118   4.294  -5.133
  180    HB3  MET  25           2HB      MET  25 -10.939   3.183  -6.222
  181    HG2  MET  25           1HG      MET  25 -12.285   3.392  -4.291
  182    HG3  MET  25           2HG      MET  25 -11.531   1.800  -4.228
  183    HE1  MET  25           1HE      MET  25  -9.929   1.047  -2.018
  184    HE2  MET  25           2HE      MET  25 -10.815   1.762  -0.671
  185    HE3  MET  25           3HE      MET  25 -11.691   1.133  -2.067
  186    H    MET  26           H        MET  26  -7.640   4.182  -6.357
  187    HA   MET  26           HA       MET  26  -7.740   3.081  -9.067
  188    HB2  MET  26           1HB      MET  26  -6.931   5.209  -9.822
  189    HB3  MET  26           2HB      MET  26  -8.232   5.502  -8.676
  190    HG2  MET  26           1HG      MET  26  -6.715   6.145  -6.978
  191    HG3  MET  26           2HG      MET  26  -5.332   5.569  -7.906
  192    HE1  MET  26           1HE      MET  26  -5.066   9.160  -7.160
  193    HE2  MET  26           2HE      MET  26  -6.801   9.453  -7.276
  194    HE3  MET  26           3HE      MET  26  -6.198   8.075  -6.354
  195    H    LYS  27           H        LYS  27  -5.712   3.092 -10.343
  196    HA   LYS  27           HA       LYS  27  -3.592   1.850  -8.799
  197    HB2  LYS  27           1HB      LYS  27  -4.591   1.138 -11.139
  198    HB3  LYS  27           2HB      LYS  27  -3.406   2.285 -11.750
  199    HG2  LYS  27           1HG      LYS  27  -1.635   1.042 -10.573
  200    HG3  LYS  27           2HG      LYS  27  -2.841  -0.135 -10.049
  201    HD2  LYS  27           1HD      LYS  27  -2.384   0.525 -12.948
  202    HD3  LYS  27           2HD      LYS  27  -1.470  -0.731 -12.109
  203    HE2  LYS  27           1HE      LYS  27  -3.678  -1.757 -11.473
  204    HE3  LYS  27           2HE      LYS  27  -4.445  -0.607 -12.566
  205    HZ1  LYS  27           1HZ      LYS  27  -2.489  -2.721 -13.278
  206    HZ2  LYS  27           2HZ      LYS  27  -3.005  -1.521 -14.352
  207    HZ3  LYS  27           3HZ      LYS  27  -4.117  -2.636 -13.734
  208    H    LEU  28           H        LEU  28  -1.840   2.884  -8.118
  209    HA   LEU  28           HA       LEU  28  -1.046   5.363  -9.498
  210    HB2  LEU  28           1HB      LEU  28  -0.942   4.729  -6.554
  211    HB3  LEU  28           2HB      LEU  28  -0.198   6.145  -7.293
  212    HG   LEU  28           HG       LEU  28  -3.128   5.680  -7.641
  213   HD11  LEU  28          1HD1      LEU  28  -3.277   7.232  -5.548
  214   HD12  LEU  28          2HD1      LEU  28  -1.733   6.489  -5.133
  215   HD13  LEU  28          3HD1      LEU  28  -3.164   5.483  -5.352
  216   HD21  LEU  28          1HD2      LEU  28  -3.184   8.079  -7.792
  217   HD22  LEU  28          2HD2      LEU  28  -1.925   7.470  -8.866
  218   HD23  LEU  28          3HD2      LEU  28  -1.490   8.191  -7.316
  219    H    THR  29           H        THR  29   0.512   4.394 -10.777
  220    HA   THR  29           HA       THR  29   2.670   2.938  -9.428
  221    HB   THR  29           HB       THR  29   2.139   3.265 -12.388
  222    HG1  THR  29           1HG      THR  29   1.419   1.326 -10.480
  223   HG21  THR  29          1HG2      THR  29   3.749   1.251 -12.435
  224   HG22  THR  29          2HG2      THR  29   4.234   1.788 -10.827
  225   HG23  THR  29          3HG2      THR  29   4.434   2.860 -12.212
  226    H    CYS  30           H        CYS  30   4.718   3.696  -9.302
  227    HA   CYS  30           HA       CYS  30   5.220   6.441  -9.493
  228    HB2  CYS  30           1HB      CYS  30   6.477   4.699  -8.117
  229    HB3  CYS  30           2HB      CYS  30   7.354   4.311  -9.593
  230    H    GLU  31           H        GLU  31   7.040   7.402 -10.811
  231    HA   GLU  31           HA       GLU  31   6.691   6.586 -13.612
  232    HB2  GLU  31           1HB      GLU  31   7.425   8.882 -14.167
  233    HB3  GLU  31           2HB      GLU  31   5.981   8.856 -13.165
  234    HG2  GLU  31           1HG      GLU  31   7.322   9.366 -11.198
  235    HG3  GLU  31           2HG      GLU  31   8.782   9.366 -12.186
  236    H    ARG  32           H        ARG  32   8.943   6.636 -11.083
  237    HA   ARG  32           HA       ARG  32  11.241   6.578 -12.898
  238    HB2  ARG  32           1HB      ARG  32  11.035   6.758  -9.891
  239    HB3  ARG  32           2HB      ARG  32  12.561   6.560 -10.743
  240    HG2  ARG  32           1HG      ARG  32  12.051   8.671 -11.979
  241    HG3  ARG  32           2HG      ARG  32  10.664   8.887 -10.909
  242    HD2  ARG  32           1HD      ARG  32  12.310  10.139  -9.865
  243    HD3  ARG  32           2HD      ARG  32  12.392   8.602  -9.006
  244    HE   ARG  32           HE       ARG  32  14.470   8.217  -9.931
  245   HH11  ARG  32          2HH1      ARG  32  12.985  10.987 -11.428
  246   HH12  ARG  32          1HH1      ARG  32  14.433  11.489 -12.236
  247   HH21  ARG  32          2HH2      ARG  32  16.382   8.868 -10.990
  248   HH22  ARG  32          1HH2      ARG  32  16.364  10.283 -11.988
  249    H    CYS  33           H        CYS  33  10.009   4.702 -10.122
  250    HA   CYS  33           HA       CYS  33  11.555   2.392 -10.964
  251    HB2  CYS  33           1HB      CYS  33  10.560   1.351  -8.896
  252    HB3  CYS  33           2HB      CYS  33  11.530   2.792  -8.607
  253    H    SER  34           H        SER  34   8.379   3.628 -11.306
  254    HA   SER  34           HA       SER  34   6.520   2.849 -12.359
  255    HB2  SER  34           1HB      SER  34   8.441   0.730 -13.350
  256    HB3  SER  34           2HB      SER  34   6.798   0.950 -13.953
  257    HG   SER  34           HG       SER  34   7.756   3.292 -14.168
  258    H    ARG  35           H        ARG  35   6.743   2.223  -9.701
  259    HA   ARG  35           HA       ARG  35   5.582  -0.484  -9.577
  260    HB2  ARG  35           1HB      ARG  35   7.356   0.957  -7.615
  261    HB3  ARG  35           2HB      ARG  35   6.357  -0.408  -7.135
  262    HG2  ARG  35           1HG      ARG  35   7.503  -1.690  -9.019
  263    HG3  ARG  35           2HG      ARG  35   8.665  -0.363  -9.046
  264    HD2  ARG  35           1HD      ARG  35   9.363  -0.795  -6.836
  265    HD3  ARG  35           2HD      ARG  35   7.978  -1.840  -6.521
  266    HE   ARG  35           HE       ARG  35   9.744  -2.760  -8.614
  267   HH11  ARG  35          2HH1      ARG  35   8.988  -2.825  -5.216
  268   HH12  ARG  35          1HH1      ARG  35   9.810  -4.323  -4.929
  269   HH21  ARG  35          2HH2      ARG  35  10.829  -4.732  -8.248
  270   HH22  ARG  35          1HH2      ARG  35  10.857  -5.406  -6.654
  271    H    ASN  36           H        ASN  36   3.829  -0.804  -8.148
  272    HA   ASN  36           HA       ASN  36   2.032   1.396  -8.001
  273    HB2  ASN  36           1HB      ASN  36   1.547  -1.166  -8.207
  274    HB3  ASN  36           2HB      ASN  36   1.626  -1.138  -6.448
  275   HD21  ASN  36          1HD2      ASN  36  -0.660  -1.925  -7.114
  276   HD22  ASN  36          2HD2      ASN  36  -1.876  -0.697  -7.121
  277    H    PHE  37           H        PHE  37   1.253   2.505  -6.214
  278    HA   PHE  37           HA       PHE  37   2.212   1.971  -3.565
  279    HB2  PHE  37           1HB      PHE  37   3.164   4.493  -4.939
  280    HB3  PHE  37           2HB      PHE  37   3.437   4.064  -3.253
  281    HD1  PHE  37           2HD      PHE  37   4.688   1.819  -2.844
  282    HD2  PHE  37           1HD      PHE  37   4.761   3.972  -6.515
  283    HE1  PHE  37           2HE      PHE  37   6.771   0.670  -3.473
  284    HE2  PHE  37           1HE      PHE  37   6.843   2.826  -7.150
  285    HZ   PHE  37           HZ       PHE  37   7.852   1.173  -5.628
  286    H    CYS  38           H        CYS  38   1.496   3.772  -2.034
  287    HA   CYS  38           HA       CYS  38  -1.221   4.528  -2.792
  288    HB2  CYS  38           1HB      CYS  38  -1.640   4.822  -0.443
  289    HB3  CYS  38           2HB      CYS  38  -0.779   3.301  -0.653
  290    H    ILE  39           H        ILE  39  -2.040   6.642  -2.465
  291    HA   ILE  39           HA       ILE  39  -0.756   8.735  -3.532
  292    HB   ILE  39           HB       ILE  39  -2.720   8.774  -1.251
  293   HG12  ILE  39          1HG1      ILE  39  -3.041   9.555  -4.153
  294   HG13  ILE  39          2HG1      ILE  39  -3.414   7.953  -3.525
  295   HG21  ILE  39          1HG2      ILE  39  -1.321  10.805  -1.169
  296   HG22  ILE  39          2HG2      ILE  39  -1.768  11.153  -2.838
  297   HG23  ILE  39          3HG2      ILE  39  -3.001  11.151  -1.577
  298   HD11  ILE  39          1HD1      ILE  39  -5.263   9.802  -3.809
  299   HD12  ILE  39          2HD1      ILE  39  -5.297   8.660  -2.465
  300   HD13  ILE  39          3HD1      ILE  39  -4.682  10.295  -2.219
  301    H    LYS  40           H        LYS  40  -0.497   7.751  -0.146
  302    HA   LYS  40           HA       LYS  40   1.087   9.916   0.723
  303    HB2  LYS  40           1HB      LYS  40   0.496   7.175   1.749
  304    HB3  LYS  40           2HB      LYS  40   1.832   8.067   2.465
  305    HG2  LYS  40           1HG      LYS  40   0.157   8.713   3.855
  306    HG3  LYS  40           2HG      LYS  40   0.011   9.972   2.626
  307    HD2  LYS  40           1HD      LYS  40  -2.184   9.176   3.052
  308    HD3  LYS  40           2HD      LYS  40  -1.698   8.508   1.492
  309    HE2  LYS  40           1HE      LYS  40  -2.521   6.613   2.443
  310    HE3  LYS  40           2HE      LYS  40  -0.866   6.518   3.042
  311    HZ1  LYS  40           1HZ      LYS  40  -2.611   8.055   4.731
  312    HZ2  LYS  40           2HZ      LYS  40  -1.538   6.811   5.133
  313    HZ3  LYS  40           3HZ      LYS  40  -3.092   6.441   4.576
  314    H    HIS  41           H        HIS  41   1.923   6.727  -0.566
  315    HA   HIS  41           HA       HIS  41   4.747   7.549  -0.640
  316    HB2  HIS  41           1HB      HIS  41   3.522   4.788  -0.808
  317    HB3  HIS  41           2HB      HIS  41   5.246   5.135  -0.916
  318    HD2  HIS  41           2HD      HIS  41   5.211   7.272   1.703
  319    HE1  HIS  41           1HE      HIS  41   4.073   3.763   3.798
  320    HE2  HIS  41           2HE      HIS  41   4.905   6.132   4.004
  321    H    ARG  42           H        ARG  42   2.477   8.181  -2.550
  322    HA   ARG  42           HA       ARG  42   3.077   6.774  -4.970
  323    HB2  ARG  42           1HB      ARG  42   0.917   7.572  -5.013
  324    HB3  ARG  42           2HB      ARG  42   1.343   9.075  -4.205
  325    HG2  ARG  42           1HG      ARG  42   0.740   9.611  -6.433
  326    HG3  ARG  42           2HG      ARG  42   2.492   9.781  -6.311
  327    HD2  ARG  42           1HD      ARG  42   2.410   7.250  -7.100
  328    HD3  ARG  42           2HD      ARG  42   0.868   7.773  -7.778
  329    HE   ARG  42           HE       ARG  42   3.438   8.358  -8.798
  330   HH11  ARG  42          2HH1      ARG  42   0.306   9.794  -8.294
  331   HH12  ARG  42          1HH1      ARG  42   0.457  10.902  -9.618
  332   HH21  ARG  42          2HH2      ARG  42   3.648   9.812 -10.543
  333   HH22  ARG  42          1HH2      ARG  42   2.358  10.911 -10.897
  334    H    HIS  43           H        HIS  43   4.143   9.746  -3.466
  335    HA   HIS  43           HA       HIS  43   5.539  10.665  -5.823
  336    HB2  HIS  43           1HB      HIS  43   4.497  12.017  -3.767
  337    HB3  HIS  43           2HB      HIS  43   6.131  11.815  -3.142
  338    HD1  HIS  43           1HD      HIS  43   8.008  13.136  -4.286
  339    HD2  HIS  43           2HD      HIS  43   4.275  13.693  -6.023
  340    HE1  HIS  43           1HE      HIS  43   8.276  15.091  -5.844
  341    HA   PRO  44           HA       PRO  44   9.296   8.477  -5.124
  342    HB2  PRO  44           1HB      PRO  44  10.978  10.077  -6.531
  343    HB3  PRO  44           2HB      PRO  44   9.818   8.988  -7.302
  344    HG2  PRO  44           1HG      PRO  44   9.607  11.932  -6.800
  345    HG3  PRO  44           2HG      PRO  44   9.167  11.010  -8.249
  346    HD2  PRO  44           1HD      PRO  44   7.335  11.830  -6.433
  347    HD3  PRO  44           2HD      PRO  44   7.156  10.324  -7.356
  348    H    LEU  45           H        LEU  45   8.486  11.251  -3.607
  349    HA   LEU  45           HA       LEU  45  11.147  11.682  -2.437
  350    HB2  LEU  45           1HB      LEU  45   8.672  13.382  -2.535
  351    HB3  LEU  45           2HB      LEU  45  10.013  13.737  -1.448
  352    HG   LEU  45           HG       LEU  45  10.144  13.677  -4.463
  353   HD11  LEU  45          1HD1      LEU  45   9.005  15.611  -3.009
  354   HD12  LEU  45          2HD1      LEU  45   9.925  15.927  -4.480
  355   HD13  LEU  45          3HD1      LEU  45  10.689  16.126  -2.903
  356   HD21  LEU  45          1HD2      LEU  45  12.291  13.131  -3.921
  357   HD22  LEU  45          2HD2      LEU  45  12.203  13.890  -2.331
  358   HD23  LEU  45          3HD2      LEU  45  12.392  14.886  -3.774
  359    H    ASP  46           H        ASP  46   7.919  10.614  -1.756
  360    HA   ASP  46           HA       ASP  46   8.552  10.403   1.107
  361    HB2  ASP  46           1HB      ASP  46   5.954  10.466  -0.411
  362    HB3  ASP  46           2HB      ASP  46   6.031   9.854   1.240
  363    H    HIS  47           H        HIS  47   9.532   8.620  -1.056
  364    HA   HIS  47           HA       HIS  47   9.034   6.135   0.279
  365    HB2  HIS  47           1HB      HIS  47   7.789   4.988  -1.278
  366    HB3  HIS  47           2HB      HIS  47   7.106   6.599  -1.473
  367    HD1  HIS  47           1HD      HIS  47   6.810   7.165  -3.849
  368    HD2  HIS  47           2HD      HIS  47  10.142   4.755  -3.254
  369    HE1  HIS  47           1HE      HIS  47   7.802   6.814  -6.133
  370    H    ASP  48           H        ASP  48  10.768   4.845   0.102
  371    HA   ASP  48           HA       ASP  48  13.140   5.718  -1.057
  372    HB2  ASP  48           1HB      ASP  48  12.394   2.852  -0.443
  373    HB3  ASP  48           2HB      ASP  48  14.024   3.505  -0.582
  374    H    CYS  49           H        CYS  49  12.743   6.328  -3.205
  375    HA   CYS  49           HA       CYS  49  11.767   4.434  -5.131
  376    HB2  CYS  49           1HB      CYS  49  11.516   6.974  -5.235
  377    HB3  CYS  49           2HB      CYS  49  13.202   7.015  -5.741
  378    H    SER  50           H        SER  50  12.908   3.349  -6.708
  379    HA   SER  50           HA       SER  50  15.819   3.207  -6.278
  380    HB2  SER  50           1HB      SER  50  13.927   1.089  -7.328
  381    HB3  SER  50           2HB      SER  50  15.676   0.904  -7.190
  382    HG   SER  50           HG       SER  50  14.024   0.260  -5.377
  383    H    GLY  51           H        GLY  51  13.404   2.669  -8.855
  384    HA2  GLY  51           1HA      GLY  51  13.400   3.357 -11.054
  385    HA3  GLY  51           2HA      GLY  51  14.739   4.426 -10.665
  386    H    GLU  52           H        GLU  52  14.258   0.890 -10.757
  387    HA   GLU  52           HA       GLU  52  16.872   0.252 -11.475
  388    HB2  GLU  52           1HB      GLU  52  14.919  -1.272 -10.704
  389    HB3  GLU  52           2HB      GLU  52  14.528  -1.374 -12.416
  390    HG2  GLU  52           1HG      GLU  52  16.861  -2.169 -12.817
  391    HG3  GLU  52           2HG      GLU  52  17.070  -2.244 -11.068
  392    H    GLY  53           H        GLY  53  17.996   0.309 -13.324
  393    HA2  GLY  53           1HA      GLY  53  16.777   0.159 -15.905
  394    HA3  GLY  53           2HA      GLY  53  17.261   1.802 -15.515
  395    H    HIS  54           H        HIS  54  19.615   1.465 -14.200
  396    HA   HIS  54           HA       HIS  54  21.390   0.838 -16.361
  397    HB2  HIS  54           1HB      HIS  54  21.911   1.664 -13.499
  398    HB3  HIS  54           2HB      HIS  54  23.175   1.451 -14.707
  399    HD1  HIS  54           1HD      HIS  54  19.897   3.400 -14.577
  400    HD2  HIS  54           2HD      HIS  54  23.858   3.835 -15.751
  401    HE1  HIS  54           1HE      HIS  54  20.083   5.748 -15.457
  402    HA   PRO  55           HA       PRO  55  21.686  -3.470 -15.174
  403    HB2  PRO  55           1HB      PRO  55  23.256  -4.192 -17.267
  404    HB3  PRO  55           2HB      PRO  55  21.511  -3.955 -17.413
  405    HG2  PRO  55           1HG      PRO  55  23.742  -2.090 -18.125
  406    HG3  PRO  55           2HG      PRO  55  22.259  -2.457 -19.026
  407    HD2  PRO  55           1HD      PRO  55  22.534  -0.221 -17.523
  408    HD3  PRO  55           2HD      PRO  55  20.975  -1.042 -17.737
  409    H    THR  56           H        THR  56  22.974  -3.909 -13.496
  410    HA   THR  56           HA       THR  56  25.702  -2.927 -13.404
  411    HB   THR  56           HB       THR  56  25.769  -3.900 -11.143
  412    HG1  THR  56           1HG      THR  56  24.032  -5.026 -10.346
  413   HG21  THR  56          1HG2      THR  56  23.514  -2.625 -10.388
  414   HG22  THR  56          2HG2      THR  56  23.707  -1.976 -12.017
  415   HG23  THR  56          3HG2      THR  56  25.002  -1.792 -10.834
  416    H    SER  57           H        SER  57  26.914  -4.070 -14.860
  417    HA   SER  57           HA       SER  57  27.999  -5.827 -15.836
  418    HB2  SER  57           1HB      SER  57  27.937  -6.698 -12.941
  419    HB3  SER  57           2HB      SER  57  28.894  -7.510 -14.181
  420    HG   SER  57           HG       SER  57  30.251  -6.039 -13.310
  421    H    SER  58           H        SER  58  25.234  -5.981 -16.154
  422    HA   SER  58           HA       SER  58  24.822  -8.898 -16.122
  423    HB2  SER  58           1HB      SER  58  22.976  -6.695 -15.307
  424    HB3  SER  58           2HB      SER  58  22.286  -8.119 -16.085
  425    HG   SER  58           HG       SER  58  24.040  -8.274 -13.868
  426    H    GLY  59           H        GLY  59  23.952  -9.819 -17.949
  427    HA2  GLY  59           1HA      GLY  59  22.646  -8.509 -20.034
  428    HA3  GLY  59           2HA      GLY  59  24.364  -8.468 -20.401
  429    HA   PRO  60           HA       PRO  60  23.039 -13.134 -20.303
  430    HB2  PRO  60           1HB      PRO  60  20.365 -13.602 -20.341
  431    HB3  PRO  60           2HB      PRO  60  21.294 -13.460 -18.844
  432    HG2  PRO  60           1HG      PRO  60  19.591 -11.417 -20.218
  433    HG3  PRO  60           2HG      PRO  60  19.700 -11.804 -18.491
  434    HD2  PRO  60           1HD      PRO  60  20.960  -9.674 -19.589
  435    HD3  PRO  60           2HD      PRO  60  21.625 -10.568 -18.207
  436    H    SER  61           H        SER  61  22.634 -14.439 -22.108
  437    HA   SER  61           HA       SER  61  22.195 -12.976 -24.564
  438    HB2  SER  61           1HB      SER  61  22.807 -15.106 -25.665
  439    HB3  SER  61           2HB      SER  61  24.002 -14.620 -24.462
  440    HG   SER  61           HG       SER  61  22.043 -16.648 -24.284
  441    H    SER  62           H        SER  62  19.963 -12.450 -24.277
  442    HA   SER  62           HA       SER  62  18.102 -14.712 -24.480
  443    HB2  SER  62           1HB      SER  62  17.756 -12.968 -22.688
  444    HB3  SER  62           2HB      SER  62  17.416 -11.810 -23.974
  445    HG   SER  62           HG       SER  62  15.553 -12.781 -24.384
  446    H    GLY  63           H        GLY  63  16.466 -14.735 -26.079
  447    HA2  GLY  63           1HA      GLY  63  17.309 -13.983 -28.653
  448    HA3  GLY  63           2HA      GLY  63  15.694 -14.533 -28.230
  Start of MODEL   10
    1    H1   GLY   1           H        GLY   1 -21.360 -27.854  -3.640
    2    HA2  GLY   1           1HA      GLY   1 -19.071 -27.758  -3.959
    3    HA3  GLY   1           2HA      GLY   1 -19.520 -26.448  -5.041
    4    H    SER   2           H        SER   2 -18.167 -24.813  -4.731
    5    HA   SER   2           HA       SER   2 -17.353 -24.162  -1.980
    6    HB2  SER   2           1HB      SER   2 -16.006 -23.932  -4.627
    7    HB3  SER   2           2HB      SER   2 -15.639 -22.702  -3.418
    8    HG   SER   2           HG       SER   2 -15.087 -25.440  -3.407
    9    H    SER   3           H        SER   3 -18.613 -22.640  -1.132
   10    HA   SER   3           HA       SER   3 -19.823 -20.604  -2.814
   11    HB2  SER   3           1HB      SER   3 -21.029 -21.815  -0.915
   12    HB3  SER   3           2HB      SER   3 -20.064 -20.832   0.186
   13    HG   SER   3           HG       SER   3 -20.965 -18.979  -0.804
   14    H    GLY   4           H        GLY   4 -18.928 -18.689  -3.173
   15    HA2  GLY   4           1HA      GLY   4 -17.844 -16.984  -1.276
   16    HA3  GLY   4           2HA      GLY   4 -16.494 -17.900  -1.932
   17    H    SER   5           H        SER   5 -15.682 -15.850  -2.693
   18    HA   SER   5           HA       SER   5 -15.212 -14.404  -4.389
   19    HB2  SER   5           1HB      SER   5 -15.829 -16.535  -5.754
   20    HB3  SER   5           2HB      SER   5 -17.325 -15.671  -6.109
   21    HG   SER   5           HG       SER   5 -14.677 -14.828  -6.677
   22    H    SER   6           H        SER   6 -16.994 -13.601  -2.431
   23    HA   SER   6           HA       SER   6 -18.385 -11.492  -3.817
   24    HB2  SER   6           1HB      SER   6 -20.048 -13.334  -3.868
   25    HB3  SER   6           2HB      SER   6 -19.981 -13.416  -2.108
   26    HG   SER   6           HG       SER   6 -21.511 -11.868  -3.567
   27    H    GLY   7           H        GLY   7 -19.305  -9.892  -2.306
   28    HA2  GLY   7           1HA      GLY   7 -19.397  -8.778  -0.257
   29    HA3  GLY   7           2HA      GLY   7 -18.495 -10.097   0.474
   30    H    ARG   8           H        ARG   8 -16.159 -10.239  -0.186
   31    HA   ARG   8           HA       ARG   8 -15.002  -7.576   0.015
   32    HB2  ARG   8           1HB      ARG   8 -12.871  -8.848   0.405
   33    HB3  ARG   8           2HB      ARG   8 -14.142  -9.162   1.580
   34    HG2  ARG   8           1HG      ARG   8 -14.695 -11.244   0.420
   35    HG3  ARG   8           2HG      ARG   8 -13.407 -10.929  -0.745
   36    HD2  ARG   8           1HD      ARG   8 -12.952 -11.156   2.224
   37    HD3  ARG   8           2HD      ARG   8 -12.819 -12.518   1.113
   38    HE   ARG   8           HE       ARG   8 -11.212 -10.199   0.454
   39   HH11  ARG   8          2HH1      ARG   8 -11.370 -13.299   2.030
   40   HH12  ARG   8          1HH1      ARG   8  -9.655 -13.542   2.010
   41   HH21  ARG   8          2HH2      ARG   8  -8.953 -10.507   0.423
   42   HH22  ARG   8          1HH2      ARG   8  -8.280 -11.953   1.097
   43    H    LYS   9           H        LYS   9 -15.612  -7.055  -2.224
   44    HA   LYS   9           HA       LYS   9 -14.523  -8.413  -4.444
   45    HB2  LYS   9           1HB      LYS   9 -15.764  -5.745  -3.977
   46    HB3  LYS   9           2HB      LYS   9 -14.852  -5.974  -5.464
   47    HG2  LYS   9           1HG      LYS   9 -16.963  -6.545  -6.140
   48    HG3  LYS   9           2HG      LYS   9 -16.313  -8.124  -5.692
   49    HD2  LYS   9           1HD      LYS   9 -18.345  -8.176  -4.621
   50    HD3  LYS   9           2HD      LYS   9 -17.319  -7.521  -3.343
   51    HE2  LYS   9           1HE      LYS   9 -18.046  -5.281  -3.839
   52    HE3  LYS   9           2HE      LYS   9 -18.946  -5.842  -5.248
   53    HZ1  LYS   9           1HZ      LYS   9 -19.812  -5.663  -2.587
   54    HZ2  LYS   9           2HZ      LYS   9 -19.828  -7.294  -3.034
   55    HZ3  LYS   9           3HZ      LYS   9 -20.689  -6.160  -3.946
   56    H    ILE  10           H        ILE  10 -12.732  -7.952  -5.735
   57    HA   ILE  10           HA       ILE  10 -10.572  -6.550  -4.326
   58    HB   ILE  10           HB       ILE  10  -9.030  -7.758  -5.782
   59   HG12  ILE  10          1HG1      ILE  10 -11.414  -9.242  -6.888
   60   HG13  ILE  10          2HG1      ILE  10 -10.693  -7.862  -7.711
   61   HG21  ILE  10          1HG2      ILE  10 -10.986  -9.139  -4.061
   62   HG22  ILE  10          2HG2      ILE  10  -9.988 -10.169  -5.086
   63   HG23  ILE  10          3HG2      ILE  10  -9.228  -9.058  -3.947
   64   HD11  ILE  10          1HD1      ILE  10  -8.494  -9.232  -7.485
   65   HD12  ILE  10          2HD1      ILE  10  -9.596 -10.594  -7.276
   66   HD13  ILE  10          3HD1      ILE  10  -9.661  -9.625  -8.748
   67    H    PHE  11           H        PHE  11 -12.491  -4.967  -5.619
   68    HA   PHE  11           HA       PHE  11 -11.438  -4.177  -8.193
   69    HB2  PHE  11           1HB      PHE  11 -13.756  -3.370  -6.494
   70    HB3  PHE  11           2HB      PHE  11 -13.184  -2.240  -7.716
   71    HD1  PHE  11           1HD      PHE  11 -12.461  -3.906  -9.946
   72    HD2  PHE  11           2HD      PHE  11 -15.723  -4.296  -7.240
   73    HE1  PHE  11           1HE      PHE  11 -13.737  -5.118 -11.665
   74    HE2  PHE  11           2HE      PHE  11 -17.004  -5.509  -8.954
   75    HZ   PHE  11           HZ       PHE  11 -16.012  -5.922 -11.170
   76    H    THR  12           H        THR  12  -9.566  -3.994  -6.069
   77    HA   THR  12           HA       THR  12  -8.858  -1.186  -6.327
   78    HB   THR  12           HB       THR  12  -8.307  -1.028  -3.875
   79    HG1  THR  12           1HG      THR  12  -9.519  -3.538  -3.957
   80   HG21  THR  12          1HG2      THR  12 -10.289  -0.009  -3.474
   81   HG22  THR  12          2HG2      THR  12 -11.231  -1.427  -3.937
   82   HG23  THR  12          3HG2      THR  12 -10.574  -0.361  -5.178
   83    H    ASN  13           H        ASN  13  -6.633  -0.801  -5.304
   84    HA   ASN  13           HA       ASN  13  -4.958  -3.193  -5.710
   85    HB2  ASN  13           1HB      ASN  13  -3.189  -1.407  -6.397
   86    HB3  ASN  13           2HB      ASN  13  -4.426  -1.879  -7.558
   87   HD21  ASN  13          1HD2      ASN  13  -6.451  -0.507  -7.449
   88   HD22  ASN  13          2HD2      ASN  13  -6.213   1.198  -7.297
   89    H    LYS  14           H        LYS  14  -2.726  -2.902  -4.703
   90    HA   LYS  14           HA       LYS  14  -3.009  -1.599  -2.074
   91    HB2  LYS  14           1HB      LYS  14  -1.568  -3.380  -1.162
   92    HB3  LYS  14           2HB      LYS  14  -3.060  -4.019  -1.839
   93    HG2  LYS  14           1HG      LYS  14  -1.562  -5.511  -2.683
   94    HG3  LYS  14           2HG      LYS  14  -1.572  -4.319  -3.986
   95    HD2  LYS  14           1HD      LYS  14   0.506  -3.493  -3.425
   96    HD3  LYS  14           2HD      LYS  14   0.376  -4.014  -1.744
   97    HE2  LYS  14           1HE      LYS  14   1.875  -5.554  -2.530
   98    HE3  LYS  14           2HE      LYS  14   0.363  -6.408  -2.834
   99    HZ1  LYS  14           1HZ      LYS  14   2.270  -5.298  -4.711
  100    HZ2  LYS  14           2HZ      LYS  14   0.647  -5.033  -5.103
  101    HZ3  LYS  14           3HZ      LYS  14   1.216  -6.610  -4.885
  102    H    CYS  15           H        CYS  15  -0.820  -1.198  -1.021
  103    HA   CYS  15           HA       CYS  15   0.847   0.195  -2.963
  104    HB2  CYS  15           1HB      CYS  15   0.055   1.343  -0.892
  105    HB3  CYS  15           2HB      CYS  15   1.019   0.215   0.056
  106    H    GLU  16           H        GLU  16   2.924  -0.307  -3.433
  107    HA   GLU  16           HA       GLU  16   3.847  -2.938  -2.815
  108    HB2  GLU  16           1HB      GLU  16   5.080  -0.618  -4.292
  109    HB3  GLU  16           2HB      GLU  16   5.928  -2.139  -4.053
  110    HG2  GLU  16           1HG      GLU  16   3.721  -3.138  -5.085
  111    HG3  GLU  16           2HG      GLU  16   3.588  -1.519  -5.770
  112    H    ARG  17           H        ARG  17   4.135   0.079  -1.282
  113    HA   ARG  17           HA       ARG  17   6.678  -0.078  -0.125
  114    HB2  ARG  17           1HB      ARG  17   5.331   1.957  -0.058
  115    HB3  ARG  17           2HB      ARG  17   4.151   1.163   0.975
  116    HG2  ARG  17           1HG      ARG  17   5.482   2.544   2.361
  117    HG3  ARG  17           2HG      ARG  17   5.967   0.876   2.675
  118    HD2  ARG  17           1HD      ARG  17   7.830   1.229   1.016
  119    HD3  ARG  17           2HD      ARG  17   7.407   2.940   1.023
  120    HE   ARG  17           HE       ARG  17   7.759   2.462   3.629
  121   HH11  ARG  17          2HH1      ARG  17   9.692   1.634   0.854
  122   HH12  ARG  17          1HH1      ARG  17  11.192   1.687   1.719
  123   HH21  ARG  17          2HH2      ARG  17   9.728   2.535   4.779
  124   HH22  ARG  17          1HH2      ARG  17  11.211   2.199   3.952
  125    H    ALA  18           H        ALA  18   7.440  -1.718   1.031
  126    HA   ALA  18           HA       ALA  18   6.089  -3.785   2.195
  127    HB1  ALA  18           1HB      ALA  18   8.319  -4.208   2.183
  128    HB2  ALA  18           2HB      ALA  18   8.748  -2.563   2.654
  129    HB3  ALA  18           3HB      ALA  18   8.161  -3.701   3.866
  130    H    GLY  19           H        GLY  19   6.980  -0.708   3.736
  131    HA2  GLY  19           1HA      GLY  19   5.592  -1.461   6.180
  132    HA3  GLY  19           2HA      GLY  19   6.488   0.025   5.903
  133    H    CYS  20           H        CYS  20   3.923  -1.287   3.866
  134    HA   CYS  20           HA       CYS  20   2.081   0.776   4.818
  135    HB2  CYS  20           1HB      CYS  20   3.453   1.576   2.795
  136    HB3  CYS  20           2HB      CYS  20   2.532   0.400   1.864
  137    H    ARG  21           H        ARG  21  -0.096   0.305   4.503
  138    HA   ARG  21           HA       ARG  21  -0.722  -2.292   3.282
  139    HB2  ARG  21           1HB      ARG  21  -2.171  -2.886   5.129
  140    HB3  ARG  21           2HB      ARG  21  -0.551  -2.569   5.737
  141    HG2  ARG  21           1HG      ARG  21  -1.208  -0.446   6.597
  142    HG3  ARG  21           2HG      ARG  21  -2.777  -0.548   5.797
  143    HD2  ARG  21           1HD      ARG  21  -3.336  -1.168   7.937
  144    HD3  ARG  21           2HD      ARG  21  -3.015  -2.739   7.205
  145    HE   ARG  21           HE       ARG  21  -0.734  -1.529   8.489
  146   HH11  ARG  21          2HH1      ARG  21  -3.512  -3.592   8.874
  147   HH12  ARG  21          1HH1      ARG  21  -2.870  -4.418  10.255
  148   HH21  ARG  21          2HH2      ARG  21   0.121  -2.608  10.307
  149   HH22  ARG  21          1HH2      ARG  21  -0.804  -3.856  11.071
  150    H    GLN  22           H        GLN  22  -1.050   0.493   2.391
  151    HA   GLN  22           HA       GLN  22  -3.782   1.239   2.647
  152    HB2  GLN  22           1HB      GLN  22  -1.474   2.116   0.979
  153    HB3  GLN  22           2HB      GLN  22  -3.090   2.569   0.452
  154    HG2  GLN  22           1HG      GLN  22  -1.754   3.254   3.055
  155    HG3  GLN  22           2HG      GLN  22  -2.208   4.352   1.753
  156   HE21  GLN  22          1HE2      GLN  22  -4.595   4.306   1.218
  157   HE22  GLN  22          2HE2      GLN  22  -5.685   4.283   2.558
  158    H    ARG  23           H        ARG  23  -5.310   1.376   0.826
  159    HA   ARG  23           HA       ARG  23  -4.978  -0.773  -1.147
  160    HB2  ARG  23           1HB      ARG  23  -7.238  -0.400   0.793
  161    HB3  ARG  23           2HB      ARG  23  -7.515  -1.183  -0.757
  162    HG2  ARG  23           1HG      ARG  23  -7.096  -2.997   0.561
  163    HG3  ARG  23           2HG      ARG  23  -5.469  -2.650  -0.027
  164    HD2  ARG  23           1HD      ARG  23  -4.953  -1.455   2.017
  165    HD3  ARG  23           2HD      ARG  23  -6.603  -1.685   2.595
  166    HE   ARG  23           HE       ARG  23  -6.086  -3.864   3.149
  167   HH11  ARG  23          2HH1      ARG  23  -3.498  -2.451   1.297
  168   HH12  ARG  23          1HH1      ARG  23  -2.388  -3.742   1.619
  169   HH21  ARG  23          2HH2      ARG  23  -4.634  -5.569   3.580
  170   HH22  ARG  23          1HH2      ARG  23  -3.036  -5.516   2.917
  171    H    GLU  24           H        GLU  24  -4.516   1.828  -1.768
  172    HA   GLU  24           HA       GLU  24  -6.434   3.568  -2.501
  173    HB2  GLU  24           1HB      GLU  24  -3.892   2.731  -3.798
  174    HB3  GLU  24           2HB      GLU  24  -4.982   3.739  -4.740
  175    HG2  GLU  24           1HG      GLU  24  -3.864   4.411  -2.027
  176    HG3  GLU  24           2HG      GLU  24  -3.314   5.068  -3.568
  177    H    MET  25           H        MET  25  -8.295   3.432  -3.549
  178    HA   MET  25           HA       MET  25  -9.195   1.151  -4.888
  179    HB2  MET  25           1HB      MET  25 -11.057   2.577  -5.675
  180    HB3  MET  25           2HB      MET  25 -10.746   2.762  -3.954
  181    HG2  MET  25           1HG      MET  25  -9.820   4.879  -4.223
  182    HG3  MET  25           2HG      MET  25  -9.551   4.643  -5.948
  183    HE1  MET  25           1HE      MET  25 -12.493   4.202  -3.456
  184    HE2  MET  25           2HE      MET  25 -12.087   5.901  -3.211
  185    HE3  MET  25           3HE      MET  25 -13.623   5.459  -3.959
  186    H    MET  26           H        MET  26  -7.487   3.971  -6.044
  187    HA   MET  26           HA       MET  26  -7.719   3.001  -8.807
  188    HB2  MET  26           1HB      MET  26  -7.110   5.188  -9.536
  189    HB3  MET  26           2HB      MET  26  -8.328   5.386  -8.283
  190    HG2  MET  26           1HG      MET  26  -6.237   5.602  -6.721
  191    HG3  MET  26           2HG      MET  26  -5.426   6.026  -8.227
  192    HE1  MET  26           1HE      MET  26  -6.742   9.409  -9.196
  193    HE2  MET  26           2HE      MET  26  -5.472   8.192  -9.322
  194    HE3  MET  26           3HE      MET  26  -7.083   7.854  -9.956
  195    H    LYS  27           H        LYS  27  -5.855   2.782 -10.110
  196    HA   LYS  27           HA       LYS  27  -3.558   1.814  -8.669
  197    HB2  LYS  27           1HB      LYS  27  -4.642   0.929 -10.892
  198    HB3  LYS  27           2HB      LYS  27  -3.608   2.136 -11.645
  199    HG2  LYS  27           1HG      LYS  27  -1.647   1.096 -10.618
  200    HG3  LYS  27           2HG      LYS  27  -2.688  -0.120  -9.873
  201    HD2  LYS  27           1HD      LYS  27  -1.818  -1.146 -11.806
  202    HD3  LYS  27           2HD      LYS  27  -3.465  -0.675 -12.232
  203    HE2  LYS  27           1HE      LYS  27  -2.293   1.512 -13.073
  204    HE3  LYS  27           2HE      LYS  27  -0.862   0.483 -13.124
  205    HZ1  LYS  27           1HZ      LYS  27  -1.809  -0.887 -14.720
  206    HZ2  LYS  27           2HZ      LYS  27  -2.298   0.655 -15.212
  207    HZ3  LYS  27           3HZ      LYS  27  -3.385  -0.359 -14.405
  208    H    LEU  28           H        LEU  28  -1.823   2.955  -8.138
  209    HA   LEU  28           HA       LEU  28  -1.219   5.396  -9.673
  210    HB2  LEU  28           1HB      LEU  28  -1.003   4.934  -6.705
  211    HB3  LEU  28           2HB      LEU  28  -0.303   6.322  -7.537
  212    HG   LEU  28           HG       LEU  28  -3.222   5.813  -7.842
  213   HD11  LEU  28          1HD1      LEU  28  -3.286   5.635  -5.556
  214   HD12  LEU  28          2HD1      LEU  28  -3.389   7.384  -5.755
  215   HD13  LEU  28          3HD1      LEU  28  -1.851   6.634  -5.327
  216   HD21  LEU  28          1HD2      LEU  28  -1.475   7.762  -8.687
  217   HD22  LEU  28          2HD2      LEU  28  -2.246   8.499  -7.283
  218   HD23  LEU  28          3HD2      LEU  28  -3.231   7.905  -8.620
  219    H    THR  29           H        THR  29   0.295   4.324 -10.963
  220    HA   THR  29           HA       THR  29   2.508   2.927  -9.718
  221    HB   THR  29           HB       THR  29   2.234   3.639 -12.638
  222    HG1  THR  29           1HG      THR  29   1.358   1.243 -11.371
  223   HG21  THR  29          1HG2      THR  29   4.368   2.825 -12.418
  224   HG22  THR  29          2HG2      THR  29   3.490   1.314 -12.655
  225   HG23  THR  29          3HG2      THR  29   3.957   1.818 -11.031
  226    H    CYS  30           H        CYS  30   4.683   3.555  -9.837
  227    HA   CYS  30           HA       CYS  30   5.119   6.373  -9.599
  228    HB2  CYS  30           1HB      CYS  30   6.315   4.451  -8.351
  229    HB3  CYS  30           2HB      CYS  30   7.306   4.317  -9.800
  230    H    GLU  31           H        GLU  31   7.085   7.360 -10.745
  231    HA   GLU  31           HA       GLU  31   6.839   6.770 -13.618
  232    HB2  GLU  31           1HB      GLU  31   7.324   9.057 -14.068
  233    HB3  GLU  31           2HB      GLU  31   6.115   9.037 -12.792
  234    HG2  GLU  31           1HG      GLU  31   8.143   9.205 -11.198
  235    HG3  GLU  31           2HG      GLU  31   9.013   9.740 -12.635
  236    H    ARG  32           H        ARG  32   8.993   6.822 -10.962
  237    HA   ARG  32           HA       ARG  32  11.365   6.848 -12.668
  238    HB2  ARG  32           1HB      ARG  32  10.921   7.004  -9.701
  239    HB3  ARG  32           2HB      ARG  32  12.507   6.611 -10.350
  240    HG2  ARG  32           1HG      ARG  32  12.303   8.742 -11.721
  241    HG3  ARG  32           2HG      ARG  32  10.935   9.142 -10.680
  242    HD2  ARG  32           1HD      ARG  32  12.787  10.195  -9.690
  243    HD3  ARG  32           2HD      ARG  32  12.508   8.747  -8.723
  244    HE   ARG  32           HE       ARG  32  14.329   7.880 -10.477
  245   HH11  ARG  32          2HH1      ARG  32  14.197  10.764  -8.532
  246   HH12  ARG  32          1HH1      ARG  32  15.918  10.902  -8.387
  247   HH21  ARG  32          2HH2      ARG  32  16.596   8.050 -10.293
  248   HH22  ARG  32          1HH2      ARG  32  17.281   9.358  -9.389
  249    H    CYS  33           H        CYS  33  10.022   4.798 -10.073
  250    HA   CYS  33           HA       CYS  33  11.630   2.557 -11.014
  251    HB2  CYS  33           1HB      CYS  33  10.795   1.404  -8.994
  252    HB3  CYS  33           2HB      CYS  33  11.555   2.946  -8.611
  253    H    SER  34           H        SER  34   8.436   3.774 -11.257
  254    HA   SER  34           HA       SER  34   6.592   3.040 -12.370
  255    HB2  SER  34           1HB      SER  34   8.421   0.851 -13.387
  256    HB3  SER  34           2HB      SER  34   6.845   1.275 -14.055
  257    HG   SER  34           HG       SER  34   8.127   2.454 -15.293
  258    H    ARG  35           H        ARG  35   6.736   2.377  -9.739
  259    HA   ARG  35           HA       ARG  35   5.646  -0.360  -9.661
  260    HB2  ARG  35           1HB      ARG  35   7.226   1.171  -7.601
  261    HB3  ARG  35           2HB      ARG  35   6.281  -0.255  -7.190
  262    HG2  ARG  35           1HG      ARG  35   7.613  -1.632  -8.618
  263    HG3  ARG  35           2HG      ARG  35   8.460  -0.225  -9.264
  264    HD2  ARG  35           1HD      ARG  35   9.636   0.127  -7.283
  265    HD3  ARG  35           2HD      ARG  35   8.504  -0.833  -6.332
  266    HE   ARG  35           HE       ARG  35   9.639  -2.571  -8.146
  267   HH11  ARG  35          2HH1      ARG  35  10.745  -0.503  -5.573
  268   HH12  ARG  35          1HH1      ARG  35  12.100  -1.506  -5.173
  269   HH21  ARG  35          2HH2      ARG  35  11.420  -3.900  -7.629
  270   HH22  ARG  35          1HH2      ARG  35  12.483  -3.437  -6.344
  271    H    ASN  36           H        ASN  36   3.947  -0.729  -8.063
  272    HA   ASN  36           HA       ASN  36   2.019   1.410  -8.113
  273    HB2  ASN  36           1HB      ASN  36   1.399  -0.976  -8.485
  274    HB3  ASN  36           2HB      ASN  36   1.807  -1.310  -6.805
  275   HD21  ASN  36          1HD2      ASN  36  -0.738  -1.427  -8.378
  276   HD22  ASN  36          2HD2      ASN  36  -1.869  -0.517  -7.442
  277    H    PHE  37           H        PHE  37   1.272   2.612  -6.427
  278    HA   PHE  37           HA       PHE  37   2.050   2.036  -3.709
  279    HB2  PHE  37           1HB      PHE  37   3.037   4.573  -5.030
  280    HB3  PHE  37           2HB      PHE  37   3.231   4.144  -3.333
  281    HD1  PHE  37           2HD      PHE  37   4.428   1.825  -2.927
  282    HD2  PHE  37           1HD      PHE  37   4.777   4.164  -6.466
  283    HE1  PHE  37           2HE      PHE  37   6.553   0.704  -3.453
  284    HE2  PHE  37           1HE      PHE  37   6.903   3.046  -6.999
  285    HZ   PHE  37           HZ       PHE  37   7.795   1.314  -5.491
  286    H    CYS  38           H        CYS  38   1.219   3.794  -2.205
  287    HA   CYS  38           HA       CYS  38  -1.472   4.494  -3.072
  288    HB2  CYS  38           1HB      CYS  38  -1.939   4.892  -0.729
  289    HB3  CYS  38           2HB      CYS  38  -1.108   3.349  -0.896
  290    H    ILE  39           H        ILE  39  -2.210   6.658  -1.799
  291    HA   ILE  39           HA       ILE  39  -1.031   8.780  -3.239
  292    HB   ILE  39           HB       ILE  39  -3.052   8.657  -1.028
  293   HG12  ILE  39          1HG1      ILE  39  -3.215   9.810  -3.817
  294   HG13  ILE  39          2HG1      ILE  39  -3.619   8.141  -3.428
  295   HG21  ILE  39          1HG2      ILE  39  -1.693  10.638  -0.576
  296   HG22  ILE  39          2HG2      ILE  39  -1.938  11.187  -2.232
  297   HG23  ILE  39          3HG2      ILE  39  -3.308  11.081  -1.127
  298   HD11  ILE  39          1HD1      ILE  39  -5.499   8.758  -2.209
  299   HD12  ILE  39          2HD1      ILE  39  -4.953  10.426  -2.033
  300   HD13  ILE  39          3HD1      ILE  39  -5.516   9.843  -3.599
  301    H    LYS  40           H        LYS  40  -0.441   7.456  -0.081
  302    HA   LYS  40           HA       LYS  40   1.011   9.721   0.917
  303    HB2  LYS  40           1HB      LYS  40   0.432   6.956   1.857
  304    HB3  LYS  40           2HB      LYS  40   1.830   7.773   2.546
  305    HG2  LYS  40           1HG      LYS  40   0.252   8.415   4.043
  306    HG3  LYS  40           2HG      LYS  40   0.075   9.724   2.873
  307    HD2  LYS  40           1HD      LYS  40  -2.117   8.989   3.353
  308    HD3  LYS  40           2HD      LYS  40  -1.720   8.309   1.773
  309    HE2  LYS  40           1HE      LYS  40  -2.811   6.637   3.142
  310    HE3  LYS  40           2HE      LYS  40  -1.131   6.182   2.863
  311    HZ1  LYS  40           1HZ      LYS  40  -1.993   5.921   5.201
  312    HZ2  LYS  40           2HZ      LYS  40  -1.999   7.609   5.307
  313    HZ3  LYS  40           3HZ      LYS  40  -0.546   6.784   5.040
  314    H    HIS  41           H        HIS  41   1.823   6.679  -0.658
  315    HA   HIS  41           HA       HIS  41   4.642   7.534  -0.738
  316    HB2  HIS  41           1HB      HIS  41   3.503   4.738  -0.944
  317    HB3  HIS  41           2HB      HIS  41   5.211   5.153  -1.051
  318    HD2  HIS  41           2HD      HIS  41   5.427   7.080   1.586
  319    HE1  HIS  41           1HE      HIS  41   3.883   3.715   3.658
  320    HE2  HIS  41           2HE      HIS  41   5.015   5.954   3.878
  321    H    ARG  42           H        ARG  42   2.287   8.139  -2.551
  322    HA   ARG  42           HA       ARG  42   2.686   6.784  -5.003
  323    HB2  ARG  42           1HB      ARG  42   0.647   7.820  -5.007
  324    HB3  ARG  42           2HB      ARG  42   1.234   9.216  -4.112
  325    HG2  ARG  42           1HG      ARG  42   0.656   9.957  -6.287
  326    HG3  ARG  42           2HG      ARG  42   2.418   9.943  -6.192
  327    HD2  ARG  42           1HD      ARG  42   2.148   7.529  -7.167
  328    HD3  ARG  42           2HD      ARG  42   0.579   8.136  -7.696
  329    HE   ARG  42           HE       ARG  42   3.118   8.757  -8.824
  330   HH11  ARG  42          2HH1      ARG  42  -0.042  10.067  -8.176
  331   HH12  ARG  42          1HH1      ARG  42   0.019  11.205  -9.481
  332   HH21  ARG  42          2HH2      ARG  42   3.210  10.251 -10.545
  333   HH22  ARG  42          1HH2      ARG  42   1.869  11.308 -10.828
  334    H    HIS  43           H        HIS  43   4.135   9.629  -3.559
  335    HA   HIS  43           HA       HIS  43   5.630  10.213  -5.996
  336    HB2  HIS  43           1HB      HIS  43   4.542  11.910  -4.245
  337    HB3  HIS  43           2HB      HIS  43   6.115  11.722  -3.476
  338    HD1  HIS  43           1HD      HIS  43   7.540  13.630  -4.107
  339    HD2  HIS  43           2HD      HIS  43   5.179  12.362  -7.282
  340    HE1  HIS  43           1HE      HIS  43   8.184  15.091  -6.049
  341    HA   PRO  44           HA       PRO  44   9.213   7.991  -4.728
  342    HB2  PRO  44           1HB      PRO  44  11.072   9.306  -6.207
  343    HB3  PRO  44           2HB      PRO  44   9.911   8.173  -6.909
  344    HG2  PRO  44           1HG      PRO  44   9.825  11.164  -6.825
  345    HG3  PRO  44           2HG      PRO  44   9.437  10.071  -8.166
  346    HD2  PRO  44           1HD      PRO  44   7.531  11.215  -6.620
  347    HD3  PRO  44           2HD      PRO  44   7.335   9.605  -7.343
  348    H    LEU  45           H        LEU  45   8.592  11.185  -3.912
  349    HA   LEU  45           HA       LEU  45  11.143  11.749  -2.676
  350    HB2  LEU  45           1HB      LEU  45   8.502  13.195  -2.581
  351    HB3  LEU  45           2HB      LEU  45   9.986  13.777  -1.831
  352    HG   LEU  45           HG       LEU  45   9.155  14.613  -4.217
  353   HD11  LEU  45          1HD1      LEU  45  11.362  14.957  -2.719
  354   HD12  LEU  45          2HD1      LEU  45  11.145  15.663  -4.320
  355   HD13  LEU  45          3HD1      LEU  45  12.067  14.171  -4.132
  356   HD21  LEU  45          1HD2      LEU  45  10.904  12.237  -4.848
  357   HD22  LEU  45          2HD2      LEU  45  10.358  13.457  -5.999
  358   HD23  LEU  45          3HD2      LEU  45   9.187  12.388  -5.225
  359    H    ASP  46           H        ASP  46   7.966  10.625  -1.712
  360    HA   ASP  46           HA       ASP  46   8.675  10.692   1.110
  361    HB2  ASP  46           1HB      ASP  46   6.172  10.130  -0.432
  362    HB3  ASP  46           2HB      ASP  46   6.313   9.538   1.221
  363    H    HIS  47           H        HIS  47   8.750   8.520  -1.529
  364    HA   HIS  47           HA       HIS  47   9.336   6.298   0.315
  365    HB2  HIS  47           1HB      HIS  47   8.138   4.788  -0.948
  366    HB3  HIS  47           2HB      HIS  47   7.158   6.234  -1.173
  367    HD1  HIS  47           1HD      HIS  47   6.825   7.026  -3.525
  368    HD2  HIS  47           2HD      HIS  47   9.850   4.195  -3.214
  369    HE1  HIS  47           1HE      HIS  47   7.465   6.464  -5.891
  370    H    ASP  48           H        ASP  48  11.412   5.788   0.228
  371    HA   ASP  48           HA       ASP  48  13.326   6.722  -1.468
  372    HB2  ASP  48           1HB      ASP  48  13.878   5.493   0.559
  373    HB3  ASP  48           2HB      ASP  48  13.247   4.005  -0.141
  374    H    CYS  49           H        CYS  49  12.965   6.779  -3.627
  375    HA   CYS  49           HA       CYS  49  12.109   4.378  -5.029
  376    HB2  CYS  49           1HB      CYS  49  11.227   6.701  -5.551
  377    HB3  CYS  49           2HB      CYS  49  12.809   7.053  -6.240
  378    H    SER  50           H        SER  50  13.547   2.933  -5.676
  379    HA   SER  50           HA       SER  50  16.351   3.571  -5.843
  380    HB2  SER  50           1HB      SER  50  15.363   1.370  -5.002
  381    HB3  SER  50           2HB      SER  50  15.058   0.979  -6.694
  382    HG   SER  50           HG       SER  50  17.054   0.363  -6.764
  383    H    GLY  51           H        GLY  51  13.755   2.766  -8.104
  384    HA2  GLY  51           1HA      GLY  51  13.656   3.695 -10.295
  385    HA3  GLY  51           2HA      GLY  51  15.404   3.872 -10.267
  386    H    GLU  52           H        GLU  52  13.326   2.465 -12.062
  387    HA   GLU  52           HA       GLU  52  14.340  -0.269 -11.974
  388    HB2  GLU  52           1HB      GLU  52  11.868   0.456 -12.379
  389    HB3  GLU  52           2HB      GLU  52  12.407   0.756 -14.026
  390    HG2  GLU  52           1HG      GLU  52  13.221  -1.600 -14.107
  391    HG3  GLU  52           2HG      GLU  52  12.460  -1.856 -12.539
  392    H    GLY  53           H        GLY  53  13.854   2.171 -14.540
  393    HA2  GLY  53           1HA      GLY  53  16.436   2.303 -15.488
  394    HA3  GLY  53           2HA      GLY  53  15.726   0.910 -16.290
  395    H    HIS  54           H        HIS  54  16.219   2.251 -18.219
  396    HA   HIS  54           HA       HIS  54  14.306   4.423 -18.663
  397    HB2  HIS  54           1HB      HIS  54  15.641   4.975 -20.626
  398    HB3  HIS  54           2HB      HIS  54  16.676   4.848 -19.207
  399    HD1  HIS  54           1HD      HIS  54  18.478   3.056 -19.222
  400    HD2  HIS  54           2HD      HIS  54  15.955   2.874 -22.518
  401    HE1  HIS  54           1HE      HIS  54  19.562   1.435 -20.809
  402    HA   PRO  55           HA       PRO  55  11.644   2.030 -21.204
  403    HB2  PRO  55           1HB      PRO  55  10.791   3.909 -22.967
  404    HB3  PRO  55           2HB      PRO  55  10.268   3.868 -21.279
  405    HG2  PRO  55           1HG      PRO  55  12.377   5.557 -22.569
  406    HG3  PRO  55           2HG      PRO  55  11.146   6.020 -21.380
  407    HD2  PRO  55           1HD      PRO  55  13.719   5.528 -20.696
  408    HD3  PRO  55           2HD      PRO  55  12.358   5.179 -19.609
  409    H    THR  56           H        THR  56  11.941   0.658 -22.848
  410    HA   THR  56           HA       THR  56  13.935   1.358 -24.897
  411    HB   THR  56           HB       THR  56  14.423  -0.640 -23.459
  412    HG1  THR  56           1HG      THR  56  14.885  -0.298 -25.923
  413   HG21  THR  56          1HG2      THR  56  12.915  -2.252 -23.146
  414   HG22  THR  56          2HG2      THR  56  12.730  -2.476 -24.886
  415   HG23  THR  56          3HG2      THR  56  11.751  -1.277 -24.041
  416    H    SER  57           H        SER  57  13.496   1.041 -27.064
  417    HA   SER  57           HA       SER  57  10.654   0.636 -27.711
  418    HB2  SER  57           1HB      SER  57  11.168   1.887 -29.809
  419    HB3  SER  57           2HB      SER  57  11.439   2.838 -28.349
  420    HG   SER  57           HG       SER  57  13.565   2.756 -28.663
  421    H    SER  58           H        SER  58  12.205  -1.621 -27.288
  422    HA   SER  58           HA       SER  58  12.741  -2.630 -30.000
  423    HB2  SER  58           1HB      SER  58  14.646  -2.805 -28.468
  424    HB3  SER  58           2HB      SER  58  13.657  -3.709 -27.322
  425    HG   SER  58           HG       SER  58  14.048  -4.585 -29.980
  426    H    GLY  59           H        GLY  59  10.540  -3.028 -30.486
  427    HA2  GLY  59           1HA      GLY  59   8.909  -4.655 -30.824
  428    HA3  GLY  59           2HA      GLY  59   9.628  -5.607 -29.534
  429    HA   PRO  60           HA       PRO  60   6.529  -2.333 -27.674
  430    HB2  PRO  60           1HB      PRO  60   4.501  -1.707 -29.367
  431    HB3  PRO  60           2HB      PRO  60   5.990  -0.761 -29.261
  432    HG2  PRO  60           1HG      PRO  60   5.212  -2.852 -31.257
  433    HG3  PRO  60           2HG      PRO  60   6.005  -1.289 -31.526
  434    HD2  PRO  60           1HD      PRO  60   7.372  -3.626 -31.471
  435    HD3  PRO  60           2HD      PRO  60   8.078  -2.094 -30.917
  436    H    SER  61           H        SER  61   4.830  -3.046 -26.463
  437    HA   SER  61           HA       SER  61   3.005  -5.047 -27.490
  438    HB2  SER  61           1HB      SER  61   5.004  -5.654 -25.312
  439    HB3  SER  61           2HB      SER  61   3.513  -6.574 -25.510
  440    HG   SER  61           HG       SER  61   5.159  -6.193 -27.741
  441    H    SER  62           H        SER  62   1.445  -5.729 -25.675
  442    HA   SER  62           HA       SER  62   0.988  -3.483 -23.830
  443    HB2  SER  62           1HB      SER  62  -1.024  -4.801 -25.659
  444    HB3  SER  62           2HB      SER  62  -1.485  -3.790 -24.290
  445    HG   SER  62           HG       SER  62   0.396  -2.636 -25.906
  446    H    GLY  63           H        GLY  63  -0.186  -6.755 -24.648
  447    HA2  GLY  63           1HA      GLY  63   0.416  -8.399 -22.783
  448    HA3  GLY  63           2HA      GLY  63  -0.459  -7.272 -21.757
  Start of MODEL   11
    1    H1   GLY   1           H        GLY   1 -11.463 -28.991 -14.038
    2    HA2  GLY   1           1HA      GLY   1 -12.646 -29.981 -11.818
    3    HA3  GLY   1           2HA      GLY   1 -11.063 -29.505 -11.221
    4    H    SER   2           H        SER   2 -12.874 -28.233  -9.947
    5    HA   SER   2           HA       SER   2 -12.703 -25.512 -10.922
    6    HB2  SER   2           1HB      SER   2 -14.800 -26.326 -11.947
    7    HB3  SER   2           2HB      SER   2 -15.403 -26.757 -10.347
    8    HG   SER   2           HG       SER   2 -15.934 -24.752 -10.052
    9    H    SER   3           H        SER   3 -11.787 -24.589  -9.210
   10    HA   SER   3           HA       SER   3 -13.157 -24.719  -6.644
   11    HB2  SER   3           1HB      SER   3 -11.209 -25.334  -5.379
   12    HB3  SER   3           2HB      SER   3 -11.416 -26.539  -6.649
   13    HG   SER   3           HG       SER   3  -9.704 -24.293  -6.886
   14    H    GLY   4           H        GLY   4 -12.918 -22.888  -5.409
   15    HA2  GLY   4           1HA      GLY   4 -10.997 -20.997  -5.313
   16    HA3  GLY   4           2HA      GLY   4 -11.851 -20.580  -6.791
   17    H    SER   5           H        SER   5 -12.431 -18.570  -5.834
   18    HA   SER   5           HA       SER   5 -14.913 -18.728  -4.359
   19    HB2  SER   5           1HB      SER   5 -14.268 -17.489  -2.455
   20    HB3  SER   5           2HB      SER   5 -12.986 -18.684  -2.658
   21    HG   SER   5           HG       SER   5 -12.920 -15.930  -2.968
   22    H    SER   6           H        SER   6 -16.053 -16.691  -4.292
   23    HA   SER   6           HA       SER   6 -15.147 -14.841  -6.400
   24    HB2  SER   6           1HB      SER   6 -17.213 -16.149  -6.929
   25    HB3  SER   6           2HB      SER   6 -18.000 -15.386  -5.548
   26    HG   SER   6           HG       SER   6 -17.832 -14.456  -7.993
   27    H    GLY   7           H        GLY   7 -16.081 -12.596  -6.169
   28    HA2  GLY   7           1HA      GLY   7 -16.893 -10.856  -4.731
   29    HA3  GLY   7           2HA      GLY   7 -16.387 -11.815  -3.348
   30    H    ARG   8           H        ARG   8 -14.571 -10.973  -6.276
   31    HA   ARG   8           HA       ARG   8 -12.758  -9.359  -4.617
   32    HB2  ARG   8           1HB      ARG   8 -11.762 -11.586  -4.913
   33    HB3  ARG   8           2HB      ARG   8 -11.909 -11.423  -6.657
   34    HG2  ARG   8           1HG      ARG   8  -9.682 -10.920  -6.226
   35    HG3  ARG   8           2HG      ARG   8 -10.447  -9.339  -6.398
   36    HD2  ARG   8           1HD      ARG   8  -8.959  -9.318  -4.497
   37    HD3  ARG   8           2HD      ARG   8 -10.628  -9.192  -3.944
   38    HE   ARG   8           HE       ARG   8 -10.411 -11.228  -2.905
   39   HH11  ARG   8          2HH1      ARG   8  -7.724 -10.728  -5.061
   40   HH12  ARG   8          1HH1      ARG   8  -6.836 -12.099  -4.483
   41   HH21  ARG   8          2HH2      ARG   8  -9.252 -13.035  -2.135
   42   HH22  ARG   8          1HH2      ARG   8  -7.707 -13.411  -2.819
   43    H    LYS   9           H        LYS   9 -12.463  -7.401  -5.436
   44    HA   LYS   9           HA       LYS   9 -12.999  -6.983  -8.301
   45    HB2  LYS   9           1HB      LYS   9 -13.396  -5.227  -5.895
   46    HB3  LYS   9           2HB      LYS   9 -13.268  -4.530  -7.505
   47    HG2  LYS   9           1HG      LYS   9 -15.560  -4.755  -7.128
   48    HG3  LYS   9           2HG      LYS   9 -15.143  -6.120  -8.165
   49    HD2  LYS   9           1HD      LYS   9 -14.873  -7.443  -5.984
   50    HD3  LYS   9           2HD      LYS   9 -15.738  -6.107  -5.221
   51    HE2  LYS   9           1HE      LYS   9 -17.290  -7.869  -5.810
   52    HE3  LYS   9           2HE      LYS   9 -17.598  -6.442  -6.799
   53    HZ1  LYS   9           1HZ      LYS   9 -17.482  -8.797  -7.871
   54    HZ2  LYS   9           2HZ      LYS   9 -15.813  -8.526  -7.838
   55    HZ3  LYS   9           3HZ      LYS   9 -16.826  -7.462  -8.677
   56    H    ILE  10           H        ILE  10 -11.403  -6.281  -9.572
   57    HA   ILE  10           HA       ILE  10  -8.790  -5.817  -8.409
   58    HB   ILE  10           HB       ILE  10  -7.966  -5.784 -10.706
   59   HG12  ILE  10          1HG1      ILE  10 -10.730  -6.389 -11.708
   60   HG13  ILE  10          2HG1      ILE  10 -10.209  -4.718 -11.520
   61   HG21  ILE  10          1HG2      ILE  10  -8.943  -8.102 -11.382
   62   HG22  ILE  10          2HG2      ILE  10  -7.987  -7.947  -9.909
   63   HG23  ILE  10          3HG2      ILE  10  -9.747  -8.009  -9.815
   64   HD11  ILE  10          1HD1      ILE  10  -9.552  -4.985 -13.648
   65   HD12  ILE  10          2HD1      ILE  10  -8.127  -5.706 -12.899
   66   HD13  ILE  10          3HD1      ILE  10  -9.423  -6.738 -13.503
   67    H    PHE  11           H        PHE  11 -10.679  -3.821  -7.772
   68    HA   PHE  11           HA       PHE  11 -10.041  -1.541  -9.472
   69    HB2  PHE  11           1HB      PHE  11 -12.027  -2.093  -7.320
   70    HB3  PHE  11           2HB      PHE  11 -11.527  -0.423  -7.564
   71    HD1  PHE  11           2HD      PHE  11 -13.093  -3.343  -9.183
   72    HD2  PHE  11           1HD      PHE  11 -12.298   0.832  -9.409
   73    HE1  PHE  11           2HE      PHE  11 -14.685  -3.144 -11.048
   74    HE2  PHE  11           1HE      PHE  11 -13.890   1.038 -11.274
   75    HZ   PHE  11           HZ       PHE  11 -15.084  -0.952 -12.097
   76    H    THR  12           H        THR  12  -9.609  -2.602  -6.119
   77    HA   THR  12           HA       THR  12  -7.997  -0.292  -5.466
   78    HB   THR  12           HB       THR  12  -7.738  -1.325  -3.259
   79    HG1  THR  12           1HG      THR  12  -7.864  -3.554  -4.297
   80   HG21  THR  12          1HG2      THR  12  -9.971  -0.205  -4.211
   81   HG22  THR  12          2HG2      THR  12  -9.845  -0.815  -2.561
   82   HG23  THR  12          3HG2      THR  12 -10.613  -1.797  -3.808
   83    H    ASN  13           H        ASN  13  -5.854  -0.141  -5.630
   84    HA   ASN  13           HA       ASN  13  -4.354  -2.445  -6.578
   85    HB2  ASN  13           1HB      ASN  13  -2.505  -0.760  -6.852
   86    HB3  ASN  13           2HB      ASN  13  -3.960  -0.409  -7.780
   87   HD21  ASN  13          1HD2      ASN  13  -5.438   1.177  -6.905
   88   HD22  ASN  13          2HD2      ASN  13  -4.817   2.473  -5.946
   89    H    LYS  14           H        LYS  14  -2.088  -2.720  -5.684
   90    HA   LYS  14           HA       LYS  14  -2.203  -2.581  -2.744
   91    HB2  LYS  14           1HB      LYS  14  -2.213  -4.867  -3.699
   92    HB3  LYS  14           2HB      LYS  14  -0.671  -4.530  -4.476
   93    HG2  LYS  14           1HG      LYS  14  -0.870  -4.156  -1.536
   94    HG3  LYS  14           2HG      LYS  14  -0.817  -5.801  -2.174
   95    HD2  LYS  14           1HD      LYS  14   1.173  -3.758  -3.085
   96    HD3  LYS  14           2HD      LYS  14   1.400  -4.603  -1.552
   97    HE2  LYS  14           1HE      LYS  14   0.894  -6.056  -4.134
   98    HE3  LYS  14           2HE      LYS  14   2.516  -5.608  -3.609
   99    HZ1  LYS  14           1HZ      LYS  14   2.563  -7.288  -2.179
  100    HZ2  LYS  14           2HZ      LYS  14   1.162  -7.879  -2.919
  101    HZ3  LYS  14           3HZ      LYS  14   1.043  -6.908  -1.539
  102    H    CYS  15           H        CYS  15  -0.801  -1.277  -1.781
  103    HA   CYS  15           HA       CYS  15   1.189   0.138  -3.237
  104    HB2  CYS  15           1HB      CYS  15   0.096   1.200  -1.362
  105    HB3  CYS  15           2HB      CYS  15   0.647  -0.066  -0.270
  106    H    GLU  16           H        GLU  16   3.324  -0.213  -3.457
  107    HA   GLU  16           HA       GLU  16   4.377  -2.734  -2.428
  108    HB2  GLU  16           1HB      GLU  16   5.481  -0.797  -4.469
  109    HB3  GLU  16           2HB      GLU  16   6.258  -2.302  -3.998
  110    HG2  GLU  16           1HG      GLU  16   3.917  -3.311  -4.678
  111    HG3  GLU  16           2HG      GLU  16   3.843  -1.848  -5.658
  112    H    ARG  17           H        ARG  17   3.996  -0.424  -0.673
  113    HA   ARG  17           HA       ARG  17   6.723   0.437  -0.086
  114    HB2  ARG  17           1HB      ARG  17   4.865   2.091  -0.080
  115    HB3  ARG  17           2HB      ARG  17   4.133   1.221   1.261
  116    HG2  ARG  17           1HG      ARG  17   5.224   2.850   2.408
  117    HG3  ARG  17           2HG      ARG  17   6.493   1.624   2.362
  118    HD2  ARG  17           1HD      ARG  17   7.591   2.716   0.554
  119    HD3  ARG  17           2HD      ARG  17   6.229   3.808   0.307
  120    HE   ARG  17           HE       ARG  17   6.972   5.103   2.065
  121   HH11  ARG  17          2HH1      ARG  17   8.769   2.124   1.927
  122   HH12  ARG  17          1HH1      ARG  17   9.968   2.643   3.065
  123   HH21  ARG  17          2HH2      ARG  17   8.545   5.797   3.564
  124   HH22  ARG  17          1HH2      ARG  17   9.839   4.732   3.996
  125    H    ALA  18           H        ALA  18   7.739   0.077   1.902
  126    HA   ALA  18           HA       ALA  18   7.321  -2.466   3.050
  127    HB1  ALA  18           1HB      ALA  18   8.984  -1.630   4.777
  128    HB2  ALA  18           2HB      ALA  18   9.520  -1.632   3.097
  129    HB3  ALA  18           3HB      ALA  18   9.018  -0.123   3.861
  130    H    GLY  19           H        GLY  19   6.202  -3.131   4.797
  131    HA2  GLY  19           1HA      GLY  19   4.608  -3.075   6.452
  132    HA3  GLY  19           2HA      GLY  19   5.520  -1.698   7.054
  133    H    CYS  20           H        CYS  20   3.656  -2.019   4.053
  134    HA   CYS  20           HA       CYS  20   1.761  -0.021   5.078
  135    HB2  CYS  20           1HB      CYS  20   3.594   0.955   3.566
  136    HB3  CYS  20           2HB      CYS  20   2.810   0.079   2.255
  137    H    ARG  21           H        ARG  21  -0.274  -0.653   4.842
  138    HA   ARG  21           HA       ARG  21  -0.894  -2.627   2.743
  139    HB2  ARG  21           1HB      ARG  21  -2.007  -2.385   5.539
  140    HB3  ARG  21           2HB      ARG  21  -2.728  -3.399   4.295
  141    HG2  ARG  21           1HG      ARG  21  -1.424  -4.882   5.498
  142    HG3  ARG  21           2HG      ARG  21  -0.394  -4.472   4.124
  143    HD2  ARG  21           1HD      ARG  21   0.920  -2.999   5.434
  144    HD3  ARG  21           2HD      ARG  21  -0.236  -3.040   6.764
  145    HE   ARG  21           HE       ARG  21   0.858  -5.616   6.158
  146   HH11  ARG  21          2HH1      ARG  21   1.404  -2.636   7.872
  147   HH12  ARG  21          1HH1      ARG  21   2.463  -3.351   9.042
  148   HH21  ARG  21          2HH2      ARG  21   2.250  -6.569   7.693
  149   HH22  ARG  21          1HH2      ARG  21   2.944  -5.588   8.939
  150    H    GLN  22           H        GLN  22  -0.999   0.159   2.324
  151    HA   GLN  22           HA       GLN  22  -3.735   1.027   2.607
  152    HB2  GLN  22           1HB      GLN  22  -1.260   2.210   1.391
  153    HB3  GLN  22           2HB      GLN  22  -2.834   2.929   1.082
  154    HG2  GLN  22           1HG      GLN  22  -1.429   3.874   2.993
  155    HG3  GLN  22           2HG      GLN  22  -3.133   3.542   3.300
  156   HE21  GLN  22          1HE2      GLN  22  -0.101   3.230   4.514
  157   HE22  GLN  22          2HE2      GLN  22  -0.358   1.919   5.609
  158    H    ARG  23           H        ARG  23  -5.316   0.452   1.285
  159    HA   ARG  23           HA       ARG  23  -4.642  -0.523  -1.399
  160    HB2  ARG  23           1HB      ARG  23  -7.136  -0.864   0.273
  161    HB3  ARG  23           2HB      ARG  23  -6.957  -1.463  -1.370
  162    HG2  ARG  23           1HG      ARG  23  -4.937  -2.749  -0.512
  163    HG3  ARG  23           2HG      ARG  23  -5.522  -2.356   1.106
  164    HD2  ARG  23           1HD      ARG  23  -7.328  -3.613  -0.928
  165    HD3  ARG  23           2HD      ARG  23  -6.228  -4.596   0.038
  166    HE   ARG  23           HE       ARG  23  -7.475  -3.199   1.933
  167   HH11  ARG  23          2HH1      ARG  23  -8.721  -4.891  -0.843
  168   HH12  ARG  23          1HH1      ARG  23 -10.237  -5.271  -0.094
  169   HH21  ARG  23          2HH2      ARG  23  -9.466  -3.693   2.930
  170   HH22  ARG  23          1HH2      ARG  23 -10.660  -4.588   2.052
  171    H    GLU  24           H        GLU  24  -4.373   1.555  -2.335
  172    HA   GLU  24           HA       GLU  24  -6.249   3.629  -2.236
  173    HB2  GLU  24           1HB      GLU  24  -3.996   2.890  -4.023
  174    HB3  GLU  24           2HB      GLU  24  -5.162   4.044  -4.654
  175    HG2  GLU  24           1HG      GLU  24  -3.733   4.361  -2.027
  176    HG3  GLU  24           2HG      GLU  24  -3.186   5.066  -3.547
  177    H    MET  25           H        MET  25  -8.006   4.168  -3.464
  178    HA   MET  25           HA       MET  25  -9.549   2.096  -4.569
  179    HB2  MET  25           1HB      MET  25  -9.787   5.095  -4.834
  180    HB3  MET  25           2HB      MET  25 -10.997   3.965  -5.426
  181    HG2  MET  25           1HG      MET  25 -11.871   4.533  -3.392
  182    HG3  MET  25           2HG      MET  25 -10.965   3.079  -2.980
  183    HE1  MET  25           1HE      MET  25  -9.881   2.911  -1.012
  184    HE2  MET  25           2HE      MET  25  -9.269   4.191   0.035
  185    HE3  MET  25           3HE      MET  25 -11.006   4.010  -0.214
  186    H    MET  26           H        MET  26  -7.477   4.538  -6.058
  187    HA   MET  26           HA       MET  26  -7.907   3.236  -8.664
  188    HB2  MET  26           1HB      MET  26  -7.364   5.283  -9.733
  189    HB3  MET  26           2HB      MET  26  -8.477   5.691  -8.435
  190    HG2  MET  26           1HG      MET  26  -6.415   6.216  -7.045
  191    HG3  MET  26           2HG      MET  26  -5.517   6.138  -8.559
  192    HE1  MET  26           1HE      MET  26  -5.908   8.241  -6.340
  193    HE2  MET  26           2HE      MET  26  -5.118   9.258  -7.546
  194    HE3  MET  26           3HE      MET  26  -6.660   9.755  -6.846
  195    H    LYS  27           H        LYS  27  -6.202   2.437  -9.794
  196    HA   LYS  27           HA       LYS  27  -3.860   1.718  -8.421
  197    HB2  LYS  27           1HB      LYS  27  -4.899   0.582 -10.448
  198    HB3  LYS  27           2HB      LYS  27  -4.139   1.833 -11.423
  199    HG2  LYS  27           1HG      LYS  27  -2.417   0.335  -9.533
  200    HG3  LYS  27           2HG      LYS  27  -2.990  -0.509 -10.973
  201    HD2  LYS  27           1HD      LYS  27  -1.655   2.188 -11.076
  202    HD3  LYS  27           2HD      LYS  27  -0.762   0.670 -11.186
  203    HE2  LYS  27           1HE      LYS  27  -2.349   0.075 -13.094
  204    HE3  LYS  27           2HE      LYS  27  -2.819   1.774 -13.079
  205    HZ1  LYS  27           1HZ      LYS  27  -0.001   0.901 -13.342
  206    HZ2  LYS  27           2HZ      LYS  27  -0.647   2.434 -13.646
  207    HZ3  LYS  27           3HZ      LYS  27  -1.007   1.144 -14.680
  208    H    LEU  28           H        LEU  28  -1.884   2.620  -8.251
  209    HA   LEU  28           HA       LEU  28  -1.289   5.004  -9.861
  210    HB2  LEU  28           1HB      LEU  28  -0.927   4.740  -6.880
  211    HB3  LEU  28           2HB      LEU  28  -0.306   6.069  -7.856
  212    HG   LEU  28           HG       LEU  28  -3.230   5.524  -7.927
  213   HD11  LEU  28          1HD1      LEU  28  -3.089   5.456  -5.623
  214   HD12  LEU  28          2HD1      LEU  28  -3.330   7.175  -5.931
  215   HD13  LEU  28          3HD1      LEU  28  -1.717   6.562  -5.568
  216   HD21  LEU  28          1HD2      LEU  28  -1.652   8.090  -7.836
  217   HD22  LEU  28          2HD2      LEU  28  -3.357   7.895  -8.246
  218   HD23  LEU  28          3HD2      LEU  28  -2.112   7.258  -9.322
  219    H    THR  29           H        THR  29   0.510   4.636 -10.957
  220    HA   THR  29           HA       THR  29   2.596   2.954  -9.727
  221    HB   THR  29           HB       THR  29   2.314   3.427 -12.689
  222    HG1  THR  29           1HG      THR  29   0.407   2.415 -12.041
  223   HG21  THR  29          1HG2      THR  29   3.623   1.365 -12.841
  224   HG22  THR  29          2HG2      THR  29   3.649   1.245 -11.082
  225   HG23  THR  29          3HG2      THR  29   4.471   2.581 -11.887
  226    H    CYS  30           H        CYS  30   4.724   3.620  -9.797
  227    HA   CYS  30           HA       CYS  30   5.166   6.433  -9.886
  228    HB2  CYS  30           1HB      CYS  30   6.364   4.727  -8.414
  229    HB3  CYS  30           2HB      CYS  30   7.310   4.312  -9.840
  230    H    GLU  31           H        GLU  31   6.997   7.396 -11.156
  231    HA   GLU  31           HA       GLU  31   6.816   6.472 -13.940
  232    HB2  GLU  31           1HB      GLU  31   7.231   8.708 -14.631
  233    HB3  GLU  31           2HB      GLU  31   6.034   8.797 -13.347
  234    HG2  GLU  31           1HG      GLU  31   7.831   9.365 -11.756
  235    HG3  GLU  31           2HG      GLU  31   8.978   9.365 -13.095
  236    H    ARG  32           H        ARG  32   8.936   6.732 -11.304
  237    HA   ARG  32           HA       ARG  32  11.331   6.741 -12.977
  238    HB2  ARG  32           1HB      ARG  32  10.875   6.951 -10.008
  239    HB3  ARG  32           2HB      ARG  32  12.476   6.673 -10.680
  240    HG2  ARG  32           1HG      ARG  32  12.041   8.765 -12.089
  241    HG3  ARG  32           2HG      ARG  32  10.715   9.077 -10.967
  242    HD2  ARG  32           1HD      ARG  32  12.416  10.234  -9.951
  243    HD3  ARG  32           2HD      ARG  32  12.563   8.667  -9.156
  244    HE   ARG  32           HE       ARG  32  14.231   8.429 -11.262
  245   HH11  ARG  32          2HH1      ARG  32  13.877  10.839  -8.775
  246   HH12  ARG  32          1HH1      ARG  32  15.554  11.276  -8.778
  247   HH21  ARG  32          2HH2      ARG  32  16.440   8.995 -11.276
  248   HH22  ARG  32          1HH2      ARG  32  17.011  10.227 -10.201
  249    H    CYS  33           H        CYS  33  10.038   4.780 -10.288
  250    HA   CYS  33           HA       CYS  33  11.696   2.537 -11.117
  251    HB2  CYS  33           1HB      CYS  33  10.788   1.448  -9.064
  252    HB3  CYS  33           2HB      CYS  33  11.607   2.973  -8.746
  253    H    SER  34           H        SER  34   8.445   3.640 -11.385
  254    HA   SER  34           HA       SER  34   6.646   2.819 -12.517
  255    HB2  SER  34           1HB      SER  34   8.548   2.057 -14.108
  256    HB3  SER  34           2HB      SER  34   8.276   0.456 -13.420
  257    HG   SER  34           HG       SER  34   6.351   0.357 -14.358
  258    H    ARG  35           H        ARG  35   6.777   2.273  -9.858
  259    HA   ARG  35           HA       ARG  35   5.718  -0.472  -9.686
  260    HB2  ARG  35           1HB      ARG  35   7.377   1.100  -7.730
  261    HB3  ARG  35           2HB      ARG  35   6.383  -0.252  -7.206
  262    HG2  ARG  35           1HG      ARG  35   7.596  -1.734  -8.723
  263    HG3  ARG  35           2HG      ARG  35   8.595  -0.376  -9.244
  264    HD2  ARG  35           1HD      ARG  35   9.514  -0.133  -7.040
  265    HD3  ARG  35           2HD      ARG  35   8.399  -1.337  -6.395
  266    HE   ARG  35           HE       ARG  35  10.133  -2.293  -8.496
  267   HH11  ARG  35          2HH1      ARG  35   9.697  -1.853  -5.070
  268   HH12  ARG  35          1HH1      ARG  35  10.827  -3.093  -4.635
  269   HH21  ARG  35          2HH2      ARG  35  11.622  -3.927  -7.936
  270   HH22  ARG  35          1HH2      ARG  35  11.922  -4.271  -6.266
  271    H    ASN  36           H        ASN  36   4.074  -0.789  -7.995
  272    HA   ASN  36           HA       ASN  36   2.146   1.361  -8.075
  273    HB2  ASN  36           1HB      ASN  36   1.792  -1.265  -8.243
  274    HB3  ASN  36           2HB      ASN  36   1.673  -1.125  -6.491
  275   HD21  ASN  36          1HD2      ASN  36   0.129   0.510  -5.683
  276   HD22  ASN  36          2HD2      ASN  36  -1.352   0.720  -6.549
  277    H    PHE  37           H        PHE  37   1.329   2.497  -6.341
  278    HA   PHE  37           HA       PHE  37   2.181   1.966  -3.649
  279    HB2  PHE  37           1HB      PHE  37   3.142   4.508  -4.979
  280    HB3  PHE  37           2HB      PHE  37   3.379   4.060  -3.293
  281    HD1  PHE  37           2HD      PHE  37   4.627   1.793  -2.905
  282    HD2  PHE  37           1HD      PHE  37   4.806   4.063  -6.502
  283    HE1  PHE  37           2HE      PHE  37   6.740   0.681  -3.497
  284    HE2  PHE  37           1HE      PHE  37   6.919   2.953  -7.100
  285    HZ   PHE  37           HZ       PHE  37   7.890   1.261  -5.597
  286    H    CYS  38           H        CYS  38   1.320   3.643  -2.122
  287    HA   CYS  38           HA       CYS  38  -1.350   4.408  -2.999
  288    HB2  CYS  38           1HB      CYS  38  -1.843   4.724  -0.645
  289    HB3  CYS  38           2HB      CYS  38  -1.045   3.171  -0.871
  290    H    ILE  39           H        ILE  39  -2.197   6.499  -2.788
  291    HA   ILE  39           HA       ILE  39  -0.856   8.616  -3.731
  292    HB   ILE  39           HB       ILE  39  -3.013   8.636  -1.628
  293   HG12  ILE  39          1HG1      ILE  39  -3.107   9.337  -4.567
  294   HG13  ILE  39          2HG1      ILE  39  -3.509   7.749  -3.924
  295   HG21  ILE  39          1HG2      ILE  39  -1.980  11.000  -3.187
  296   HG22  ILE  39          2HG2      ILE  39  -3.320  10.999  -2.042
  297   HG23  ILE  39          3HG2      ILE  39  -1.677  10.702  -1.476
  298   HD11  ILE  39          1HD1      ILE  39  -4.927  10.015  -2.700
  299   HD12  ILE  39          2HD1      ILE  39  -5.312   9.678  -4.388
  300   HD13  ILE  39          3HD1      ILE  39  -5.514   8.419  -3.170
  301    H    LYS  40           H        LYS  40  -0.866   7.598  -0.351
  302    HA   LYS  40           HA       LYS  40   0.554   9.793   0.696
  303    HB2  LYS  40           1HB      LYS  40  -0.069   7.030   1.598
  304    HB3  LYS  40           2HB      LYS  40   1.251   7.860   2.412
  305    HG2  LYS  40           1HG      LYS  40  -0.545   8.405   3.737
  306    HG3  LYS  40           2HG      LYS  40  -0.462   9.797   2.654
  307    HD2  LYS  40           1HD      LYS  40  -2.747   9.158   2.779
  308    HD3  LYS  40           2HD      LYS  40  -2.157   8.628   1.202
  309    HE2  LYS  40           1HE      LYS  40  -2.239   6.408   1.767
  310    HE3  LYS  40           2HE      LYS  40  -2.006   6.725   3.485
  311    HZ1  LYS  40           1HZ      LYS  40  -4.454   7.824   2.495
  312    HZ2  LYS  40           2HZ      LYS  40  -4.189   6.803   3.817
  313    HZ3  LYS  40           3HZ      LYS  40  -4.375   6.149   2.268
  314    H    HIS  41           H        HIS  41   1.634   6.675  -0.588
  315    HA   HIS  41           HA       HIS  41   4.410   7.643  -0.448
  316    HB2  HIS  41           1HB      HIS  41   3.439   4.796  -0.765
  317    HB3  HIS  41           2HB      HIS  41   5.107   5.314  -0.546
  318    HD2  HIS  41           2HD      HIS  41   4.451   7.344   2.042
  319    HE1  HIS  41           1HE      HIS  41   3.165   3.727   3.849
  320    HE2  HIS  41           2HE      HIS  41   3.798   6.134   4.234
  321    H    ARG  42           H        ARG  42   2.243   8.120  -2.521
  322    HA   ARG  42           HA       ARG  42   3.021   6.719  -4.874
  323    HB2  ARG  42           1HB      ARG  42   0.877   7.544  -5.061
  324    HB3  ARG  42           2HB      ARG  42   1.275   9.058  -4.260
  325    HG2  ARG  42           1HG      ARG  42   0.886   9.669  -6.468
  326    HG3  ARG  42           2HG      ARG  42   2.645   9.589  -6.355
  327    HD2  ARG  42           1HD      ARG  42   2.258   7.108  -7.126
  328    HD3  ARG  42           2HD      ARG  42   0.740   7.762  -7.740
  329    HE   ARG  42           HE       ARG  42   3.155   9.184  -8.499
  330   HH11  ARG  42          2HH1      ARG  42   0.730   6.835  -9.346
  331   HH12  ARG  42          1HH1      ARG  42   1.043   6.932 -11.047
  332   HH21  ARG  42          2HH2      ARG  42   3.577   9.321 -10.736
  333   HH22  ARG  42          1HH2      ARG  42   2.663   8.346 -11.837
  334    H    HIS  43           H        HIS  43   4.029   9.696  -3.341
  335    HA   HIS  43           HA       HIS  43   5.414  10.821  -5.527
  336    HB2  HIS  43           1HB      HIS  43   4.756  11.777  -3.133
  337    HB3  HIS  43           2HB      HIS  43   6.401  11.276  -2.750
  338    HD1  HIS  43           1HD      HIS  43   8.334  12.525  -3.979
  339    HD2  HIS  43           2HD      HIS  43   4.537  14.027  -4.748
  340    HE1  HIS  43           1HE      HIS  43   8.704  14.767  -5.055
  341    HA   PRO  44           HA       PRO  44   8.953   8.212  -5.812
  342    HB2  PRO  44           1HB      PRO  44  10.615   9.922  -7.110
  343    HB3  PRO  44           2HB      PRO  44   9.257   9.115  -7.903
  344    HG2  PRO  44           1HG      PRO  44   9.435  11.899  -6.817
  345    HG3  PRO  44           2HG      PRO  44   8.721  11.336  -8.339
  346    HD2  PRO  44           1HD      PRO  44   7.228  11.914  -6.156
  347    HD3  PRO  44           2HD      PRO  44   6.772  10.651  -7.317
  348    H    LEU  45           H        LEU  45   8.613  10.541  -3.614
  349    HA   LEU  45           HA       LEU  45  11.413  10.364  -2.713
  350    HB2  LEU  45           1HB      LEU  45   9.433  12.611  -2.461
  351    HB3  LEU  45           2HB      LEU  45  10.874  12.506  -1.451
  352    HG   LEU  45           HG       LEU  45  10.876  12.707  -4.462
  353   HD11  LEU  45          1HD1      LEU  45  11.325  14.770  -2.317
  354   HD12  LEU  45          2HD1      LEU  45  10.096  14.777  -3.581
  355   HD13  LEU  45          3HD1      LEU  45  11.795  14.987  -4.003
  356   HD21  LEU  45          1HD2      LEU  45  12.843  11.784  -2.701
  357   HD22  LEU  45          2HD2      LEU  45  13.315  13.431  -3.121
  358   HD23  LEU  45          3HD2      LEU  45  13.045  12.239  -4.393
  359    H    ASP  46           H        ASP  46   8.023  10.267  -1.827
  360    HA   ASP  46           HA       ASP  46   8.381   9.965   0.963
  361    HB2  ASP  46           1HB      ASP  46   6.102   9.078  -0.819
  362    HB3  ASP  46           2HB      ASP  46   6.051   9.105   0.942
  363    H    HIS  47           H        HIS  47   8.160   7.657  -1.699
  364    HA   HIS  47           HA       HIS  47   8.576   5.438   0.166
  365    HB2  HIS  47           1HB      HIS  47   7.928   3.976  -1.611
  366    HB3  HIS  47           2HB      HIS  47   6.785   5.317  -1.603
  367    HD1  HIS  47           1HD      HIS  47   6.671   6.772  -3.677
  368    HD2  HIS  47           2HD      HIS  47   9.747   3.982  -3.807
  369    HE1  HIS  47           1HE      HIS  47   7.534   6.832  -6.038
  370    H    ASP  48           H        ASP  48  10.700   7.314  -0.350
  371    HA   ASP  48           HA       ASP  48  12.851   7.462  -1.192
  372    HB2  ASP  48           1HB      ASP  48  12.972   4.620  -0.188
  373    HB3  ASP  48           2HB      ASP  48  14.257   5.824  -0.186
  374    H    CYS  49           H        CYS  49  11.415   7.088  -3.381
  375    HA   CYS  49           HA       CYS  49  11.424   4.978  -4.992
  376    HB2  CYS  49           1HB      CYS  49  10.873   7.351  -5.641
  377    HB3  CYS  49           2HB      CYS  49  12.592   7.601  -5.932
  378    H    SER  50           H        SER  50  12.785   3.603  -5.990
  379    HA   SER  50           HA       SER  50  15.671   4.162  -5.833
  380    HB2  SER  50           1HB      SER  50  14.730   2.441  -4.136
  381    HB3  SER  50           2HB      SER  50  14.580   1.374  -5.532
  382    HG   SER  50           HG       SER  50  16.844   2.270  -4.213
  383    H    GLY  51           H        GLY  51  13.862   4.585  -8.039
  384    HA2  GLY  51           1HA      GLY  51  14.259   2.416  -9.905
  385    HA3  GLY  51           2HA      GLY  51  13.504   3.965 -10.248
  386    H    GLU  52           H        GLU  52  15.292   5.833  -9.868
  387    HA   GLU  52           HA       GLU  52  16.878   6.854 -11.218
  388    HB2  GLU  52           1HB      GLU  52  18.555   4.725  -9.881
  389    HB3  GLU  52           2HB      GLU  52  19.105   6.293 -10.457
  390    HG2  GLU  52           1HG      GLU  52  17.798   7.421  -8.780
  391    HG3  GLU  52           2HG      GLU  52  17.098   5.891  -8.252
  392    H    GLY  53           H        GLY  53  15.520   5.149 -12.864
  393    HA2  GLY  53           1HA      GLY  53  17.232   4.791 -15.014
  394    HA3  GLY  53           2HA      GLY  53  17.180   3.248 -14.175
  395    H    HIS  54           H        HIS  54  16.277   3.739 -16.837
  396    HA   HIS  54           HA       HIS  54  13.360   3.510 -16.574
  397    HB2  HIS  54           1HB      HIS  54  13.145   4.271 -18.758
  398    HB3  HIS  54           2HB      HIS  54  14.551   5.172 -18.197
  399    HD1  HIS  54           1HD      HIS  54  16.644   4.931 -19.535
  400    HD2  HIS  54           2HD      HIS  54  13.855   1.983 -20.422
  401    HE1  HIS  54           1HE      HIS  54  17.589   3.682 -21.503
  402    HA   PRO  55           HA       PRO  55  13.370  -0.781 -17.497
  403    HB2  PRO  55           1HB      PRO  55  11.059  -1.022 -18.902
  404    HB3  PRO  55           2HB      PRO  55  11.098  -0.736 -17.158
  405    HG2  PRO  55           1HG      PRO  55  10.671   1.214 -19.388
  406    HG3  PRO  55           2HG      PRO  55   9.819   1.082 -17.839
  407    HD2  PRO  55           1HD      PRO  55  11.768   2.910 -18.278
  408    HD3  PRO  55           2HD      PRO  55  11.486   2.179 -16.685
  409    H    THR  56           H        THR  56  15.002  -1.320 -18.868
  410    HA   THR  56           HA       THR  56  14.642  -0.791 -21.737
  411    HB   THR  56           HB       THR  56  17.163  -1.678 -20.324
  412    HG1  THR  56           1HG      THR  56  17.302   0.349 -19.753
  413   HG21  THR  56          1HG2      THR  56  16.752  -0.519 -23.083
  414   HG22  THR  56          2HG2      THR  56  17.025  -2.226 -22.733
  415   HG23  THR  56          3HG2      THR  56  18.282  -1.041 -22.379
  416    H    SER  57           H        SER  57  15.114  -2.471 -23.262
  417    HA   SER  57           HA       SER  57  14.461  -5.134 -22.208
  418    HB2  SER  57           1HB      SER  57  14.117  -3.914 -24.951
  419    HB3  SER  57           2HB      SER  57  13.870  -5.629 -24.623
  420    HG   SER  57           HG       SER  57  12.552  -3.681 -23.078
  421    H    SER  58           H        SER  58  17.108  -4.196 -21.969
  422    HA   SER  58           HA       SER  58  18.486  -6.055 -23.788
  423    HB2  SER  58           1HB      SER  58  18.889  -3.624 -24.362
  424    HB3  SER  58           2HB      SER  58  19.686  -3.463 -22.798
  425    HG   SER  58           HG       SER  58  20.830  -5.513 -23.787
  426    H    GLY  59           H        GLY  59  19.159  -7.710 -22.596
  427    HA2  GLY  59           1HA      GLY  59  20.908  -7.281 -20.361
  428    HA3  GLY  59           2HA      GLY  59  19.341  -7.910 -19.874
  429    HA   PRO  60           HA       PRO  60  21.944 -11.174 -22.409
  430    HB2  PRO  60           1HB      PRO  60  24.522 -11.182 -21.559
  431    HB3  PRO  60           2HB      PRO  60  23.972 -10.242 -22.952
  432    HG2  PRO  60           1HG      PRO  60  24.463  -9.347 -20.137
  433    HG3  PRO  60           2HG      PRO  60  24.898  -8.546 -21.658
  434    HD2  PRO  60           1HD      PRO  60  22.739  -7.819 -20.194
  435    HD3  PRO  60           2HD      PRO  60  22.776  -7.698 -21.965
  436    H    SER  61           H        SER  61  22.783 -10.240 -19.088
  437    HA   SER  61           HA       SER  61  23.113 -11.504 -17.199
  438    HB2  SER  61           1HB      SER  61  21.143 -12.677 -16.516
  439    HB3  SER  61           2HB      SER  61  20.606 -11.319 -17.506
  440    HG   SER  61           HG       SER  61  20.672 -12.944 -19.289
  441    H    SER  62           H        SER  62  24.748 -12.451 -19.204
  442    HA   SER  62           HA       SER  62  25.054 -15.209 -18.389
  443    HB2  SER  62           1HB      SER  62  25.249 -15.999 -20.779
  444    HB3  SER  62           2HB      SER  62  23.612 -15.580 -20.271
  445    HG   SER  62           HG       SER  62  24.669 -14.712 -22.379
  446    H    GLY  63           H        GLY  63  27.126 -15.397 -17.878
  447    HA2  GLY  63           1HA      GLY  63  29.103 -13.519 -18.500
  448    HA3  GLY  63           2HA      GLY  63  29.405 -15.141 -17.894
  Start of MODEL   12
    1    H1   GLY   1           H        GLY   1  -9.536 -20.507  11.760
    2    HA2  GLY   1           1HA      GLY   1  -8.305 -18.931  10.162
    3    HA3  GLY   1           2HA      GLY   1  -9.599 -19.351   9.049
    4    H    SER   2           H        SER   2 -10.286 -17.200   8.892
    5    HA   SER   2           HA       SER   2 -11.585 -16.149  11.321
    6    HB2  SER   2           1HB      SER   2  -9.603 -14.857  10.208
    7    HB3  SER   2           2HB      SER   2 -10.814 -14.387   9.016
    8    HG   SER   2           HG       SER   2 -12.074 -13.816  11.051
    9    H    SER   3           H        SER   3 -13.623 -15.161  11.096
   10    HA   SER   3           HA       SER   3 -15.126 -16.127   8.772
   11    HB2  SER   3           1HB      SER   3 -15.731 -16.533  11.320
   12    HB3  SER   3           2HB      SER   3 -16.474 -14.941  11.162
   13    HG   SER   3           HG       SER   3 -17.978 -15.758   9.917
   14    H    GLY   4           H        GLY   4 -16.633 -14.769   7.692
   15    HA2  GLY   4           1HA      GLY   4 -17.299 -12.820   6.680
   16    HA3  GLY   4           2HA      GLY   4 -17.015 -12.042   8.230
   17    H    SER   5           H        SER   5 -15.822 -12.597   5.051
   18    HA   SER   5           HA       SER   5 -13.152 -11.781   5.371
   19    HB2  SER   5           1HB      SER   5 -13.779 -12.865   3.332
   20    HB3  SER   5           2HB      SER   5 -15.017 -11.655   2.996
   21    HG   SER   5           HG       SER   5 -12.847 -11.510   1.899
   22    H    SER   6           H        SER   6 -12.345  -9.883   5.936
   23    HA   SER   6           HA       SER   6 -13.722  -7.633   6.617
   24    HB2  SER   6           1HB      SER   6 -11.163  -8.246   6.800
   25    HB3  SER   6           2HB      SER   6 -11.040  -7.270   5.337
   26    HG   SER   6           HG       SER   6 -11.916  -5.535   6.463
   27    H    GLY   7           H        GLY   7 -12.122  -8.174   3.474
   28    HA2  GLY   7           1HA      GLY   7 -13.552  -5.869   2.374
   29    HA3  GLY   7           2HA      GLY   7 -12.236  -6.738   1.600
   30    H    ARG   8           H        ARG   8 -14.268  -6.177   0.011
   31    HA   ARG   8           HA       ARG   8 -15.852  -8.657  -0.138
   32    HB2  ARG   8           1HB      ARG   8 -16.514  -5.936  -1.280
   33    HB3  ARG   8           2HB      ARG   8 -17.513  -7.377  -1.413
   34    HG2  ARG   8           1HG      ARG   8 -17.639  -7.401   1.093
   35    HG3  ARG   8           2HG      ARG   8 -16.861  -5.817   1.071
   36    HD2  ARG   8           1HD      ARG   8 -18.774  -5.227  -0.607
   37    HD3  ARG   8           2HD      ARG   8 -19.579  -6.613   0.126
   38    HE   ARG   8           HE       ARG   8 -18.625  -4.914   2.153
   39   HH11  ARG   8          2HH1      ARG   8 -21.059  -5.037  -0.334
   40   HH12  ARG   8          1HH1      ARG   8 -22.161  -4.001   0.512
   41   HH21  ARG   8          2HH2      ARG   8 -20.067  -3.549   3.276
   42   HH22  ARG   8          1HH2      ARG   8 -21.596  -3.155   2.564
   43    H    LYS   9           H        LYS   9 -14.607  -6.103  -2.300
   44    HA   LYS   9           HA       LYS   9 -14.194  -8.138  -4.370
   45    HB2  LYS   9           1HB      LYS   9 -14.651  -5.200  -4.382
   46    HB3  LYS   9           2HB      LYS   9 -13.643  -5.860  -5.663
   47    HG2  LYS   9           1HG      LYS   9 -15.742  -5.895  -6.610
   48    HG3  LYS   9           2HG      LYS   9 -15.581  -7.541  -5.993
   49    HD2  LYS   9           1HD      LYS   9 -17.729  -6.871  -5.334
   50    HD3  LYS   9           2HD      LYS   9 -16.740  -6.672  -3.885
   51    HE2  LYS   9           1HE      LYS   9 -16.439  -4.235  -4.884
   52    HE3  LYS   9           2HE      LYS   9 -17.980  -4.623  -5.647
   53    HZ1  LYS   9           1HZ      LYS   9 -17.536  -4.955  -2.740
   54    HZ2  LYS   9           2HZ      LYS   9 -19.006  -4.898  -3.574
   55    HZ3  LYS   9           3HZ      LYS   9 -18.075  -3.496  -3.405
   56    H    ILE  10           H        ILE  10 -12.211  -8.354  -5.449
   57    HA   ILE  10           HA       ILE  10  -9.906  -7.431  -3.878
   58    HB   ILE  10           HB       ILE  10  -8.640  -9.239  -4.919
   59   HG12  ILE  10          1HG1      ILE  10 -11.197 -10.205  -6.185
   60   HG13  ILE  10          2HG1      ILE  10 -10.076  -9.160  -7.050
   61   HG21  ILE  10          1HG2      ILE  10 -10.230 -11.167  -4.072
   62   HG22  ILE  10          2HG2      ILE  10  -9.490 -10.025  -2.951
   63   HG23  ILE  10          3HG2      ILE  10 -11.165  -9.804  -3.456
   64   HD11  ILE  10          1HD1      ILE  10  -9.866 -12.008  -6.365
   65   HD12  ILE  10          2HD1      ILE  10  -9.229 -11.116  -7.747
   66   HD13  ILE  10          3HD1      ILE  10  -8.383 -11.067  -6.201
   67    H    PHE  11           H        PHE  11 -11.148  -5.638  -5.679
   68    HA   PHE  11           HA       PHE  11  -9.462  -5.574  -8.051
   69    HB2  PHE  11           1HB      PHE  11 -11.916  -4.152  -7.146
   70    HB3  PHE  11           2HB      PHE  11 -10.860  -3.310  -8.276
   71    HD1  PHE  11           2HD      PHE  11 -12.088  -6.819  -7.910
   72    HD2  PHE  11           1HD      PHE  11 -11.602  -3.426 -10.434
   73    HE1  PHE  11           2HE      PHE  11 -13.097  -8.066  -9.775
   74    HE2  PHE  11           1HE      PHE  11 -12.612  -4.668 -12.303
   75    HZ   PHE  11           HZ       PHE  11 -13.360  -6.992 -11.975
   76    H    THR  12           H        THR  12 -10.087  -3.621  -5.160
   77    HA   THR  12           HA       THR  12  -8.455  -1.460  -5.624
   78    HB   THR  12           HB       THR  12  -8.126  -1.344  -3.142
   79    HG1  THR  12           1HG      THR  12  -9.820  -3.607  -2.978
   80   HG21  THR  12          1HG2      THR  12 -10.928  -1.839  -3.062
   81   HG22  THR  12          2HG2      THR  12 -10.529  -1.168  -4.644
   82   HG23  THR  12          3HG2      THR  12 -10.087  -0.293  -3.178
   83    H    ASN  13           H        ASN  13  -6.380  -1.303  -6.130
   84    HA   ASN  13           HA       ASN  13  -4.570  -3.468  -5.987
   85    HB2  ASN  13           1HB      ASN  13  -3.579  -0.653  -6.171
   86    HB3  ASN  13           2HB      ASN  13  -3.055  -2.084  -7.054
   87   HD21  ASN  13          1HD2      ASN  13  -5.237   0.571  -6.946
   88   HD22  ASN  13          2HD2      ASN  13  -5.960   0.321  -8.495
   89    H    LYS  14           H        LYS  14  -2.370  -3.224  -4.909
   90    HA   LYS  14           HA       LYS  14  -2.730  -2.209  -2.164
   91    HB2  LYS  14           1HB      LYS  14  -1.626  -4.074  -1.281
   92    HB3  LYS  14           2HB      LYS  14  -2.662  -4.756  -2.528
   93    HG2  LYS  14           1HG      LYS  14   0.198  -4.049  -3.080
   94    HG3  LYS  14           2HG      LYS  14  -0.260  -5.601  -2.375
   95    HD2  LYS  14           1HD      LYS  14  -1.941  -5.666  -4.388
   96    HD3  LYS  14           2HD      LYS  14  -0.812  -4.510  -5.098
   97    HE2  LYS  14           1HE      LYS  14   0.070  -6.492  -5.849
   98    HE3  LYS  14           2HE      LYS  14   0.979  -6.271  -4.355
   99    HZ1  LYS  14           1HZ      LYS  14  -0.759  -7.691  -3.270
  100    HZ2  LYS  14           2HZ      LYS  14   0.236  -8.493  -4.378
  101    HZ3  LYS  14           3HZ      LYS  14  -1.339  -8.058  -4.816
  102    H    CYS  15           H        CYS  15  -0.988  -1.207  -1.169
  103    HA   CYS  15           HA       CYS  15   0.832   0.127  -2.914
  104    HB2  CYS  15           1HB      CYS  15  -0.138   1.107  -0.812
  105    HB3  CYS  15           2HB      CYS  15   0.910   0.031   0.106
  106    H    GLU  16           H        GLU  16   2.903  -0.313  -3.393
  107    HA   GLU  16           HA       GLU  16   4.011  -2.821  -2.399
  108    HB2  GLU  16           1HB      GLU  16   5.002  -0.992  -4.593
  109    HB3  GLU  16           2HB      GLU  16   5.649  -2.581  -4.209
  110    HG2  GLU  16           1HG      GLU  16   3.124  -3.285  -4.607
  111    HG3  GLU  16           2HG      GLU  16   3.150  -1.834  -5.608
  112    H    ARG  17           H        ARG  17   3.905  -0.320  -0.785
  113    HA   ARG  17           HA       ARG  17   6.740   0.335  -0.498
  114    HB2  ARG  17           1HB      ARG  17   4.680   1.999  -0.462
  115    HB3  ARG  17           2HB      ARG  17   4.629   1.539   1.234
  116    HG2  ARG  17           1HG      ARG  17   7.247   2.362   0.111
  117    HG3  ARG  17           2HG      ARG  17   6.028   3.611   0.372
  118    HD2  ARG  17           1HD      ARG  17   5.802   2.465   2.717
  119    HD3  ARG  17           2HD      ARG  17   7.419   1.866   2.352
  120    HE   ARG  17           HE       ARG  17   7.673   4.492   1.871
  121   HH11  ARG  17          2HH1      ARG  17   6.323   2.737   4.558
  122   HH12  ARG  17          1HH1      ARG  17   6.725   3.954   5.723
  123   HH21  ARG  17          2HH2      ARG  17   8.208   6.102   3.397
  124   HH22  ARG  17          1HH2      ARG  17   7.796   5.868   5.062
  125    H    ALA  18           H        ALA  18   7.885   0.034   1.414
  126    HA   ALA  18           HA       ALA  18   7.309  -2.309   2.867
  127    HB1  ALA  18           1HB      ALA  18   9.112  -0.638   4.326
  128    HB2  ALA  18           2HB      ALA  18   9.450  -2.107   3.410
  129    HB3  ALA  18           3HB      ALA  18   9.481  -0.539   2.604
  130    H    GLY  19           H        GLY  19   6.355  -2.672   4.806
  131    HA2  GLY  19           1HA      GLY  19   5.013  -2.293   6.629
  132    HA3  GLY  19           2HA      GLY  19   5.944  -0.819   6.850
  133    H    CYS  20           H        CYS  20   3.846  -1.678   4.134
  134    HA   CYS  20           HA       CYS  20   1.904   0.334   5.006
  135    HB2  CYS  20           1HB      CYS  20   3.663   1.267   3.358
  136    HB3  CYS  20           2HB      CYS  20   2.845   0.282   2.149
  137    H    ARG  21           H        ARG  21  -0.111  -0.386   4.818
  138    HA   ARG  21           HA       ARG  21  -0.665  -2.518   2.863
  139    HB2  ARG  21           1HB      ARG  21  -1.532  -2.311   5.741
  140    HB3  ARG  21           2HB      ARG  21  -2.382  -3.326   4.583
  141    HG2  ARG  21           1HG      ARG  21  -0.331  -4.587   4.176
  142    HG3  ARG  21           2HG      ARG  21   0.524  -3.566   5.335
  143    HD2  ARG  21           1HD      ARG  21  -1.930  -5.136   6.074
  144    HD3  ARG  21           2HD      ARG  21  -0.310  -5.824   6.168
  145    HE   ARG  21           HE       ARG  21  -0.583  -3.317   7.547
  146   HH11  ARG  21          2HH1      ARG  21  -0.955  -6.770   7.783
  147   HH12  ARG  21          1HH1      ARG  21  -0.805  -6.800   9.508
  148   HH21  ARG  21          2HH2      ARG  21  -0.385  -3.343   9.819
  149   HH22  ARG  21          1HH2      ARG  21  -0.482  -4.849  10.666
  150    H    GLN  22           H        GLN  22  -1.025   0.255   2.425
  151    HA   GLN  22           HA       GLN  22  -3.794   0.912   2.859
  152    HB2  GLN  22           1HB      GLN  22  -1.505   2.234   1.440
  153    HB3  GLN  22           2HB      GLN  22  -3.148   2.819   1.209
  154    HG2  GLN  22           1HG      GLN  22  -1.691   3.930   2.998
  155    HG3  GLN  22           2HG      GLN  22  -3.351   3.506   3.410
  156   HE21  GLN  22          1HE2      GLN  22  -0.251   3.432   4.471
  157   HE22  GLN  22          2HE2      GLN  22  -0.365   2.149   5.622
  158    H    ARG  23           H        ARG  23  -5.426   1.031   1.324
  159    HA   ARG  23           HA       ARG  23  -4.884  -0.374  -1.210
  160    HB2  ARG  23           1HB      ARG  23  -7.204  -0.604   0.688
  161    HB3  ARG  23           2HB      ARG  23  -7.378  -1.032  -1.008
  162    HG2  ARG  23           1HG      ARG  23  -6.882  -3.063  -0.065
  163    HG3  ARG  23           2HG      ARG  23  -5.283  -2.511  -0.569
  164    HD2  ARG  23           1HD      ARG  23  -4.663  -1.948   1.614
  165    HD3  ARG  23           2HD      ARG  23  -6.333  -1.940   2.181
  166    HE   ARG  23           HE       ARG  23  -6.230  -4.226   2.455
  167   HH11  ARG  23          2HH1      ARG  23  -3.422  -3.105   0.729
  168   HH12  ARG  23          1HH1      ARG  23  -2.578  -4.613   0.860
  169   HH21  ARG  23          2HH2      ARG  23  -5.129  -6.216   2.635
  170   HH22  ARG  23          1HH2      ARG  23  -3.550  -6.382   1.944
  171    H    GLU  24           H        GLU  24  -4.799   1.236  -2.670
  172    HA   GLU  24           HA       GLU  24  -6.654   3.465  -2.527
  173    HB2  GLU  24           1HB      GLU  24  -4.194   2.831  -4.073
  174    HB3  GLU  24           2HB      GLU  24  -5.345   3.938  -4.808
  175    HG2  GLU  24           1HG      GLU  24  -4.375   4.355  -2.008
  176    HG3  GLU  24           2HG      GLU  24  -3.435   4.903  -3.395
  177    H    MET  25           H        MET  25  -8.343   3.838  -3.879
  178    HA   MET  25           HA       MET  25  -9.606   1.677  -5.136
  179    HB2  MET  25           1HB      MET  25 -10.486   4.041  -4.328
  180    HB3  MET  25           2HB      MET  25 -10.213   4.464  -6.013
  181    HG2  MET  25           1HG      MET  25 -11.833   2.069  -5.225
  182    HG3  MET  25           2HG      MET  25 -12.539   3.678  -5.348
  183    HE1  MET  25           1HE      MET  25 -12.430   4.523  -9.062
  184    HE2  MET  25           2HE      MET  25 -13.362   4.717  -7.578
  185    HE3  MET  25           3HE      MET  25 -11.658   5.170  -7.614
  186    H    MET  26           H        MET  26  -7.613   4.289  -6.446
  187    HA   MET  26           HA       MET  26  -7.806   3.114  -9.119
  188    HB2  MET  26           1HB      MET  26  -6.927   5.147  -9.963
  189    HB3  MET  26           2HB      MET  26  -8.094   5.600  -8.727
  190    HG2  MET  26           1HG      MET  26  -6.309   6.008  -7.147
  191    HG3  MET  26           2HG      MET  26  -5.115   5.468  -8.325
  192    HE1  MET  26           1HE      MET  26  -7.694   8.297  -7.366
  193    HE2  MET  26           2HE      MET  26  -6.116   8.354  -6.581
  194    HE3  MET  26           3HE      MET  26  -6.587   9.628  -7.707
  195    H    LYS  27           H        LYS  27  -5.646   3.267 -10.389
  196    HA   LYS  27           HA       LYS  27  -3.623   1.882  -8.774
  197    HB2  LYS  27           1HB      LYS  27  -4.356   0.559 -10.622
  198    HB3  LYS  27           2HB      LYS  27  -4.184   1.907 -11.739
  199    HG2  LYS  27           1HG      LYS  27  -1.904   1.698 -11.861
  200    HG3  LYS  27           2HG      LYS  27  -1.781   0.929 -10.276
  201    HD2  LYS  27           1HD      LYS  27  -3.145  -0.428 -12.582
  202    HD3  LYS  27           2HD      LYS  27  -1.398  -0.529 -12.353
  203    HE2  LYS  27           1HE      LYS  27  -1.905  -1.318  -9.993
  204    HE3  LYS  27           2HE      LYS  27  -3.578  -1.495 -10.519
  205    HZ1  LYS  27           1HZ      LYS  27  -2.589  -2.905 -12.386
  206    HZ2  LYS  27           2HZ      LYS  27  -2.661  -3.586 -10.840
  207    HZ3  LYS  27           3HZ      LYS  27  -1.196  -2.981 -11.430
  208    H    LEU  28           H        LEU  28  -1.962   3.066  -8.119
  209    HA   LEU  28           HA       LEU  28  -1.077   5.313  -9.804
  210    HB2  LEU  28           1HB      LEU  28  -0.637   4.897  -6.851
  211    HB3  LEU  28           2HB      LEU  28  -0.157   6.309  -7.790
  212    HG   LEU  28           HG       LEU  28  -3.043   5.580  -7.704
  213   HD11  LEU  28          1HD1      LEU  28  -1.901   7.276  -5.530
  214   HD12  LEU  28          2HD1      LEU  28  -1.945   5.523  -5.344
  215   HD13  LEU  28          3HD1      LEU  28  -3.441   6.420  -5.598
  216   HD21  LEU  28          1HD2      LEU  28  -1.978   7.462  -9.062
  217   HD22  LEU  28          2HD2      LEU  28  -1.746   8.281  -7.518
  218   HD23  LEU  28          3HD2      LEU  28  -3.373   7.871  -8.063
  219    H    THR  29           H        THR  29   0.586   4.677 -11.018
  220    HA   THR  29           HA       THR  29   2.652   2.971  -9.799
  221    HB   THR  29           HB       THR  29   2.176   3.470 -12.743
  222    HG1  THR  29           1HG      THR  29   0.461   2.267 -11.906
  223   HG21  THR  29          1HG2      THR  29   3.661   1.544 -13.054
  224   HG22  THR  29          2HG2      THR  29   3.895   1.440 -11.309
  225   HG23  THR  29          3HG2      THR  29   4.479   2.849 -12.195
  226    H    CYS  30           H        CYS  30   4.630   3.763  -9.460
  227    HA   CYS  30           HA       CYS  30   5.237   6.467  -9.653
  228    HB2  CYS  30           1HB      CYS  30   6.396   4.633  -8.275
  229    HB3  CYS  30           2HB      CYS  30   7.343   4.315  -9.724
  230    H    GLU  31           H        GLU  31   7.121   7.394 -10.900
  231    HA   GLU  31           HA       GLU  31   6.849   6.610 -13.718
  232    HB2  GLU  31           1HB      GLU  31   7.393   8.846 -14.313
  233    HB3  GLU  31           2HB      GLU  31   6.223   8.948 -13.005
  234    HG2  GLU  31           1HG      GLU  31   7.747   9.766 -11.513
  235    HG3  GLU  31           2HG      GLU  31   9.115   9.008 -12.327
  236    H    ARG  32           H        ARG  32   9.037   6.677 -11.108
  237    HA   ARG  32           HA       ARG  32  11.378   6.524 -12.859
  238    HB2  ARG  32           1HB      ARG  32  11.100   6.757  -9.861
  239    HB3  ARG  32           2HB      ARG  32  12.642   6.532 -10.676
  240    HG2  ARG  32           1HG      ARG  32  12.175   8.631 -11.955
  241    HG3  ARG  32           2HG      ARG  32  10.775   8.876 -10.909
  242    HD2  ARG  32           1HD      ARG  32  12.400  10.119  -9.837
  243    HD3  ARG  32           2HD      ARG  32  12.490   8.579  -8.982
  244    HE   ARG  32           HE       ARG  32  14.554   8.168  -9.971
  245   HH11  ARG  32          2HH1      ARG  32  13.133  11.099 -11.200
  246   HH12  ARG  32          1HH1      ARG  32  14.598  11.654 -11.938
  247   HH21  ARG  32          2HH2      ARG  32  16.489   8.888 -10.939
  248   HH22  ARG  32          1HH2      ARG  32  16.507  10.396 -11.790
  249    H    CYS  33           H        CYS  33  10.010   4.724 -10.097
  250    HA   CYS  33           HA       CYS  33  11.540   2.369 -10.845
  251    HB2  CYS  33           1HB      CYS  33  10.525   1.385  -8.786
  252    HB3  CYS  33           2HB      CYS  33  11.429   2.866  -8.489
  253    H    SER  34           H        SER  34   8.376   3.649 -11.246
  254    HA   SER  34           HA       SER  34   6.520   2.884 -12.316
  255    HB2  SER  34           1HB      SER  34   8.630   1.034 -13.380
  256    HB3  SER  34           2HB      SER  34   6.936   0.754 -13.782
  257    HG   SER  34           HG       SER  34   8.400   2.247 -15.135
  258    H    ARG  35           H        ARG  35   6.532   2.290  -9.717
  259    HA   ARG  35           HA       ARG  35   5.460  -0.452  -9.618
  260    HB2  ARG  35           1HB      ARG  35   7.161   1.011  -7.613
  261    HB3  ARG  35           2HB      ARG  35   6.140  -0.340  -7.138
  262    HG2  ARG  35           1HG      ARG  35   7.347  -1.620  -9.026
  263    HG3  ARG  35           2HG      ARG  35   8.544  -0.328  -8.913
  264    HD2  ARG  35           1HD      ARG  35   9.156  -0.908  -6.757
  265    HD3  ARG  35           2HD      ARG  35   7.636  -1.745  -6.443
  266    HE   ARG  35           HE       ARG  35   8.573  -3.653  -7.271
  267   HH11  ARG  35          2HH1      ARG  35  10.436  -0.925  -8.369
  268   HH12  ARG  35          1HH1      ARG  35  11.675  -1.896  -9.092
  269   HH21  ARG  35          2HH2      ARG  35  10.198  -4.943  -8.220
  270   HH22  ARG  35          1HH2      ARG  35  11.538  -4.181  -9.008
  271    H    ASN  36           H        ASN  36   3.754  -0.797  -8.051
  272    HA   ASN  36           HA       ASN  36   1.877   1.369  -8.042
  273    HB2  ASN  36           1HB      ASN  36   1.452  -1.208  -8.224
  274    HB3  ASN  36           2HB      ASN  36   1.481  -1.151  -6.464
  275   HD21  ASN  36          1HD2      ASN  36   0.085   0.647  -5.530
  276   HD22  ASN  36          2HD2      ASN  36  -1.485   0.827  -6.229
  277    H    PHE  37           H        PHE  37   1.126   2.564  -6.331
  278    HA   PHE  37           HA       PHE  37   1.981   2.052  -3.635
  279    HB2  PHE  37           1HB      PHE  37   2.981   4.558  -5.003
  280    HB3  PHE  37           2HB      PHE  37   3.231   4.117  -3.317
  281    HD1  PHE  37           2HD      PHE  37   4.441   1.833  -2.925
  282    HD2  PHE  37           1HD      PHE  37   4.612   4.063  -6.546
  283    HE1  PHE  37           2HE      PHE  37   6.523   0.674  -3.536
  284    HE2  PHE  37           1HE      PHE  37   6.694   2.906  -7.164
  285    HZ   PHE  37           HZ       PHE  37   7.653   1.210  -5.658
  286    H    CYS  38           H        CYS  38   1.154   3.749  -2.123
  287    HA   CYS  38           HA       CYS  38  -1.506   4.549  -2.984
  288    HB2  CYS  38           1HB      CYS  38  -1.978   4.906  -0.647
  289    HB3  CYS  38           2HB      CYS  38  -1.141   3.366  -0.816
  290    H    ILE  39           H        ILE  39  -2.233   6.716  -1.805
  291    HA   ILE  39           HA       ILE  39  -0.962   8.816  -3.176
  292    HB   ILE  39           HB       ILE  39  -3.020   8.748  -0.994
  293   HG12  ILE  39          1HG1      ILE  39  -3.092   9.776  -3.839
  294   HG13  ILE  39          2HG1      ILE  39  -3.643   8.183  -3.333
  295   HG21  ILE  39          1HG2      ILE  39  -1.654  10.713  -0.549
  296   HG22  ILE  39          2HG2      ILE  39  -1.828  11.228  -2.226
  297   HG23  ILE  39          3HG2      ILE  39  -3.238  11.181  -1.168
  298   HD11  ILE  39          1HD1      ILE  39  -5.645   9.102  -3.098
  299   HD12  ILE  39          2HD1      ILE  39  -5.004   9.909  -1.666
  300   HD13  ILE  39          3HD1      ILE  39  -4.993  10.736  -3.224
  301    H    LYS  40           H        LYS  40  -0.507   7.493   0.012
  302    HA   LYS  40           HA       LYS  40   0.996   9.714   1.031
  303    HB2  LYS  40           1HB      LYS  40   0.314   6.971   1.976
  304    HB3  LYS  40           2HB      LYS  40   1.698   7.772   2.709
  305    HG2  LYS  40           1HG      LYS  40   0.093   8.480   4.137
  306    HG3  LYS  40           2HG      LYS  40  -0.054   9.755   2.925
  307    HD2  LYS  40           1HD      LYS  40  -2.257   9.012   3.403
  308    HD3  LYS  40           2HD      LYS  40  -1.832   8.345   1.825
  309    HE2  LYS  40           1HE      LYS  40  -2.691   6.472   2.795
  310    HE3  LYS  40           2HE      LYS  40  -1.014   6.316   3.317
  311    HZ1  LYS  40           1HZ      LYS  40  -2.753   5.998   5.082
  312    HZ2  LYS  40           2HZ      LYS  40  -3.082   7.653   4.964
  313    HZ3  LYS  40           3HZ      LYS  40  -1.547   7.129   5.446
  314    H    HIS  41           H        HIS  41   1.730   6.698  -0.597
  315    HA   HIS  41           HA       HIS  41   4.591   7.397  -0.520
  316    HB2  HIS  41           1HB      HIS  41   3.302   4.684  -0.884
  317    HB3  HIS  41           2HB      HIS  41   5.034   4.998  -0.942
  318    HD2  HIS  41           2HD      HIS  41   4.900   6.993   1.825
  319    HE1  HIS  41           1HE      HIS  41   3.829   3.312   3.642
  320    HE2  HIS  41           2HE      HIS  41   4.584   5.683   4.033
  321    H    ARG  42           H        ARG  42   2.286   8.137  -2.404
  322    HA   ARG  42           HA       ARG  42   2.858   6.896  -4.900
  323    HB2  ARG  42           1HB      ARG  42   0.748   7.811  -4.904
  324    HB3  ARG  42           2HB      ARG  42   1.245   9.230  -3.991
  325    HG2  ARG  42           1HG      ARG  42   0.833  10.137  -6.054
  326    HG3  ARG  42           2HG      ARG  42   2.565   9.816  -6.160
  327    HD2  ARG  42           1HD      ARG  42   1.992   7.622  -7.236
  328    HD3  ARG  42           2HD      ARG  42   0.316   8.167  -7.298
  329    HE   ARG  42           HE       ARG  42   0.872   9.633  -8.996
  330   HH11  ARG  42          2HH1      ARG  42   3.740   8.184  -7.656
  331   HH12  ARG  42          1HH1      ARG  42   4.774   8.742  -8.929
  332   HH21  ARG  42          2HH2      ARG  42   2.223  10.373 -10.677
  333   HH22  ARG  42          1HH2      ARG  42   3.911   9.988 -10.647
  334    H    HIS  43           H        HIS  43   4.061   9.732  -3.234
  335    HA   HIS  43           HA       HIS  43   5.514  10.707  -5.530
  336    HB2  HIS  43           1HB      HIS  43   4.544  11.994  -3.406
  337    HB3  HIS  43           2HB      HIS  43   6.154  11.654  -2.779
  338    HD1  HIS  43           1HD      HIS  43   8.123  12.924  -3.821
  339    HD2  HIS  43           2HD      HIS  43   4.454  13.814  -5.555
  340    HE1  HIS  43           1HE      HIS  43   8.531  14.950  -5.252
  341    HA   PRO  44           HA       PRO  44   9.145   8.277  -4.975
  342    HB2  PRO  44           1HB      PRO  44  10.909   9.859  -6.301
  343    HB3  PRO  44           2HB      PRO  44   9.690   8.880  -7.125
  344    HG2  PRO  44           1HG      PRO  44   9.641  11.798  -6.459
  345    HG3  PRO  44           2HG      PRO  44   9.148  10.983  -7.955
  346    HD2  PRO  44           1HD      PRO  44   7.367  11.799  -6.085
  347    HD3  PRO  44           2HD      PRO  44   7.104  10.359  -7.090
  348    H    LEU  45           H        LEU  45   8.482  10.974  -3.281
  349    HA   LEU  45           HA       LEU  45  11.169  11.206  -2.113
  350    HB2  LEU  45           1HB      LEU  45   8.780  13.032  -2.050
  351    HB3  LEU  45           2HB      LEU  45  10.186  13.261  -1.012
  352    HG   LEU  45           HG       LEU  45  10.277  13.271  -4.027
  353   HD11  LEU  45          1HD1      LEU  45  10.175  15.582  -4.021
  354   HD12  LEU  45          2HD1      LEU  45  10.555  15.698  -2.303
  355   HD13  LEU  45          3HD1      LEU  45   8.962  15.143  -2.818
  356   HD21  LEU  45          1HD2      LEU  45  12.377  14.610  -2.509
  357   HD22  LEU  45          2HD2      LEU  45  12.496  13.487  -3.865
  358   HD23  LEU  45          3HD2      LEU  45  12.305  12.871  -2.223
  359    H    ASP  46           H        ASP  46   7.916  10.215  -1.491
  360    HA   ASP  46           HA       ASP  46   8.509   9.861   1.365
  361    HB2  ASP  46           1HB      ASP  46   5.942  10.025  -0.192
  362    HB3  ASP  46           2HB      ASP  46   5.977   9.314   1.419
  363    H    HIS  47           H        HIS  47   9.556   8.162  -0.800
  364    HA   HIS  47           HA       HIS  47   9.088   5.637   0.410
  365    HB2  HIS  47           1HB      HIS  47   7.800   4.511  -1.153
  366    HB3  HIS  47           2HB      HIS  47   7.035   6.097  -1.148
  367    HD1  HIS  47           1HD      HIS  47   6.524   6.874  -3.426
  368    HD2  HIS  47           2HD      HIS  47   9.948   4.522  -3.344
  369    HE1  HIS  47           1HE      HIS  47   7.312   6.751  -5.811
  370    H    ASP  48           H        ASP  48  10.801   4.347   0.070
  371    HA   ASP  48           HA       ASP  48  13.115   5.253  -1.149
  372    HB2  ASP  48           1HB      ASP  48  13.178   3.472   0.486
  373    HB3  ASP  48           2HB      ASP  48  12.247   2.415  -0.571
  374    H    CYS  49           H        CYS  49  13.170   5.869  -3.227
  375    HA   CYS  49           HA       CYS  49  12.020   4.085  -5.258
  376    HB2  CYS  49           1HB      CYS  49  11.349   6.535  -5.155
  377    HB3  CYS  49           2HB      CYS  49  12.988   6.913  -5.677
  378    H    SER  50           H        SER  50  13.430   2.681  -6.062
  379    HA   SER  50           HA       SER  50  16.266   3.238  -6.081
  380    HB2  SER  50           1HB      SER  50  14.795   0.840  -7.198
  381    HB3  SER  50           2HB      SER  50  16.523   0.954  -6.861
  382    HG   SER  50           HG       SER  50  15.068  -0.085  -5.229
  383    H    GLY  51           H        GLY  51  13.693   2.755  -8.472
  384    HA2  GLY  51           1HA      GLY  51  13.562   3.320 -10.692
  385    HA3  GLY  51           2HA      GLY  51  14.771   4.545 -10.337
  386    H    GLU  52           H        GLU  52  14.745   0.979 -10.493
  387    HA   GLU  52           HA       GLU  52  17.324   0.514 -11.200
  388    HB2  GLU  52           1HB      GLU  52  14.824  -0.864 -12.173
  389    HB3  GLU  52           2HB      GLU  52  16.438  -1.463 -12.527
  390    HG2  GLU  52           1HG      GLU  52  16.886  -1.891 -10.251
  391    HG3  GLU  52           2HG      GLU  52  15.472  -0.979  -9.727
  392    H    GLY  53           H        GLY  53  14.716   0.838 -13.622
  393    HA2  GLY  53           1HA      GLY  53  14.744   1.874 -15.688
  394    HA3  GLY  53           2HA      GLY  53  16.336   2.509 -15.303
  395    H    HIS  54           H        HIS  54  17.207   2.055 -17.316
  396    HA   HIS  54           HA       HIS  54  17.006  -0.184 -18.855
  397    HB2  HIS  54           1HB      HIS  54  18.886   0.536 -19.981
  398    HB3  HIS  54           2HB      HIS  54  18.441   2.010 -19.126
  399    HD1  HIS  54           1HD      HIS  54  21.358   0.494 -20.016
  400    HD2  HIS  54           2HD      HIS  54  19.879   1.616 -16.299
  401    HE1  HIS  54           1HE      HIS  54  23.373   0.709 -18.527
  402    HA   PRO  55           HA       PRO  55  18.771  -3.596 -16.732
  403    HB2  PRO  55           1HB      PRO  55  19.822  -5.009 -18.799
  404    HB3  PRO  55           2HB      PRO  55  18.083  -4.894 -18.499
  405    HG2  PRO  55           1HG      PRO  55  19.774  -3.373 -20.445
  406    HG3  PRO  55           2HG      PRO  55  18.171  -4.095 -20.681
  407    HD2  PRO  55           1HD      PRO  55  18.524  -1.451 -20.216
  408    HD3  PRO  55           2HD      PRO  55  17.090  -2.336 -19.657
  409    H    THR  56           H        THR  56  20.472  -3.102 -15.456
  410    HA   THR  56           HA       THR  56  23.080  -2.622 -16.736
  411    HB   THR  56           HB       THR  56  22.368  -0.789 -15.290
  412    HG1  THR  56           1HG      THR  56  24.653  -1.906 -15.248
  413   HG21  THR  56          1HG2      THR  56  21.246  -2.743 -13.712
  414   HG22  THR  56          2HG2      THR  56  21.437  -1.048 -13.265
  415   HG23  THR  56          3HG2      THR  56  22.644  -2.234 -12.767
  416    H    SER  57           H        SER  57  24.588  -4.143 -16.586
  417    HA   SER  57           HA       SER  57  24.242  -6.257 -14.564
  418    HB2  SER  57           1HB      SER  57  24.064  -6.956 -16.972
  419    HB3  SER  57           2HB      SER  57  25.746  -6.470 -17.181
  420    HG   SER  57           HG       SER  57  26.283  -8.002 -15.543
  421    H    SER  58           H        SER  58  25.400  -5.109 -12.966
  422    HA   SER  58           HA       SER  58  27.816  -3.855 -13.125
  423    HB2  SER  58           1HB      SER  58  28.053  -4.178 -10.803
  424    HB3  SER  58           2HB      SER  58  26.311  -4.248 -11.070
  425    HG   SER  58           HG       SER  58  26.470  -6.096 -10.081
  426    H    GLY  59           H        GLY  59  29.976  -4.425 -13.060
  427    HA2  GLY  59           1HA      GLY  59  30.741  -6.758 -14.417
  428    HA3  GLY  59           2HA      GLY  59  31.827  -5.696 -13.533
  429    HA   PRO  60           HA       PRO  60  31.752  -9.845 -11.439
  430    HB2  PRO  60           1HB      PRO  60  34.451 -10.090 -11.287
  431    HB3  PRO  60           2HB      PRO  60  33.516 -10.616 -12.692
  432    HG2  PRO  60           1HG      PRO  60  35.074  -8.092 -12.291
  433    HG3  PRO  60           2HG      PRO  60  34.994  -9.142 -13.717
  434    HD2  PRO  60           1HD      PRO  60  33.590  -6.835 -13.526
  435    HD3  PRO  60           2HD      PRO  60  32.989  -8.247 -14.419
  436    H    SER  61           H        SER  61  33.073  -6.728 -10.837
  437    HA   SER  61           HA       SER  61  33.457  -7.398  -7.994
  438    HB2  SER  61           1HB      SER  61  35.524  -6.587  -8.830
  439    HB3  SER  61           2HB      SER  61  34.739  -5.290  -9.732
  440    HG   SER  61           HG       SER  61  35.240  -5.497  -6.976
  441    H    SER  62           H        SER  62  31.185  -7.176  -7.612
  442    HA   SER  62           HA       SER  62  30.124  -4.451  -7.853
  443    HB2  SER  62           1HB      SER  62  28.838  -6.497  -8.713
  444    HB3  SER  62           2HB      SER  62  28.557  -6.889  -7.017
  445    HG   SER  62           HG       SER  62  27.041  -5.450  -7.014
  446    H    GLY  63           H        GLY  63  32.079  -4.812  -5.914
  447    HA2  GLY  63           1HA      GLY  63  32.427  -4.166  -3.730
  448    HA3  GLY  63           2HA      GLY  63  30.697  -3.890  -3.593
  Start of MODEL   13
    1    H1   GLY   1           H        GLY   1 -23.760 -19.700  -2.484
    2    HA2  GLY   1           1HA      GLY   1 -23.608 -20.346  -5.187
    3    HA3  GLY   1           2HA      GLY   1 -24.740 -19.193  -4.496
    4    H    SER   2           H        SER   2 -24.638 -17.790  -6.243
    5    HA   SER   2           HA       SER   2 -22.620 -15.814  -6.134
    6    HB2  SER   2           1HB      SER   2 -22.343 -17.954  -8.191
    7    HB3  SER   2           2HB      SER   2 -22.005 -16.295  -8.684
    8    HG   SER   2           HG       SER   2 -20.286 -17.782  -7.633
    9    H    SER   3           H        SER   3 -23.733 -14.033  -6.531
   10    HA   SER   3           HA       SER   3 -25.769 -14.083  -8.660
   11    HB2  SER   3           1HB      SER   3 -27.096 -12.481  -7.307
   12    HB3  SER   3           2HB      SER   3 -26.893 -14.034  -6.497
   13    HG   SER   3           HG       SER   3 -24.962 -12.122  -5.961
   14    H    GLY   4           H        GLY   4 -24.840 -12.989 -10.286
   15    HA2  GLY   4           1HA      GLY   4 -23.984 -11.215 -11.465
   16    HA3  GLY   4           2HA      GLY   4 -24.458 -10.199 -10.112
   17    H    SER   5           H        SER   5 -22.959  -9.676  -8.526
   18    HA   SER   5           HA       SER   5 -20.236  -9.664  -9.394
   19    HB2  SER   5           1HB      SER   5 -21.578  -8.723  -6.856
   20    HB3  SER   5           2HB      SER   5 -19.847  -8.552  -7.146
   21    HG   SER   5           HG       SER   5 -20.572  -7.471  -9.180
   22    H    SER   6           H        SER   6 -18.627 -11.010  -8.893
   23    HA   SER   6           HA       SER   6 -18.514 -12.510  -6.474
   24    HB2  SER   6           1HB      SER   6 -20.166 -13.909  -7.571
   25    HB3  SER   6           2HB      SER   6 -19.172 -14.002  -9.025
   26    HG   SER   6           HG       SER   6 -17.884 -14.782  -6.727
   27    H    GLY   7           H        GLY   7 -16.422 -12.545  -6.015
   28    HA2  GLY   7           1HA      GLY   7 -14.277 -13.612  -6.773
   29    HA3  GLY   7           2HA      GLY   7 -14.507 -12.705  -8.260
   30    H    ARG   8           H        ARG   8 -12.498 -11.669  -7.989
   31    HA   ARG   8           HA       ARG   8 -12.301  -9.825  -5.713
   32    HB2  ARG   8           1HB      ARG   8 -10.187 -10.690  -7.695
   33    HB3  ARG   8           2HB      ARG   8  -9.927  -9.614  -6.328
   34    HG2  ARG   8           1HG      ARG   8 -10.148 -11.321  -4.776
   35    HG3  ARG   8           2HG      ARG   8 -11.009 -12.369  -5.907
   36    HD2  ARG   8           1HD      ARG   8  -9.066 -12.961  -7.032
   37    HD3  ARG   8           2HD      ARG   8  -8.184 -11.549  -6.452
   38    HE   ARG   8           HE       ARG   8  -7.529 -12.783  -4.656
   39   HH11  ARG   8          2HH1      ARG   8 -10.421 -14.205  -5.972
   40   HH12  ARG   8          1HH1      ARG   8 -10.408 -15.556  -4.887
   41   HH21  ARG   8          2HH2      ARG   8  -7.500 -14.556  -3.221
   42   HH22  ARG   8          1HH2      ARG   8  -8.746 -15.754  -3.322
   43    H    LYS   9           H        LYS   9 -11.162  -7.701  -6.285
   44    HA   LYS   9           HA       LYS   9 -12.242  -6.658  -8.821
   45    HB2  LYS   9           1HB      LYS   9 -12.511  -4.468  -7.569
   46    HB3  LYS   9           2HB      LYS   9 -13.635  -5.750  -7.135
   47    HG2  LYS   9           1HG      LYS   9 -12.071  -6.287  -5.219
   48    HG3  LYS   9           2HG      LYS   9 -11.255  -4.766  -5.590
   49    HD2  LYS   9           1HD      LYS   9 -14.164  -5.101  -4.859
   50    HD3  LYS   9           2HD      LYS   9 -12.895  -4.451  -3.819
   51    HE2  LYS   9           1HE      LYS   9 -12.573  -2.585  -5.334
   52    HE3  LYS   9           2HE      LYS   9 -13.763  -3.255  -6.449
   53    HZ1  LYS   9           1HZ      LYS   9 -15.490  -2.875  -4.899
   54    HZ2  LYS   9           2HZ      LYS   9 -14.591  -1.444  -4.965
   55    HZ3  LYS   9           3HZ      LYS   9 -14.407  -2.498  -3.655
   56    H    ILE  10           H        ILE  10 -10.251  -6.889  -9.872
   57    HA   ILE  10           HA       ILE  10  -7.733  -6.299  -9.101
   58    HB   ILE  10           HB       ILE  10  -8.941  -5.474 -11.744
   59   HG12  ILE  10          1HG1      ILE  10  -9.229  -7.882 -11.120
   60   HG13  ILE  10          2HG1      ILE  10  -8.253  -7.633 -12.563
   61   HG21  ILE  10          1HG2      ILE  10  -6.063  -6.151 -11.227
   62   HG22  ILE  10          2HG2      ILE  10  -6.774  -5.349 -12.627
   63   HG23  ILE  10          3HG2      ILE  10  -6.676  -4.504 -11.082
   64   HD11  ILE  10          1HD1      ILE  10  -7.461  -9.363 -10.874
   65   HD12  ILE  10          2HD1      ILE  10  -6.276  -8.193 -11.456
   66   HD13  ILE  10          3HD1      ILE  10  -7.006  -7.991  -9.863
   67    H    PHE  11           H        PHE  11 -10.178  -3.933 -10.078
   68    HA   PHE  11           HA       PHE  11  -8.926  -1.602 -10.315
   69    HB2  PHE  11           1HB      PHE  11 -11.318  -2.141  -8.549
   70    HB3  PHE  11           2HB      PHE  11 -10.782  -0.523  -8.991
   71    HD1  PHE  11           1HD      PHE  11 -10.439  -0.192 -11.606
   72    HD2  PHE  11           2HD      PHE  11 -12.973  -3.100  -9.807
   73    HE1  PHE  11           1HE      PHE  11 -11.758  -0.321 -13.680
   74    HE2  PHE  11           2HE      PHE  11 -14.295  -3.234 -11.878
   75    HZ   PHE  11           HZ       PHE  11 -13.688  -1.844 -13.818
   76    H    THR  12           H        THR  12  -9.715  -2.909  -7.091
   77    HA   THR  12           HA       THR  12  -8.291  -0.988  -5.628
   78    HB   THR  12           HB       THR  12  -8.333  -2.646  -3.764
   79    HG1  THR  12           1HG      THR  12  -9.197  -4.304  -5.877
   80   HG21  THR  12          1HG2      THR  12 -10.279  -1.532  -3.551
   81   HG22  THR  12          2HG2      THR  12 -11.006  -3.017  -4.167
   82   HG23  THR  12          3HG2      THR  12 -10.663  -1.680  -5.265
   83    H    ASN  13           H        ASN  13  -6.219  -0.607  -6.260
   84    HA   ASN  13           HA       ASN  13  -4.365  -2.724  -6.818
   85    HB2  ASN  13           1HB      ASN  13  -3.550   0.113  -6.255
   86    HB3  ASN  13           2HB      ASN  13  -2.829  -1.046  -7.369
   87   HD21  ASN  13          1HD2      ASN  13  -5.603   1.029  -6.814
   88   HD22  ASN  13          2HD2      ASN  13  -6.051   1.189  -8.474
   89    H    LYS  14           H        LYS  14  -2.330  -3.017  -5.662
   90    HA   LYS  14           HA       LYS  14  -2.656  -2.596  -2.763
   91    HB2  LYS  14           1HB      LYS  14  -2.793  -4.941  -3.253
   92    HB3  LYS  14           2HB      LYS  14  -1.363  -4.867  -4.275
   93    HG2  LYS  14           1HG      LYS  14  -1.041  -4.044  -1.452
   94    HG3  LYS  14           2HG      LYS  14  -1.303  -5.760  -1.772
   95    HD2  LYS  14           1HD      LYS  14   0.566  -5.622  -3.451
   96    HD3  LYS  14           2HD      LYS  14   0.896  -3.998  -2.843
   97    HE2  LYS  14           1HE      LYS  14   1.035  -5.102  -0.534
   98    HE3  LYS  14           2HE      LYS  14   1.137  -6.628  -1.413
   99    HZ1  LYS  14           1HZ      LYS  14   3.106  -4.518  -1.131
  100    HZ2  LYS  14           2HZ      LYS  14   2.984  -5.184  -2.680
  101    HZ3  LYS  14           3HZ      LYS  14   3.324  -6.180  -1.356
  102    H    CYS  15           H        CYS  15  -1.306  -1.134  -1.974
  103    HA   CYS  15           HA       CYS  15   0.802   0.059  -3.304
  104    HB2  CYS  15           1HB      CYS  15  -0.303   0.932  -1.243
  105    HB3  CYS  15           2HB      CYS  15   0.573  -0.275  -0.307
  106    H    GLU  16           H        GLU  16   2.913  -0.374  -3.610
  107    HA   GLU  16           HA       GLU  16   3.901  -2.950  -2.614
  108    HB2  GLU  16           1HB      GLU  16   4.985  -1.211  -4.837
  109    HB3  GLU  16           2HB      GLU  16   5.561  -2.815  -4.405
  110    HG2  GLU  16           1HG      GLU  16   3.038  -3.453  -4.840
  111    HG3  GLU  16           2HG      GLU  16   3.096  -2.004  -5.842
  112    H    ARG  17           H        ARG  17   3.823  -0.606  -0.926
  113    HA   ARG  17           HA       ARG  17   6.659   0.098  -0.671
  114    HB2  ARG  17           1HB      ARG  17   4.573   1.754  -0.620
  115    HB3  ARG  17           2HB      ARG  17   4.580   1.311   1.082
  116    HG2  ARG  17           1HG      ARG  17   7.071   2.264  -0.279
  117    HG3  ARG  17           2HG      ARG  17   5.876   3.398   0.355
  118    HD2  ARG  17           1HD      ARG  17   7.198   3.211   2.197
  119    HD3  ARG  17           2HD      ARG  17   6.113   1.854   2.499
  120    HE   ARG  17           HE       ARG  17   7.983   0.555   1.256
  121   HH11  ARG  17          2HH1      ARG  17   8.414   3.206   3.471
  122   HH12  ARG  17          1HH1      ARG  17   9.973   2.675   4.008
  123   HH21  ARG  17          2HH2      ARG  17  10.035  -0.155   1.956
  124   HH22  ARG  17          1HH2      ARG  17  10.895   0.763   3.145
  125    H    ALA  18           H        ALA  18   7.674  -1.478   0.436
  126    HA   ALA  18           HA       ALA  18   6.881  -3.324   2.179
  127    HB1  ALA  18           1HB      ALA  18   9.082  -3.592   2.252
  128    HB2  ALA  18           2HB      ALA  18   9.347  -1.924   1.741
  129    HB3  ALA  18           3HB      ALA  18   9.158  -2.303   3.453
  130    H    GLY  19           H        GLY  19   5.987  -3.502   4.149
  131    HA2  GLY  19           1HA      GLY  19   5.188  -2.928   6.230
  132    HA3  GLY  19           2HA      GLY  19   6.285  -1.555   6.205
  133    H    CYS  20           H        CYS  20   3.835  -2.142   3.765
  134    HA   CYS  20           HA       CYS  20   2.187   0.007   4.898
  135    HB2  CYS  20           1HB      CYS  20   3.806   0.763   3.023
  136    HB3  CYS  20           2HB      CYS  20   2.732  -0.121   1.943
  137    H    ARG  21           H        ARG  21   0.145  -0.614   5.068
  138    HA   ARG  21           HA       ARG  21  -0.831  -2.737   3.274
  139    HB2  ARG  21           1HB      ARG  21  -1.735  -2.083   6.084
  140    HB3  ARG  21           2HB      ARG  21  -2.393  -3.359   5.068
  141    HG2  ARG  21           1HG      ARG  21   0.487  -3.235   5.924
  142    HG3  ARG  21           2HG      ARG  21  -0.764  -4.113   6.806
  143    HD2  ARG  21           1HD      ARG  21  -0.135  -4.584   3.899
  144    HD3  ARG  21           2HD      ARG  21   0.609  -5.493   5.213
  145    HE   ARG  21           HE       ARG  21  -2.049  -5.804   4.185
  146   HH11  ARG  21          2HH1      ARG  21  -0.018  -6.197   6.985
  147   HH12  ARG  21          1HH1      ARG  21  -1.004  -7.437   7.687
  148   HH21  ARG  21          2HH2      ARG  21  -3.354  -7.436   5.099
  149   HH22  ARG  21          1HH2      ARG  21  -2.900  -8.142   6.613
  150    H    GLN  22           H        GLN  22  -0.904  -0.081   2.444
  151    HA   GLN  22           HA       GLN  22  -3.603   0.893   2.929
  152    HB2  GLN  22           1HB      GLN  22  -1.224   1.998   1.456
  153    HB3  GLN  22           2HB      GLN  22  -2.816   2.730   1.312
  154    HG2  GLN  22           1HG      GLN  22  -1.137   3.655   3.043
  155    HG3  GLN  22           2HG      GLN  22  -2.830   3.460   3.492
  156   HE21  GLN  22          1HE2      GLN  22  -3.408   1.558   4.715
  157   HE22  GLN  22          2HE2      GLN  22  -2.251   0.847   5.783
  158    H    ARG  23           H        ARG  23  -5.039   1.421   1.152
  159    HA   ARG  23           HA       ARG  23  -4.579  -0.095  -1.312
  160    HB2  ARG  23           1HB      ARG  23  -6.908  -0.403   0.566
  161    HB3  ARG  23           2HB      ARG  23  -7.059  -0.785  -1.144
  162    HG2  ARG  23           1HG      ARG  23  -5.000  -2.285  -0.766
  163    HG3  ARG  23           2HG      ARG  23  -5.398  -2.130   0.947
  164    HD2  ARG  23           1HD      ARG  23  -7.497  -3.156   0.657
  165    HD3  ARG  23           2HD      ARG  23  -7.433  -2.973  -1.096
  166    HE   ARG  23           HE       ARG  23  -6.244  -5.070   0.478
  167   HH11  ARG  23          2HH1      ARG  23  -6.157  -3.338  -2.541
  168   HH12  ARG  23          1HH1      ARG  23  -5.385  -4.624  -3.407
  169   HH21  ARG  23          2HH2      ARG  23  -5.226  -6.770  -0.651
  170   HH22  ARG  23          1HH2      ARG  23  -4.856  -6.577  -2.331
  171    H    GLU  24           H        GLU  24  -4.715   1.348  -2.893
  172    HA   GLU  24           HA       GLU  24  -6.577   3.599  -2.617
  173    HB2  GLU  24           1HB      GLU  24  -4.008   3.186  -4.060
  174    HB3  GLU  24           2HB      GLU  24  -5.180   4.272  -4.793
  175    HG2  GLU  24           1HG      GLU  24  -4.154   4.525  -1.976
  176    HG3  GLU  24           2HG      GLU  24  -3.514   5.407  -3.361
  177    H    MET  25           H        MET  25  -8.475   3.399  -3.585
  178    HA   MET  25           HA       MET  25  -9.344   1.398  -5.219
  179    HB2  MET  25           1HB      MET  25 -10.215   4.288  -5.160
  180    HB3  MET  25           2HB      MET  25 -11.081   3.035  -6.038
  181    HG2  MET  25           1HG      MET  25 -10.596   3.111  -3.069
  182    HG3  MET  25           2HG      MET  25 -12.114   3.469  -3.890
  183    HE1  MET  25           1HE      MET  25 -12.778   1.947  -5.789
  184    HE2  MET  25           2HE      MET  25 -12.436   0.221  -5.910
  185    HE3  MET  25           3HE      MET  25 -13.768   0.788  -4.901
  186    H    MET  26           H        MET  26  -7.687   4.357  -6.174
  187    HA   MET  26           HA       MET  26  -7.867   3.640  -8.992
  188    HB2  MET  26           1HB      MET  26  -6.868   5.797  -9.434
  189    HB3  MET  26           2HB      MET  26  -8.182   5.995  -8.282
  190    HG2  MET  26           1HG      MET  26  -6.288   5.802  -6.508
  191    HG3  MET  26           2HG      MET  26  -5.242   6.229  -7.860
  192    HE1  MET  26           1HE      MET  26  -6.979   9.073  -9.355
  193    HE2  MET  26           2HE      MET  26  -5.449   9.548  -8.617
  194    HE3  MET  26           3HE      MET  26  -5.610   7.961  -9.370
  195    H    LYS  27           H        LYS  27  -5.935   3.567 -10.333
  196    HA   LYS  27           HA       LYS  27  -3.834   2.050  -9.032
  197    HB2  LYS  27           1HB      LYS  27  -4.642   1.163 -11.106
  198    HB3  LYS  27           2HB      LYS  27  -4.407   2.703 -11.923
  199    HG2  LYS  27           1HG      LYS  27  -2.093   2.457 -11.985
  200    HG3  LYS  27           2HG      LYS  27  -2.097   1.222 -10.724
  201    HD2  LYS  27           1HD      LYS  27  -1.764  -0.055 -12.614
  202    HD3  LYS  27           2HD      LYS  27  -3.520  -0.125 -12.453
  203    HE2  LYS  27           1HE      LYS  27  -3.434   2.003 -13.979
  204    HE3  LYS  27           2HE      LYS  27  -1.846   1.374 -14.417
  205    HZ1  LYS  27           1HZ      LYS  27  -3.716  -0.722 -14.492
  206    HZ2  LYS  27           2HZ      LYS  27  -2.812  -0.071 -15.765
  207    HZ3  LYS  27           3HZ      LYS  27  -4.330   0.574 -15.390
  208    H    LEU  28           H        LEU  28  -2.051   2.957  -8.268
  209    HA   LEU  28           HA       LEU  28  -1.107   5.463  -9.498
  210    HB2  LEU  28           1HB      LEU  28  -0.963   4.588  -6.619
  211    HB3  LEU  28           2HB      LEU  28  -0.144   6.007  -7.269
  212    HG   LEU  28           HG       LEU  28  -3.110   5.760  -7.540
  213   HD11  LEU  28          1HD1      LEU  28  -3.574   6.200  -5.390
  214   HD12  LEU  28          2HD1      LEU  28  -2.150   7.219  -5.183
  215   HD13  LEU  28          3HD1      LEU  28  -2.000   5.465  -5.083
  216   HD21  LEU  28          1HD2      LEU  28  -1.973   7.554  -8.716
  217   HD22  LEU  28          2HD2      LEU  28  -1.209   8.081  -7.215
  218   HD23  LEU  28          3HD2      LEU  28  -2.959   8.207  -7.407
  219    H    THR  29           H        THR  29   0.464   4.732 -10.833
  220    HA   THR  29           HA       THR  29   2.519   2.956  -9.700
  221    HB   THR  29           HB       THR  29   2.093   3.571 -12.626
  222    HG1  THR  29           1HG      THR  29   0.544   2.125 -11.027
  223   HG21  THR  29          1HG2      THR  29   3.478   1.217 -11.352
  224   HG22  THR  29          2HG2      THR  29   4.326   2.692 -11.821
  225   HG23  THR  29          3HG2      THR  29   3.513   1.715 -13.043
  226    H    CYS  30           H        CYS  30   4.516   3.699  -9.363
  227    HA   CYS  30           HA       CYS  30   5.168   6.400  -9.482
  228    HB2  CYS  30           1HB      CYS  30   6.309   4.589  -8.122
  229    HB3  CYS  30           2HB      CYS  30   7.179   4.150  -9.588
  230    H    GLU  31           H        GLU  31   7.035   7.343 -10.723
  231    HA   GLU  31           HA       GLU  31   6.722   6.649 -13.558
  232    HB2  GLU  31           1HB      GLU  31   6.174   8.899 -13.321
  233    HB3  GLU  31           2HB      GLU  31   7.415   9.178 -12.108
  234    HG2  GLU  31           1HG      GLU  31   9.082   9.414 -13.664
  235    HG3  GLU  31           2HG      GLU  31   8.235   8.455 -14.876
  236    H    ARG  32           H        ARG  32   8.908   6.423 -10.991
  237    HA   ARG  32           HA       ARG  32  11.240   6.306 -12.762
  238    HB2  ARG  32           1HB      ARG  32  11.041   6.288  -9.745
  239    HB3  ARG  32           2HB      ARG  32  12.546   6.196 -10.649
  240    HG2  ARG  32           1HG      ARG  32  11.992   8.402 -11.664
  241    HG3  ARG  32           2HG      ARG  32  10.606   8.493 -10.575
  242    HD2  ARG  32           1HD      ARG  32  12.392   9.721  -9.579
  243    HD3  ARG  32           2HD      ARG  32  12.193   8.227  -8.664
  244    HE   ARG  32           HE       ARG  32  14.321   7.662  -9.245
  245   HH11  ARG  32          2HH1      ARG  32  13.146  10.026 -11.514
  246   HH12  ARG  32          1HH1      ARG  32  14.659  10.171 -12.346
  247   HH21  ARG  32          2HH2      ARG  32  16.318   7.843 -10.333
  248   HH22  ARG  32          1HH2      ARG  32  16.463   8.929 -11.674
  249    H    CYS  33           H        CYS  33   9.877   4.406 -10.063
  250    HA   CYS  33           HA       CYS  33  11.263   2.035 -11.008
  251    HB2  CYS  33           1HB      CYS  33  10.241   0.980  -8.969
  252    HB3  CYS  33           2HB      CYS  33  11.278   2.362  -8.633
  253    H    SER  34           H        SER  34   8.212   3.507 -11.351
  254    HA   SER  34           HA       SER  34   6.273   2.881 -12.362
  255    HB2  SER  34           1HB      SER  34   6.426   1.483 -14.239
  256    HB3  SER  34           2HB      SER  34   8.061   2.122 -14.078
  257    HG   SER  34           HG       SER  34   7.370  -0.388 -14.159
  258    H    ARG  35           H        ARG  35   6.483   2.089  -9.753
  259    HA   ARG  35           HA       ARG  35   5.217  -0.573  -9.767
  260    HB2  ARG  35           1HB      ARG  35   7.029   0.718  -7.739
  261    HB3  ARG  35           2HB      ARG  35   5.971  -0.620  -7.312
  262    HG2  ARG  35           1HG      ARG  35   7.059  -2.028  -8.974
  263    HG3  ARG  35           2HG      ARG  35   8.104  -0.683  -9.436
  264    HD2  ARG  35           1HD      ARG  35   9.178  -0.679  -7.319
  265    HD3  ARG  35           2HD      ARG  35   7.978  -1.776  -6.636
  266    HE   ARG  35           HE       ARG  35   9.179  -3.092  -8.767
  267   HH11  ARG  35          2HH1      ARG  35  10.088  -1.802  -5.664
  268   HH12  ARG  35          1HH1      ARG  35  11.360  -2.951  -5.413
  269   HH21  ARG  35          2HH2      ARG  35  10.851  -4.611  -8.449
  270   HH22  ARG  35          1HH2      ARG  35  11.794  -4.548  -6.998
  271    H    ASN  36           H        ASN  36   3.514  -0.915  -8.220
  272    HA   ASN  36           HA       ASN  36   1.736   1.311  -8.052
  273    HB2  ASN  36           1HB      ASN  36   1.148  -1.185  -8.328
  274    HB3  ASN  36           2HB      ASN  36   1.365  -1.291  -6.583
  275   HD21  ASN  36          1HD2      ASN  36  -0.312   0.650  -9.028
  276   HD22  ASN  36          2HD2      ASN  36  -1.758   0.871  -8.108
  277    H    PHE  37           H        PHE  37   1.014   2.424  -6.250
  278    HA   PHE  37           HA       PHE  37   1.985   1.831  -3.616
  279    HB2  PHE  37           1HB      PHE  37   2.969   4.359  -4.957
  280    HB3  PHE  37           2HB      PHE  37   3.264   3.883  -3.287
  281    HD1  PHE  37           2HD      PHE  37   4.511   1.648  -2.931
  282    HD2  PHE  37           1HD      PHE  37   4.489   3.800  -6.603
  283    HE1  PHE  37           2HE      PHE  37   6.557   0.474  -3.627
  284    HE2  PHE  37           1HE      PHE  37   6.535   2.629  -7.306
  285    HZ   PHE  37           HZ       PHE  37   7.573   0.964  -5.817
  286    H    CYS  38           H        CYS  38   1.352   3.680  -2.072
  287    HA   CYS  38           HA       CYS  38  -1.368   4.485  -2.785
  288    HB2  CYS  38           1HB      CYS  38  -1.772   4.734  -0.441
  289    HB3  CYS  38           2HB      CYS  38  -0.897   3.222  -0.658
  290    H    ILE  39           H        ILE  39  -2.139   6.620  -2.319
  291    HA   ILE  39           HA       ILE  39  -0.857   8.702  -3.420
  292    HB   ILE  39           HB       ILE  39  -2.661   8.791  -1.006
  293   HG12  ILE  39          1HG1      ILE  39  -3.207   9.430  -3.911
  294   HG13  ILE  39          2HG1      ILE  39  -3.571   7.883  -3.153
  295   HG21  ILE  39          1HG2      ILE  39  -2.936  11.146  -1.349
  296   HG22  ILE  39          2HG2      ILE  39  -1.214  10.810  -1.173
  297   HG23  ILE  39          3HG2      ILE  39  -1.895  11.108  -2.772
  298   HD11  ILE  39          1HD1      ILE  39  -5.369   8.695  -2.052
  299   HD12  ILE  39          2HD1      ILE  39  -4.667  10.301  -1.858
  300   HD13  ILE  39          3HD1      ILE  39  -5.363   9.824  -3.406
  301    H    LYS  40           H        LYS  40  -0.480   7.674  -0.054
  302    HA   LYS  40           HA       LYS  40   1.234   9.774   0.737
  303    HB2  LYS  40           1HB      LYS  40   0.535   7.081   1.815
  304    HB3  LYS  40           2HB      LYS  40   1.953   7.894   2.464
  305    HG2  LYS  40           1HG      LYS  40   0.365   8.631   3.919
  306    HG3  LYS  40           2HG      LYS  40   0.280   9.909   2.705
  307    HD2  LYS  40           1HD      LYS  40  -1.957   9.294   3.170
  308    HD3  LYS  40           2HD      LYS  40  -1.565   8.566   1.610
  309    HE2  LYS  40           1HE      LYS  40  -2.557   6.786   2.651
  310    HE3  LYS  40           2HE      LYS  40  -0.877   6.519   3.112
  311    HZ1  LYS  40           1HZ      LYS  40  -1.632   6.484   5.188
  312    HZ2  LYS  40           2HZ      LYS  40  -3.139   7.121   4.758
  313    HZ3  LYS  40           3HZ      LYS  40  -1.838   8.158   5.060
  314    H    HIS  41           H        HIS  41   1.841   6.571  -0.620
  315    HA   HIS  41           HA       HIS  41   4.706   7.222  -0.768
  316    HB2  HIS  41           1HB      HIS  41   3.381   4.516  -1.029
  317    HB3  HIS  41           2HB      HIS  41   5.114   4.831  -0.990
  318    HD2  HIS  41           2HD      HIS  41   4.624   6.970   1.699
  319    HE1  HIS  41           1HE      HIS  41   3.764   3.257   3.562
  320    HE2  HIS  41           2HE      HIS  41   4.268   5.698   3.923
  321    H    ARG  42           H        ARG  42   2.497   8.092  -2.593
  322    HA   ARG  42           HA       ARG  42   2.981   6.665  -5.058
  323    HB2  ARG  42           1HB      ARG  42   0.813   7.430  -5.048
  324    HB3  ARG  42           2HB      ARG  42   1.226   8.910  -4.192
  325    HG2  ARG  42           1HG      ARG  42   0.552   9.470  -6.415
  326    HG3  ARG  42           2HG      ARG  42   2.288   9.754  -6.267
  327    HD2  ARG  42           1HD      ARG  42   2.398   7.263  -7.154
  328    HD3  ARG  42           2HD      ARG  42   0.818   7.682  -7.813
  329    HE   ARG  42           HE       ARG  42   3.390   8.732  -8.636
  330   HH11  ARG  42          2HH1      ARG  42  -0.075   9.059  -8.738
  331   HH12  ARG  42          1HH1      ARG  42  -0.072  10.023 -10.178
  332   HH21  ARG  42          2HH2      ARG  42   3.407  10.000 -10.532
  333   HH22  ARG  42          1HH2      ARG  42   1.909  10.557 -11.198
  334    H    HIS  43           H        HIS  43   4.111   9.555  -3.477
  335    HA   HIS  43           HA       HIS  43   5.366  10.636  -5.837
  336    HB2  HIS  43           1HB      HIS  43   4.494  11.837  -3.629
  337    HB3  HIS  43           2HB      HIS  43   6.148  11.539  -3.105
  338    HD1  HIS  43           1HD      HIS  43   8.017  12.877  -4.261
  339    HD2  HIS  43           2HD      HIS  43   4.209  13.730  -5.686
  340    HE1  HIS  43           1HE      HIS  43   8.270  14.957  -5.651
  341    HA   PRO  44           HA       PRO  44   9.119   8.342  -5.598
  342    HB2  PRO  44           1HB      PRO  44  10.714  10.017  -7.020
  343    HB3  PRO  44           2HB      PRO  44   9.478   9.001  -7.770
  344    HG2  PRO  44           1HG      PRO  44   9.361  11.903  -7.047
  345    HG3  PRO  44           2HG      PRO  44   8.791  11.093  -8.518
  346    HD2  PRO  44           1HD      PRO  44   7.123  11.805  -6.507
  347    HD3  PRO  44           2HD      PRO  44   6.845  10.371  -7.517
  348    H    LEU  45           H        LEU  45   8.506  11.088  -3.891
  349    HA   LEU  45           HA       LEU  45  11.203  11.105  -2.702
  350    HB2  LEU  45           1HB      LEU  45   9.244  13.387  -2.902
  351    HB3  LEU  45           2HB      LEU  45  10.793  13.443  -2.064
  352    HG   LEU  45           HG       LEU  45  10.489  12.978  -5.028
  353   HD11  LEU  45          1HD1      LEU  45  11.558  15.521  -3.952
  354   HD12  LEU  45          2HD1      LEU  45   9.812  15.285  -3.889
  355   HD13  LEU  45          3HD1      LEU  45  10.657  15.202  -5.435
  356   HD21  LEU  45          1HD2      LEU  45  12.744  12.891  -5.156
  357   HD22  LEU  45          2HD2      LEU  45  12.589  12.322  -3.494
  358   HD23  LEU  45          3HD2      LEU  45  12.975  14.013  -3.814
  359    H    ASP  46           H        ASP  46   8.482   9.718  -2.153
  360    HA   ASP  46           HA       ASP  46   8.400  10.394   0.715
  361    HB2  ASP  46           1HB      ASP  46   6.109   9.440  -1.017
  362    HB3  ASP  46           2HB      ASP  46   6.025   9.743   0.716
  363    H    HIS  47           H        HIS  47   8.556   7.932  -1.721
  364    HA   HIS  47           HA       HIS  47   8.608   5.855   0.366
  365    HB2  HIS  47           1HB      HIS  47   7.984   4.253  -1.307
  366    HB3  HIS  47           2HB      HIS  47   6.883   5.621  -1.442
  367    HD1  HIS  47           1HD      HIS  47   6.852   6.883  -3.636
  368    HD2  HIS  47           2HD      HIS  47   9.881   4.047  -3.434
  369    HE1  HIS  47           1HE      HIS  47   7.787   6.731  -5.966
  370    H    ASP  48           H        ASP  48  10.836   7.584  -0.242
  371    HA   ASP  48           HA       ASP  48  13.027   7.557  -0.970
  372    HB2  ASP  48           1HB      ASP  48  12.782   6.176   1.210
  373    HB3  ASP  48           2HB      ASP  48  13.060   4.777   0.175
  374    H    CYS  49           H        CYS  49  11.472   6.932  -3.133
  375    HA   CYS  49           HA       CYS  49  11.631   4.660  -4.527
  376    HB2  CYS  49           1HB      CYS  49  10.792   6.856  -5.395
  377    HB3  CYS  49           2HB      CYS  49  12.461   7.309  -5.727
  378    H    SER  50           H        SER  50  13.092   3.590  -5.902
  379    HA   SER  50           HA       SER  50  15.923   4.139  -5.292
  380    HB2  SER  50           1HB      SER  50  14.440   1.558  -5.746
  381    HB3  SER  50           2HB      SER  50  16.190   1.651  -5.942
  382    HG   SER  50           HG       SER  50  15.644   1.035  -3.827
  383    H    GLY  51           H        GLY  51  13.671   3.086  -7.817
  384    HA2  GLY  51           1HA      GLY  51  13.797   3.886 -10.053
  385    HA3  GLY  51           2HA      GLY  51  15.508   4.205  -9.812
  386    H    GLU  52           H        GLU  52  13.171   1.979 -10.923
  387    HA   GLU  52           HA       GLU  52  14.439  -0.465 -10.791
  388    HB2  GLU  52           1HB      GLU  52  12.136   0.075 -11.733
  389    HB3  GLU  52           2HB      GLU  52  12.952   0.484 -13.235
  390    HG2  GLU  52           1HG      GLU  52  13.438  -2.171 -11.971
  391    HG3  GLU  52           2HG      GLU  52  11.955  -1.891 -12.882
  392    H    GLY  53           H        GLY  53  16.475  -0.930 -11.300
  393    HA2  GLY  53           1HA      GLY  53  17.655   0.357 -13.678
  394    HA3  GLY  53           2HA      GLY  53  18.571  -0.250 -12.306
  395    H    HIS  54           H        HIS  54  19.503  -1.046 -14.623
  396    HA   HIS  54           HA       HIS  54  18.579  -3.064 -16.115
  397    HB2  HIS  54           1HB      HIS  54  21.317  -3.031 -14.826
  398    HB3  HIS  54           2HB      HIS  54  20.870  -3.975 -16.243
  399    HD1  HIS  54           1HD      HIS  54  21.953  -0.616 -15.187
  400    HD2  HIS  54           2HD      HIS  54  20.384  -2.403 -18.594
  401    HE1  HIS  54           1HE      HIS  54  22.346   1.027 -17.050
  402    HA   PRO  55           HA       PRO  55  17.443  -6.467 -13.573
  403    HB2  PRO  55           1HB      PRO  55  17.703  -8.484 -15.371
  404    HB3  PRO  55           2HB      PRO  55  16.382  -7.311 -15.427
  405    HG2  PRO  55           1HG      PRO  55  18.921  -7.380 -17.011
  406    HG3  PRO  55           2HG      PRO  55  17.273  -7.020 -17.555
  407    HD2  PRO  55           1HD      PRO  55  19.098  -5.083 -17.058
  408    HD3  PRO  55           2HD      PRO  55  17.359  -4.848 -16.789
  409    H    THR  56           H        THR  56  18.238  -8.569 -12.776
  410    HA   THR  56           HA       THR  56  20.998  -8.423 -12.093
  411    HB   THR  56           HB       THR  56  19.049 -10.695 -11.654
  412    HG1  THR  56           1HG      THR  56  18.564  -8.566 -10.685
  413   HG21  THR  56          1HG2      THR  56  20.591 -11.725 -10.325
  414   HG22  THR  56          2HG2      THR  56  21.378 -10.211  -9.877
  415   HG23  THR  56          3HG2      THR  56  21.696 -10.938 -11.451
  416    H    SER  57           H        SER  57  22.620  -8.998 -13.369
  417    HA   SER  57           HA       SER  57  22.199 -10.802 -15.592
  418    HB2  SER  57           1HB      SER  57  24.683  -9.339 -14.665
  419    HB3  SER  57           2HB      SER  57  24.553 -10.268 -16.158
  420    HG   SER  57           HG       SER  57  22.753  -8.804 -16.669
  421    H    SER  58           H        SER  58  24.425 -10.687 -12.809
  422    HA   SER  58           HA       SER  58  25.221 -13.427 -13.201
  423    HB2  SER  58           1HB      SER  58  25.910 -11.270 -11.240
  424    HB3  SER  58           2HB      SER  58  26.319 -12.943 -10.861
  425    HG   SER  58           HG       SER  58  28.052 -12.194 -11.948
  426    H    GLY  59           H        GLY  59  23.806 -14.990 -12.746
  427    HA2  GLY  59           1HA      GLY  59  22.683 -15.093 -10.055
  428    HA3  GLY  59           2HA      GLY  59  21.532 -15.083 -11.383
  429    HA   PRO  60           HA       PRO  60  23.913 -19.304 -10.854
  430    HB2  PRO  60           1HB      PRO  60  23.338 -20.224  -8.365
  431    HB3  PRO  60           2HB      PRO  60  24.796 -19.294  -8.733
  432    HG2  PRO  60           1HG      PRO  60  22.217 -18.374  -7.523
  433    HG3  PRO  60           2HG      PRO  60  23.879 -17.966  -7.058
  434    HD2  PRO  60           1HD      PRO  60  22.333 -16.311  -8.543
  435    HD3  PRO  60           2HD      PRO  60  24.096 -16.399  -8.734
  436    H    SER  61           H        SER  61  22.392 -20.109 -12.254
  437    HA   SER  61           HA       SER  61  19.646 -20.455 -11.518
  438    HB2  SER  61           1HB      SER  61  19.464 -21.637 -13.695
  439    HB3  SER  61           2HB      SER  61  20.238 -20.060 -13.848
  440    HG   SER  61           HG       SER  61  21.510 -22.596 -13.785
  441    H    SER  62           H        SER  62  19.818 -21.711  -9.600
  442    HA   SER  62           HA       SER  62  21.115 -24.171  -9.373
  443    HB2  SER  62           1HB      SER  62  20.026 -22.751  -7.532
  444    HB3  SER  62           2HB      SER  62  18.515 -23.542  -7.981
  445    HG   SER  62           HG       SER  62  19.377 -24.787  -6.396
  446    H    GLY  63           H        GLY  63  20.032 -26.319  -9.121
  447    HA2  GLY  63           1HA      GLY  63  17.688 -26.686 -10.835
  448    HA3  GLY  63           2HA      GLY  63  19.171 -27.501 -11.305
  Start of MODEL   14
    1    H1   GLY   1           H        GLY   1   2.187 -31.191  -5.106
    2    HA2  GLY   1           1HA      GLY   1  -0.724 -30.716  -5.187
    3    HA3  GLY   1           2HA      GLY   1   0.242 -30.141  -3.836
    4    H    SER   2           H        SER   2  -1.393 -28.628  -5.734
    5    HA   SER   2           HA       SER   2   0.707 -26.985  -6.990
    6    HB2  SER   2           1HB      SER   2  -2.203 -27.331  -7.745
    7    HB3  SER   2           2HB      SER   2  -1.128 -26.140  -8.478
    8    HG   SER   2           HG       SER   2  -0.272 -27.663  -9.644
    9    H    SER   3           H        SER   3   0.798 -24.823  -6.573
   10    HA   SER   3           HA       SER   3  -1.055 -23.817  -4.515
   11    HB2  SER   3           1HB      SER   3   1.532 -24.099  -4.086
   12    HB3  SER   3           2HB      SER   3   1.632 -22.576  -4.970
   13    HG   SER   3           HG       SER   3  -0.244 -22.109  -3.322
   14    H    GLY   4           H        GLY   4  -2.551 -23.064  -6.081
   15    HA2  GLY   4           1HA      GLY   4  -1.588 -20.800  -7.713
   16    HA3  GLY   4           2HA      GLY   4  -2.995 -21.779  -8.099
   17    H    SER   5           H        SER   5  -4.501 -20.167  -8.159
   18    HA   SER   5           HA       SER   5  -6.088 -18.755  -7.339
   19    HB2  SER   5           1HB      SER   5  -6.149 -20.496  -5.483
   20    HB3  SER   5           2HB      SER   5  -5.095 -19.421  -4.565
   21    HG   SER   5           HG       SER   5  -7.192 -18.947  -4.005
   22    H    SER   6           H        SER   6  -3.665 -17.679  -8.150
   23    HA   SER   6           HA       SER   6  -3.143 -15.550  -6.188
   24    HB2  SER   6           1HB      SER   6  -1.006 -15.247  -7.171
   25    HB3  SER   6           2HB      SER   6  -1.224 -16.994  -7.067
   26    HG   SER   6           HG       SER   6  -2.089 -16.702  -9.328
   27    H    GLY   7           H        GLY   7  -3.768 -13.527  -6.605
   28    HA2  GLY   7           1HA      GLY   7  -3.796 -12.268  -9.093
   29    HA3  GLY   7           2HA      GLY   7  -5.404 -12.926  -8.831
   30    H    ARG   8           H        ARG   8  -5.109 -10.238  -9.123
   31    HA   ARG   8           HA       ARG   8  -5.540  -9.241  -6.384
   32    HB2  ARG   8           1HB      ARG   8  -4.126  -7.976  -8.710
   33    HB3  ARG   8           2HB      ARG   8  -4.859  -6.976  -7.464
   34    HG2  ARG   8           1HG      ARG   8  -3.441  -7.869  -5.787
   35    HG3  ARG   8           2HG      ARG   8  -2.864  -9.141  -6.865
   36    HD2  ARG   8           1HD      ARG   8  -2.474  -6.246  -7.535
   37    HD3  ARG   8           2HD      ARG   8  -1.361  -7.087  -6.457
   38    HE   ARG   8           HE       ARG   8  -1.780  -8.498  -8.905
   39   HH11  ARG   8          2HH1      ARG   8  -0.022  -5.881  -7.429
   40   HH12  ARG   8          1HH1      ARG   8   1.294  -5.958  -8.553
   41   HH21  ARG   8          2HH2      ARG   8  -0.053  -8.609 -10.392
   42   HH22  ARG   8          1HH2      ARG   8   1.275  -7.509 -10.239
   43    H    LYS   9           H        LYS   9  -6.972  -7.310  -6.290
   44    HA   LYS   9           HA       LYS   9  -9.219  -7.676  -8.139
   45    HB2  LYS   9           1HB      LYS   9  -8.968  -6.740  -5.315
   46    HB3  LYS   9           2HB      LYS   9 -10.311  -6.139  -6.278
   47    HG2  LYS   9           1HG      LYS   9 -11.134  -8.014  -5.132
   48    HG3  LYS   9           2HG      LYS   9 -10.854  -8.557  -6.788
   49    HD2  LYS   9           1HD      LYS   9  -9.982 -10.272  -5.446
   50    HD3  LYS   9           2HD      LYS   9  -8.569  -9.344  -5.956
   51    HE2  LYS   9           1HE      LYS   9  -9.903  -8.579  -3.413
   52    HE3  LYS   9           2HE      LYS   9  -8.949 -10.061  -3.431
   53    HZ1  LYS   9           1HZ      LYS   9  -7.233  -8.453  -4.593
   54    HZ2  LYS   9           2HZ      LYS   9  -7.333  -8.580  -2.909
   55    HZ3  LYS   9           3HZ      LYS   9  -8.078  -7.287  -3.705
   56    H    ILE  10           H        ILE  10  -9.870  -6.114  -9.496
   57    HA   ILE  10           HA       ILE  10  -8.214  -3.924 -10.083
   58    HB   ILE  10           HB       ILE  10 -11.106  -4.345 -10.847
   59   HG12  ILE  10          1HG1      ILE  10  -8.654  -4.884 -12.519
   60   HG13  ILE  10          2HG1      ILE  10  -9.386  -6.119 -11.501
   61   HG21  ILE  10          1HG2      ILE  10  -9.926  -2.894 -12.849
   62   HG22  ILE  10          2HG2      ILE  10 -10.961  -2.239 -11.581
   63   HG23  ILE  10          3HG2      ILE  10  -9.208  -2.200 -11.395
   64   HD11  ILE  10          1HD1      ILE  10 -10.685  -4.685 -13.804
   65   HD12  ILE  10          2HD1      ILE  10 -10.157  -6.368 -13.759
   66   HD13  ILE  10          3HD1      ILE  10 -11.496  -5.837 -12.743
   67    H    PHE  11           H        PHE  11 -11.256  -4.138  -8.281
   68    HA   PHE  11           HA       PHE  11 -12.055  -1.630  -7.874
   69    HB2  PHE  11           1HB      PHE  11 -11.595  -3.629  -5.650
   70    HB3  PHE  11           2HB      PHE  11 -12.639  -2.216  -5.543
   71    HD1  PHE  11           1HD      PHE  11 -14.765  -2.147  -6.699
   72    HD2  PHE  11           2HD      PHE  11 -12.247  -5.571  -6.921
   73    HE1  PHE  11           1HE      PHE  11 -16.643  -3.466  -7.585
   74    HE2  PHE  11           2HE      PHE  11 -14.121  -6.896  -7.809
   75    HZ   PHE  11           HZ       PHE  11 -16.322  -5.843  -8.143
   76    H    THR  12           H        THR  12  -9.575  -3.020  -5.717
   77    HA   THR  12           HA       THR  12  -8.271  -0.387  -5.640
   78    HB   THR  12           HB       THR  12  -7.805  -0.768  -3.198
   79    HG1  THR  12           1HG      THR  12  -9.678  -2.239  -2.370
   80   HG21  THR  12          1HG2      THR  12 -10.562  -0.293  -4.269
   81   HG22  THR  12          2HG2      THR  12  -9.423   0.857  -3.569
   82   HG23  THR  12          3HG2      THR  12 -10.272  -0.288  -2.530
   83    H    ASN  13           H        ASN  13  -6.026  -0.436  -5.048
   84    HA   ASN  13           HA       ASN  13  -4.775  -3.062  -5.523
   85    HB2  ASN  13           1HB      ASN  13  -3.446  -0.429  -6.130
   86    HB3  ASN  13           2HB      ASN  13  -3.040  -2.029  -6.742
   87   HD21  ASN  13          1HD2      ASN  13  -5.272   0.641  -6.958
   88   HD22  ASN  13          2HD2      ASN  13  -5.939   0.214  -8.494
   89    H    LYS  14           H        LYS  14  -2.888  -3.577  -4.365
   90    HA   LYS  14           HA       LYS  14  -2.737  -2.279  -1.762
   91    HB2  LYS  14           1HB      LYS  14  -2.858  -4.667  -1.690
   92    HB3  LYS  14           2HB      LYS  14  -1.554  -4.830  -2.859
   93    HG2  LYS  14           1HG      LYS  14  -0.188  -3.538  -1.019
   94    HG3  LYS  14           2HG      LYS  14  -1.437  -4.195   0.042
   95    HD2  LYS  14           1HD      LYS  14   0.223  -5.826   0.094
   96    HD3  LYS  14           2HD      LYS  14  -0.914  -6.446  -1.105
   97    HE2  LYS  14           1HE      LYS  14   1.423  -4.755  -1.920
   98    HE3  LYS  14           2HE      LYS  14   1.612  -6.486  -1.642
   99    HZ1  LYS  14           1HZ      LYS  14  -0.493  -6.522  -3.228
  100    HZ2  LYS  14           2HZ      LYS  14   1.089  -6.540  -3.826
  101    HZ3  LYS  14           3HZ      LYS  14   0.216  -5.091  -3.787
  102    H    CYS  15           H        CYS  15  -1.084  -1.053  -1.068
  103    HA   CYS  15           HA       CYS  15   0.727   0.084  -2.882
  104    HB2  CYS  15           1HB      CYS  15  -0.066   1.078  -0.696
  105    HB3  CYS  15           2HB      CYS  15   1.065   0.002   0.118
  106    H    GLU  16           H        GLU  16   3.087   0.015  -2.795
  107    HA   GLU  16           HA       GLU  16   4.047  -2.713  -2.243
  108    HB2  GLU  16           1HB      GLU  16   5.021  -0.668  -4.243
  109    HB3  GLU  16           2HB      GLU  16   5.820  -2.203  -3.929
  110    HG2  GLU  16           1HG      GLU  16   3.401  -3.142  -4.459
  111    HG3  GLU  16           2HG      GLU  16   3.293  -1.634  -5.365
  112    H    ARG  17           H        ARG  17   4.320   0.537  -1.325
  113    HA   ARG  17           HA       ARG  17   6.957   0.888  -0.625
  114    HB2  ARG  17           1HB      ARG  17   4.795   2.393  -0.309
  115    HB3  ARG  17           2HB      ARG  17   4.872   1.751   1.326
  116    HG2  ARG  17           1HG      ARG  17   7.385   2.832   0.214
  117    HG3  ARG  17           2HG      ARG  17   6.106   3.993   0.573
  118    HD2  ARG  17           1HD      ARG  17   5.965   2.743   2.844
  119    HD3  ARG  17           2HD      ARG  17   7.573   2.155   2.423
  120    HE   ARG  17           HE       ARG  17   7.888   4.774   2.088
  121   HH11  ARG  17          2HH1      ARG  17   6.376   2.986   4.665
  122   HH12  ARG  17          1HH1      ARG  17   6.759   4.160   5.880
  123   HH21  ARG  17          2HH2      ARG  17   8.397   6.328   3.679
  124   HH22  ARG  17          1HH2      ARG  17   7.907   6.061   5.318
  125    H    ALA  18           H        ALA  18   8.240   0.376   1.123
  126    HA   ALA  18           HA       ALA  18   7.888  -2.122   2.329
  127    HB1  ALA  18           1HB      ALA  18   9.601  -0.181   3.748
  128    HB2  ALA  18           2HB      ALA  18   9.955  -1.817   3.189
  129    HB3  ALA  18           3HB      ALA  18   9.984  -0.470   2.051
  130    H    GLY  19           H        GLY  19   6.732  -2.777   4.022
  131    HA2  GLY  19           1HA      GLY  19   5.520  -2.743   5.975
  132    HA3  GLY  19           2HA      GLY  19   6.362  -1.255   6.383
  133    H    CYS  20           H        CYS  20   4.379  -1.721   3.517
  134    HA   CYS  20           HA       CYS  20   2.323   0.022   4.695
  135    HB2  CYS  20           1HB      CYS  20   3.932   1.232   3.129
  136    HB3  CYS  20           2HB      CYS  20   3.241   0.263   1.831
  137    H    ARG  21           H        ARG  21   0.256  -0.546   4.290
  138    HA   ARG  21           HA       ARG  21  -0.254  -2.597   2.250
  139    HB2  ARG  21           1HB      ARG  21  -1.804  -3.732   3.818
  140    HB3  ARG  21           2HB      ARG  21  -0.129  -3.787   4.350
  141    HG2  ARG  21           1HG      ARG  21  -0.688  -1.761   5.786
  142    HG3  ARG  21           2HG      ARG  21  -2.378  -2.132   5.439
  143    HD2  ARG  21           1HD      ARG  21  -2.279  -4.182   6.552
  144    HD3  ARG  21           2HD      ARG  21  -0.517  -4.230   6.495
  145    HE   ARG  21           HE       ARG  21  -0.985  -2.070   8.024
  146   HH11  ARG  21          2HH1      ARG  21  -2.211  -5.326   8.126
  147   HH12  ARG  21          1HH1      ARG  21  -2.428  -5.329   9.845
  148   HH21  ARG  21          2HH2      ARG  21  -1.265  -2.062  10.287
  149   HH22  ARG  21          1HH2      ARG  21  -1.890  -3.472  11.073
  150    H    GLN  22           H        GLN  22  -0.687   0.283   2.265
  151    HA   GLN  22           HA       GLN  22  -3.423   0.856   2.756
  152    HB2  GLN  22           1HB      GLN  22  -1.210   2.233   1.281
  153    HB3  GLN  22           2HB      GLN  22  -2.861   2.815   1.113
  154    HG2  GLN  22           1HG      GLN  22  -1.327   3.862   2.899
  155    HG3  GLN  22           2HG      GLN  22  -2.996   3.478   3.314
  156   HE21  GLN  22          1HE2      GLN  22  -3.401   1.552   4.529
  157   HE22  GLN  22          2HE2      GLN  22  -2.186   0.920   5.583
  158    H    ARG  23           H        ARG  23  -5.166   0.945   1.378
  159    HA   ARG  23           HA       ARG  23  -4.789  -0.350  -1.243
  160    HB2  ARG  23           1HB      ARG  23  -7.103  -0.520   0.689
  161    HB3  ARG  23           2HB      ARG  23  -7.185  -1.095  -0.971
  162    HG2  ARG  23           1HG      ARG  23  -5.125  -2.074   0.983
  163    HG3  ARG  23           2HG      ARG  23  -6.711  -2.827   0.800
  164    HD2  ARG  23           1HD      ARG  23  -4.795  -2.409  -1.485
  165    HD3  ARG  23           2HD      ARG  23  -4.847  -3.884  -0.521
  166    HE   ARG  23           HE       ARG  23  -6.755  -3.035  -2.516
  167   HH11  ARG  23          2HH1      ARG  23  -6.139  -5.103   0.216
  168   HH12  ARG  23          1HH1      ARG  23  -7.379  -6.240  -0.200
  169   HH21  ARG  23          2HH2      ARG  23  -8.390  -4.524  -3.074
  170   HH22  ARG  23          1HH2      ARG  23  -8.658  -5.910  -2.072
  171    H    GLU  24           H        GLU  24  -5.080   0.997  -2.883
  172    HA   GLU  24           HA       GLU  24  -6.927   3.264  -2.537
  173    HB2  GLU  24           1HB      GLU  24  -4.502   2.943  -4.306
  174    HB3  GLU  24           2HB      GLU  24  -5.635   4.278  -4.456
  175    HG2  GLU  24           1HG      GLU  24  -3.486   4.628  -3.100
  176    HG3  GLU  24           2HG      GLU  24  -5.010   5.211  -2.435
  177    H    MET  25           H        MET  25  -8.564   3.588  -3.963
  178    HA   MET  25           HA       MET  25  -9.486   1.398  -5.491
  179    HB2  MET  25           1HB      MET  25 -11.240   2.955  -6.272
  180    HB3  MET  25           2HB      MET  25 -11.043   2.986  -4.525
  181    HG2  MET  25           1HG      MET  25  -9.581   5.014  -4.850
  182    HG3  MET  25           2HG      MET  25 -10.128   5.028  -6.525
  183    HE1  MET  25           1HE      MET  25 -11.605   7.987  -4.664
  184    HE2  MET  25           2HE      MET  25 -11.299   7.062  -3.194
  185    HE3  MET  25           3HE      MET  25 -10.081   7.120  -4.469
  186    H    MET  26           H        MET  26  -7.768   4.357  -6.326
  187    HA   MET  26           HA       MET  26  -7.799   3.616  -9.157
  188    HB2  MET  26           1HB      MET  26  -7.069   5.825  -9.632
  189    HB3  MET  26           2HB      MET  26  -8.309   5.974  -8.394
  190    HG2  MET  26           1HG      MET  26  -6.770   6.507  -6.738
  191    HG3  MET  26           2HG      MET  26  -5.414   5.857  -7.657
  192    HE1  MET  26           1HE      MET  26  -4.643   8.815  -6.570
  193    HE2  MET  26           2HE      MET  26  -5.867  10.003  -7.018
  194    HE3  MET  26           3HE      MET  26  -6.320   8.582  -6.076
  195    H    LYS  27           H        LYS  27  -5.960   3.158 -10.321
  196    HA   LYS  27           HA       LYS  27  -3.780   2.029  -8.866
  197    HB2  LYS  27           1HB      LYS  27  -4.807   1.436 -11.234
  198    HB3  LYS  27           2HB      LYS  27  -3.587   2.571 -11.795
  199    HG2  LYS  27           1HG      LYS  27  -1.830   1.247 -10.853
  200    HG3  LYS  27           2HG      LYS  27  -2.995   0.176 -10.071
  201    HD2  LYS  27           1HD      LYS  27  -3.842  -0.097 -12.574
  202    HD3  LYS  27           2HD      LYS  27  -2.167   0.338 -12.920
  203    HE2  LYS  27           1HE      LYS  27  -2.807  -1.789 -10.912
  204    HE3  LYS  27           2HE      LYS  27  -2.799  -2.159 -12.635
  205    HZ1  LYS  27           1HZ      LYS  27  -0.626  -2.472 -12.385
  206    HZ2  LYS  27           2HZ      LYS  27  -0.597  -1.752 -10.855
  207    HZ3  LYS  27           3HZ      LYS  27  -0.476  -0.793 -12.243
  208    H    LEU  28           H        LEU  28  -1.906   2.922  -8.283
  209    HA   LEU  28           HA       LEU  28  -1.100   5.453  -9.550
  210    HB2  LEU  28           1HB      LEU  28  -0.954   4.788  -6.613
  211    HB3  LEU  28           2HB      LEU  28  -0.308   6.245  -7.365
  212    HG   LEU  28           HG       LEU  28  -3.214   5.655  -7.662
  213   HD11  LEU  28          1HD1      LEU  28  -3.707   6.743  -5.547
  214   HD12  LEU  28          2HD1      LEU  28  -1.985   6.854  -5.184
  215   HD13  LEU  28          3HD1      LEU  28  -2.765   5.275  -5.284
  216   HD21  LEU  28          1HD2      LEU  28  -1.906   8.287  -7.093
  217   HD22  LEU  28          2HD2      LEU  28  -3.410   7.949  -7.950
  218   HD23  LEU  28          3HD2      LEU  28  -1.860   7.590  -8.713
  219    H    THR  29           H        THR  29   0.476   4.528 -10.815
  220    HA   THR  29           HA       THR  29   2.582   2.991  -9.466
  221    HB   THR  29           HB       THR  29   2.141   3.364 -12.434
  222    HG1  THR  29           1HG      THR  29   1.199   1.332 -12.363
  223   HG21  THR  29          1HG2      THR  29   3.888   1.402 -10.943
  224   HG22  THR  29          2HG2      THR  29   4.467   2.847 -11.772
  225   HG23  THR  29          3HG2      THR  29   3.720   1.541 -12.692
  226    H    CYS  30           H        CYS  30   4.576   3.787  -9.184
  227    HA   CYS  30           HA       CYS  30   5.148   6.492  -9.382
  228    HB2  CYS  30           1HB      CYS  30   6.366   4.603  -8.082
  229    HB3  CYS  30           2HB      CYS  30   7.319   4.421  -9.551
  230    H    GLU  31           H        GLU  31   7.036   7.421 -10.659
  231    HA   GLU  31           HA       GLU  31   6.698   6.657 -13.479
  232    HB2  GLU  31           1HB      GLU  31   7.143   8.903 -14.083
  233    HB3  GLU  31           2HB      GLU  31   6.032   8.982 -12.723
  234    HG2  GLU  31           1HG      GLU  31   8.941   9.099 -12.155
  235    HG3  GLU  31           2HG      GLU  31   8.172  10.513 -12.872
  236    H    ARG  32           H        ARG  32   8.879   6.547 -10.934
  237    HA   ARG  32           HA       ARG  32  11.214   6.549 -12.716
  238    HB2  ARG  32           1HB      ARG  32  11.024   6.663  -9.701
  239    HB3  ARG  32           2HB      ARG  32  12.534   6.588 -10.599
  240    HG2  ARG  32           1HG      ARG  32  12.162   8.726 -11.566
  241    HG3  ARG  32           2HG      ARG  32  10.505   8.776 -10.962
  242    HD2  ARG  32           1HD      ARG  32  11.397   8.753  -8.651
  243    HD3  ARG  32           2HD      ARG  32  13.029   8.827  -9.313
  244    HE   ARG  32           HE       ARG  32  11.419  10.948 -10.302
  245   HH11  ARG  32          2HH1      ARG  32  13.198   9.888  -7.503
  246   HH12  ARG  32          1HH1      ARG  32  13.500  11.493  -6.926
  247   HH21  ARG  32          2HH2      ARG  32  11.810  13.066  -9.551
  248   HH22  ARG  32          1HH2      ARG  32  12.709  13.300  -8.091
  249    H    CYS  33           H        CYS  33   9.943   4.679  -9.953
  250    HA   CYS  33           HA       CYS  33  11.514   2.373 -10.726
  251    HB2  CYS  33           1HB      CYS  33  10.355   1.320  -8.734
  252    HB3  CYS  33           2HB      CYS  33  11.347   2.731  -8.380
  253    H    SER  34           H        SER  34   8.283   3.547 -11.112
  254    HA   SER  34           HA       SER  34   6.532   2.780 -12.354
  255    HB2  SER  34           1HB      SER  34   8.318   0.486 -13.189
  256    HB3  SER  34           2HB      SER  34   6.884   1.084 -14.023
  257    HG   SER  34           HG       SER  34   8.043   2.601 -14.906
  258    H    ARG  35           H        ARG  35   6.790   2.089  -9.628
  259    HA   ARG  35           HA       ARG  35   5.542  -0.580  -9.569
  260    HB2  ARG  35           1HB      ARG  35   7.233   0.863  -7.539
  261    HB3  ARG  35           2HB      ARG  35   6.196  -0.483  -7.087
  262    HG2  ARG  35           1HG      ARG  35   7.396  -1.852  -8.818
  263    HG3  ARG  35           2HG      ARG  35   8.537  -0.515  -8.970
  264    HD2  ARG  35           1HD      ARG  35   7.976  -1.483  -6.232
  265    HD3  ARG  35           2HD      ARG  35   8.889  -2.566  -7.281
  266    HE   ARG  35           HE       ARG  35  10.224  -0.279  -7.599
  267   HH11  ARG  35          2HH1      ARG  35   9.069  -1.873  -4.728
  268   HH12  ARG  35          1HH1      ARG  35  10.339  -1.262  -3.721
  269   HH21  ARG  35          2HH2      ARG  35  11.901   0.531  -6.283
  270   HH22  ARG  35          1HH2      ARG  35  11.949   0.106  -4.606
  271    H    ASN  36           H        ASN  36   3.815  -0.893  -8.016
  272    HA   ASN  36           HA       ASN  36   1.976   1.308  -8.032
  273    HB2  ASN  36           1HB      ASN  36   1.228  -1.022  -8.365
  274    HB3  ASN  36           2HB      ASN  36   1.729  -1.410  -6.722
  275   HD21  ASN  36          1HD2      ASN  36  -0.278   0.940  -8.464
  276   HD22  ASN  36          2HD2      ASN  36  -1.564   0.952  -7.310
  277    H    PHE  37           H        PHE  37   1.130   2.426  -6.281
  278    HA   PHE  37           HA       PHE  37   2.004   1.915  -3.597
  279    HB2  PHE  37           1HB      PHE  37   2.971   4.448  -4.939
  280    HB3  PHE  37           2HB      PHE  37   3.218   3.999  -3.255
  281    HD1  PHE  37           2HD      PHE  37   4.555   1.866  -2.793
  282    HD2  PHE  37           1HD      PHE  37   4.522   3.854  -6.556
  283    HE1  PHE  37           2HE      PHE  37   6.657   0.742  -3.401
  284    HE2  PHE  37           1HE      PHE  37   6.624   2.732  -7.171
  285    HZ   PHE  37           HZ       PHE  37   7.695   1.175  -5.592
  286    H    CYS  38           H        CYS  38   1.270   3.804  -2.130
  287    HA   CYS  38           HA       CYS  38  -1.438   4.520  -2.979
  288    HB2  CYS  38           1HB      CYS  38  -1.940   4.827  -0.642
  289    HB3  CYS  38           2HB      CYS  38  -1.098   3.293  -0.829
  290    H    ILE  39           H        ILE  39  -2.259   6.629  -2.742
  291    HA   ILE  39           HA       ILE  39  -0.938   8.720  -3.739
  292    HB   ILE  39           HB       ILE  39  -2.997   8.748  -1.546
  293   HG12  ILE  39          1HG1      ILE  39  -3.146   9.556  -4.458
  294   HG13  ILE  39          2HG1      ILE  39  -3.620   7.978  -3.839
  295   HG21  ILE  39          1HG2      ILE  39  -1.899  11.141  -3.016
  296   HG22  ILE  39          2HG2      ILE  39  -3.257  11.146  -1.892
  297   HG23  ILE  39          3HG2      ILE  39  -1.635  10.766  -1.313
  298   HD11  ILE  39          1HD1      ILE  39  -4.885  10.634  -3.229
  299   HD12  ILE  39          2HD1      ILE  39  -5.583   9.284  -4.124
  300   HD13  ILE  39          3HD1      ILE  39  -5.286   9.135  -2.393
  301    H    LYS  40           H        LYS  40  -0.805   7.746  -0.343
  302    HA   LYS  40           HA       LYS  40   0.738   9.907   0.591
  303    HB2  LYS  40           1HB      LYS  40   0.088   7.173   1.571
  304    HB3  LYS  40           2HB      LYS  40   1.458   7.993   2.310
  305    HG2  LYS  40           1HG      LYS  40  -0.179   8.698   3.708
  306    HG3  LYS  40           2HG      LYS  40  -0.299   9.969   2.488
  307    HD2  LYS  40           1HD      LYS  40  -2.513   9.231   2.929
  308    HD3  LYS  40           2HD      LYS  40  -2.059   8.563   1.359
  309    HE2  LYS  40           1HE      LYS  40  -2.923   6.682   2.299
  310    HE3  LYS  40           2HE      LYS  40  -1.268   6.538   2.887
  311    HZ1  LYS  40           1HZ      LYS  40  -2.821   6.172   4.673
  312    HZ2  LYS  40           2HZ      LYS  40  -3.570   7.662   4.390
  313    HZ3  LYS  40           3HZ      LYS  40  -1.977   7.611   4.956
  314    H    HIS  41           H        HIS  41   1.673   6.695  -0.596
  315    HA   HIS  41           HA       HIS  41   4.477   7.574  -0.624
  316    HB2  HIS  41           1HB      HIS  41   3.325   4.784  -0.833
  317    HB3  HIS  41           2HB      HIS  41   5.041   5.183  -0.826
  318    HD2  HIS  41           2HD      HIS  41   4.717   7.336   1.779
  319    HE1  HIS  41           1HE      HIS  41   3.633   3.767   3.801
  320    HE2  HIS  41           2HE      HIS  41   4.317   6.178   4.057
  321    H    ARG  42           H        ARG  42   2.222   8.109  -2.609
  322    HA   ARG  42           HA       ARG  42   2.886   6.696  -4.991
  323    HB2  ARG  42           1HB      ARG  42   0.761   7.540  -5.148
  324    HB3  ARG  42           2HB      ARG  42   1.167   9.015  -4.281
  325    HG2  ARG  42           1HG      ARG  42   0.705   9.682  -6.480
  326    HG3  ARG  42           2HG      ARG  42   2.465   9.703  -6.345
  327    HD2  ARG  42           1HD      ARG  42   2.160   7.203  -7.206
  328    HD3  ARG  42           2HD      ARG  42   0.691   7.897  -7.892
  329    HE   ARG  42           HE       ARG  42   3.177   9.315  -8.410
  330   HH11  ARG  42          2HH1      ARG  42   0.744   7.099  -9.543
  331   HH12  ARG  42          1HH1      ARG  42   1.161   7.291 -11.214
  332   HH21  ARG  42          2HH2      ARG  42   3.736   9.577 -10.606
  333   HH22  ARG  42          1HH2      ARG  42   2.863   8.700 -11.817
  334    H    HIS  43           H        HIS  43   4.025   9.625  -3.476
  335    HA   HIS  43           HA       HIS  43   5.499  10.479  -5.819
  336    HB2  HIS  43           1HB      HIS  43   4.421  11.902  -3.830
  337    HB3  HIS  43           2HB      HIS  43   6.029  11.677  -3.147
  338    HD1  HIS  43           1HD      HIS  43   7.944  12.994  -4.184
  339    HD2  HIS  43           2HD      HIS  43   4.342  13.462  -6.201
  340    HE1  HIS  43           1HE      HIS  43   8.316  14.889  -5.795
  341    HA   PRO  44           HA       PRO  44   9.178   8.224  -4.944
  342    HB2  PRO  44           1HB      PRO  44  10.946   9.757  -6.321
  343    HB3  PRO  44           2HB      PRO  44   9.789   8.679  -7.112
  344    HG2  PRO  44           1HG      PRO  44   9.630  11.636  -6.674
  345    HG3  PRO  44           2HG      PRO  44   9.220  10.696  -8.120
  346    HD2  PRO  44           1HD      PRO  44   7.344  11.593  -6.386
  347    HD3  PRO  44           2HD      PRO  44   7.163  10.074  -7.286
  348    H    LEU  45           H        LEU  45   8.390  11.067  -3.530
  349    HA   LEU  45           HA       LEU  45  11.016  11.464  -2.277
  350    HB2  LEU  45           1HB      LEU  45   8.558  13.196  -2.405
  351    HB3  LEU  45           2HB      LEU  45   9.941  13.559  -1.374
  352    HG   LEU  45           HG       LEU  45  10.163  13.279  -4.364
  353   HD11  LEU  45          1HD1      LEU  45   8.556  15.076  -3.711
  354   HD12  LEU  45          2HD1      LEU  45   9.988  15.647  -4.568
  355   HD13  LEU  45          3HD1      LEU  45   9.868  15.847  -2.820
  356   HD21  LEU  45          1HD2      LEU  45  12.182  13.087  -2.812
  357   HD22  LEU  45          2HD2      LEU  45  11.936  14.801  -2.478
  358   HD23  LEU  45          3HD2      LEU  45  12.276  14.263  -4.123
  359    H    ASP  46           H        ASP  46   7.794  10.370  -1.689
  360    HA   ASP  46           HA       ASP  46   8.303  10.255   1.204
  361    HB2  ASP  46           1HB      ASP  46   5.790  10.258  -0.439
  362    HB3  ASP  46           2HB      ASP  46   5.780   9.608   1.198
  363    H    HIS  47           H        HIS  47   9.405   8.440  -0.888
  364    HA   HIS  47           HA       HIS  47   8.984   5.988   0.511
  365    HB2  HIS  47           1HB      HIS  47   7.796   4.726  -1.028
  366    HB3  HIS  47           2HB      HIS  47   6.991   6.286  -1.160
  367    HD1  HIS  47           1HD      HIS  47   6.577   6.923  -3.501
  368    HD2  HIS  47           2HD      HIS  47  10.024   4.634  -3.125
  369    HE1  HIS  47           1HE      HIS  47   7.469   6.662  -5.838
  370    H    ASP  48           H        ASP  48  10.729   4.703   0.309
  371    HA   ASP  48           HA       ASP  48  13.075   5.604  -0.864
  372    HB2  ASP  48           1HB      ASP  48  12.655   3.726   0.901
  373    HB3  ASP  48           2HB      ASP  48  12.576   2.667  -0.504
  374    H    CYS  49           H        CYS  49  12.653   6.244  -2.999
  375    HA   CYS  49           HA       CYS  49  11.700   4.355  -4.947
  376    HB2  CYS  49           1HB      CYS  49  11.378   6.893  -4.999
  377    HB3  CYS  49           2HB      CYS  49  13.053   6.985  -5.536
  378    H    SER  50           H        SER  50  12.886   2.856  -5.907
  379    HA   SER  50           HA       SER  50  15.791   2.984  -5.732
  380    HB2  SER  50           1HB      SER  50  14.218   0.903  -5.297
  381    HB3  SER  50           2HB      SER  50  14.355   0.712  -7.045
  382    HG   SER  50           HG       SER  50  16.229   0.304  -5.070
  383    H    GLY  51           H        GLY  51  13.293   2.569  -8.234
  384    HA2  GLY  51           1HA      GLY  51  13.300   3.455 -10.390
  385    HA3  GLY  51           2HA      GLY  51  14.942   4.021 -10.126
  386    H    GLU  52           H        GLU  52  13.431   2.319 -12.235
  387    HA   GLU  52           HA       GLU  52  15.258   0.018 -12.255
  388    HB2  GLU  52           1HB      GLU  52  12.664   0.523 -13.715
  389    HB3  GLU  52           2HB      GLU  52  13.705  -0.856 -14.037
  390    HG2  GLU  52           1HG      GLU  52  12.701  -0.306 -11.275
  391    HG3  GLU  52           2HG      GLU  52  11.702  -1.151 -12.456
  392    H    GLY  53           H        GLY  53  15.724  -0.688 -14.661
  393    HA2  GLY  53           1HA      GLY  53  16.296   1.637 -16.346
  394    HA3  GLY  53           2HA      GLY  53  17.659   0.668 -15.807
  395    H    HIS  54           H        HIS  54  17.658   0.731 -18.347
  396    HA   HIS  54           HA       HIS  54  16.214  -1.660 -19.287
  397    HB2  HIS  54           1HB      HIS  54  16.933   0.899 -20.683
  398    HB3  HIS  54           2HB      HIS  54  16.694  -0.579 -21.609
  399    HD1  HIS  54           1HD      HIS  54  14.890   2.243 -21.070
  400    HD2  HIS  54           2HD      HIS  54  14.006  -1.742 -20.294
  401    HE1  HIS  54           1HE      HIS  54  12.380   2.120 -20.960
  402    HA   PRO  55           HA       PRO  55  20.434  -3.208 -19.410
  403    HB2  PRO  55           1HB      PRO  55  19.715  -5.786 -19.868
  404    HB3  PRO  55           2HB      PRO  55  19.662  -5.044 -18.265
  405    HG2  PRO  55           1HG      PRO  55  17.439  -5.493 -20.218
  406    HG3  PRO  55           2HG      PRO  55  17.452  -5.740 -18.462
  407    HD2  PRO  55           1HD      PRO  55  16.355  -3.550 -19.617
  408    HD3  PRO  55           2HD      PRO  55  17.125  -3.502 -18.018
  409    H    THR  56           H        THR  56  17.891  -4.068 -21.739
  410    HA   THR  56           HA       THR  56  18.052  -4.739 -23.944
  411    HB   THR  56           HB       THR  56  17.976  -2.278 -24.041
  412    HG1  THR  56           1HG      THR  56  18.395  -3.778 -25.957
  413   HG21  THR  56          1HG2      THR  56  20.969  -2.561 -23.910
  414   HG22  THR  56          2HG2      THR  56  19.914  -1.573 -22.899
  415   HG23  THR  56          3HG2      THR  56  20.190  -1.130 -24.583
  416    H    SER  57           H        SER  57  19.941  -6.148 -22.420
  417    HA   SER  57           HA       SER  57  22.573  -6.096 -23.162
  418    HB2  SER  57           1HB      SER  57  21.371  -7.705 -21.556
  419    HB3  SER  57           2HB      SER  57  21.066  -8.701 -22.979
  420    HG   SER  57           HG       SER  57  23.199  -8.746 -21.526
  421    H    SER  58           H        SER  58  23.483  -5.998 -25.095
  422    HA   SER  58           HA       SER  58  22.104  -7.046 -27.429
  423    HB2  SER  58           1HB      SER  58  23.442  -4.784 -27.193
  424    HB3  SER  58           2HB      SER  58  24.826  -5.809 -27.573
  425    HG   SER  58           HG       SER  58  23.424  -4.737 -29.336
  426    H    GLY  59           H        GLY  59  22.836  -8.685 -28.743
  427    HA2  GLY  59           1HA      GLY  59  25.160  -9.938 -29.052
  428    HA3  GLY  59           2HA      GLY  59  24.682 -10.550 -27.475
  429    HA   PRO  60           HA       PRO  60  22.896 -13.189 -30.936
  430    HB2  PRO  60           1HB      PRO  60  24.151 -15.493 -30.237
  431    HB3  PRO  60           2HB      PRO  60  24.854 -14.316 -31.353
  432    HG2  PRO  60           1HG      PRO  60  25.396 -14.720 -28.437
  433    HG3  PRO  60           2HG      PRO  60  26.542 -14.419 -29.757
  434    HD2  PRO  60           1HD      PRO  60  25.728 -12.471 -28.062
  435    HD3  PRO  60           2HD      PRO  60  26.138 -12.150 -29.759
  436    H    SER  61           H        SER  61  23.476 -13.741 -27.501
  437    HA   SER  61           HA       SER  61  22.331 -15.031 -25.963
  438    HB2  SER  61           1HB      SER  61  21.137 -12.763 -26.282
  439    HB3  SER  61           2HB      SER  61  19.903 -13.690 -27.135
  440    HG   SER  61           HG       SER  61  19.582 -14.903 -25.262
  441    H    SER  62           H        SER  62  22.792 -16.584 -28.215
  442    HA   SER  62           HA       SER  62  20.757 -17.759 -29.568
  443    HB2  SER  62           1HB      SER  62  23.149 -19.086 -28.282
  444    HB3  SER  62           2HB      SER  62  22.078 -19.909 -29.414
  445    HG   SER  62           HG       SER  62  24.075 -18.785 -30.234
  446    H    GLY  63           H        GLY  63  18.790 -18.025 -28.638
  447    HA2  GLY  63           1HA      GLY  63  18.664 -19.709 -26.215
  448    HA3  GLY  63           2HA      GLY  63  17.461 -18.502 -26.646
  Start of MODEL   15
    1    H1   GLY   1           H        GLY   1 -23.085 -14.070  11.675
    2    HA2  GLY   1           1HA      GLY   1 -24.730 -14.849   9.860
    3    HA3  GLY   1           2HA      GLY   1 -25.861 -13.817  10.723
    4    H    SER   2           H        SER   2 -25.419 -13.352   8.086
    5    HA   SER   2           HA       SER   2 -23.663 -10.986   8.063
    6    HB2  SER   2           1HB      SER   2 -23.520 -11.281   5.622
    7    HB3  SER   2           2HB      SER   2 -22.966 -12.723   6.472
    8    HG   SER   2           HG       SER   2 -24.326 -13.608   5.092
    9    H    SER   3           H        SER   3 -24.462  -9.039   7.426
   10    HA   SER   3           HA       SER   3 -27.164  -8.871   6.346
   11    HB2  SER   3           1HB      SER   3 -27.697  -8.744   8.656
   12    HB3  SER   3           2HB      SER   3 -26.319  -7.697   8.995
   13    HG   SER   3           HG       SER   3 -27.377  -6.007   8.191
   14    H    GLY   4           H        GLY   4 -27.655  -6.838   5.384
   15    HA2  GLY   4           1HA      GLY   4 -27.176  -4.761   4.460
   16    HA3  GLY   4           2HA      GLY   4 -25.634  -4.774   5.303
   17    H    SER   5           H        SER   5 -24.885  -3.868   3.224
   18    HA   SER   5           HA       SER   5 -24.307  -6.023   1.297
   19    HB2  SER   5           1HB      SER   5 -25.841  -3.973   0.628
   20    HB3  SER   5           2HB      SER   5 -24.289  -3.160   0.432
   21    HG   SER   5           HG       SER   5 -23.884  -4.335  -1.279
   22    H    SER   6           H        SER   6 -22.227  -6.455   0.957
   23    HA   SER   6           HA       SER   6 -20.233  -4.529   1.957
   24    HB2  SER   6           1HB      SER   6 -20.357  -7.516   2.013
   25    HB3  SER   6           2HB      SER   6 -18.777  -6.737   1.927
   26    HG   SER   6           HG       SER   6 -19.145  -5.763   3.859
   27    H    GLY   7           H        GLY   7 -18.232  -4.347   0.790
   28    HA2  GLY   7           1HA      GLY   7 -18.444  -5.177  -2.037
   29    HA3  GLY   7           2HA      GLY   7 -17.939  -3.556  -1.585
   30    H    ARG   8           H        ARG   8 -17.019  -6.641  -0.108
   31    HA   ARG   8           HA       ARG   8 -14.236  -5.905  -0.250
   32    HB2  ARG   8           1HB      ARG   8 -15.566  -8.433   0.742
   33    HB3  ARG   8           2HB      ARG   8 -13.859  -8.050   0.924
   34    HG2  ARG   8           1HG      ARG   8 -14.840  -5.877   2.067
   35    HG3  ARG   8           2HG      ARG   8 -16.216  -6.947   2.343
   36    HD2  ARG   8           1HD      ARG   8 -13.410  -7.768   3.026
   37    HD3  ARG   8           2HD      ARG   8 -14.401  -6.836   4.148
   38    HE   ARG   8           HE       ARG   8 -15.726  -9.182   3.180
   39   HH11  ARG   8          2HH1      ARG   8 -13.452  -7.977   5.525
   40   HH12  ARG   8          1HH1      ARG   8 -13.737  -9.259   6.654
   41   HH21  ARG   8          2HH2      ARG   8 -16.110 -10.876   4.659
   42   HH22  ARG   8          1HH2      ARG   8 -15.248 -10.908   6.160
   43    H    LYS   9           H        LYS   9 -14.006  -5.827  -2.560
   44    HA   LYS   9           HA       LYS   9 -13.860  -8.488  -3.819
   45    HB2  LYS   9           1HB      LYS   9 -15.450  -6.741  -4.793
   46    HB3  LYS   9           2HB      LYS   9 -14.011  -5.862  -5.293
   47    HG2  LYS   9           1HG      LYS   9 -13.307  -7.971  -6.500
   48    HG3  LYS   9           2HG      LYS   9 -14.940  -8.570  -6.200
   49    HD2  LYS   9           1HD      LYS   9 -15.825  -6.539  -7.338
   50    HD3  LYS   9           2HD      LYS   9 -14.165  -6.096  -7.744
   51    HE2  LYS   9           1HE      LYS   9 -15.540  -8.654  -8.562
   52    HE3  LYS   9           2HE      LYS   9 -15.321  -7.242  -9.594
   53    HZ1  LYS   9           1HZ      LYS   9 -12.966  -8.454  -8.330
   54    HZ2  LYS   9           2HZ      LYS   9 -13.089  -7.621  -9.796
   55    HZ3  LYS   9           3HZ      LYS   9 -13.645  -9.214  -9.680
   56    H    ILE  10           H        ILE  10 -12.063  -8.958  -5.157
   57    HA   ILE  10           HA       ILE  10  -9.607  -7.779  -4.216
   58    HB   ILE  10           HB       ILE  10  -8.492  -9.449  -5.637
   59   HG12  ILE  10          1HG1      ILE  10 -11.237 -10.480  -6.344
   60   HG13  ILE  10          2HG1      ILE  10 -10.350  -9.380  -7.394
   61   HG21  ILE  10          1HG2      ILE  10  -9.168 -11.395  -4.402
   62   HG22  ILE  10          2HG2      ILE  10  -9.268  -9.989  -3.343
   63   HG23  ILE  10          3HG2      ILE  10 -10.736 -10.673  -4.041
   64   HD11  ILE  10          1HD1      ILE  10  -9.896 -12.238  -6.817
   65   HD12  ILE  10          2HD1      ILE  10  -9.689 -11.330  -8.315
   66   HD13  ILE  10          3HD1      ILE  10  -8.467 -11.230  -7.047
   67    H    PHE  11           H        PHE  11 -11.051  -5.842  -5.517
   68    HA   PHE  11           HA       PHE  11  -9.886  -5.586  -8.187
   69    HB2  PHE  11           1HB      PHE  11 -11.505  -3.959  -8.644
   70    HB3  PHE  11           2HB      PHE  11 -12.362  -5.106  -7.620
   71    HD1  PHE  11           1HD      PHE  11 -12.464  -4.572  -5.107
   72    HD2  PHE  11           2HD      PHE  11 -11.460  -1.711  -8.094
   73    HE1  PHE  11           1HE      PHE  11 -13.048  -2.753  -3.556
   74    HE2  PHE  11           2HE      PHE  11 -12.041   0.113  -6.548
   75    HZ   PHE  11           HZ       PHE  11 -12.835  -0.407  -4.275
   76    H    THR  12           H        THR  12  -9.969  -3.952  -5.056
   77    HA   THR  12           HA       THR  12  -8.496  -1.680  -5.679
   78    HB   THR  12           HB       THR  12  -7.797  -1.692  -3.262
   79    HG1  THR  12           1HG      THR  12  -7.722  -3.779  -2.648
   80   HG21  THR  12          1HG2      THR  12  -9.819  -0.878  -2.625
   81   HG22  THR  12          2HG2      THR  12 -10.695  -2.290  -3.216
   82   HG23  THR  12          3HG2      THR  12 -10.166  -1.044  -4.346
   83    H    ASN  13           H        ASN  13  -6.249  -1.174  -5.067
   84    HA   ASN  13           HA       ASN  13  -4.467  -3.424  -5.720
   85    HB2  ASN  13           1HB      ASN  13  -3.649  -0.548  -5.972
   86    HB3  ASN  13           2HB      ASN  13  -3.047  -1.955  -6.844
   87   HD21  ASN  13          1HD2      ASN  13  -4.909   0.745  -7.080
   88   HD22  ASN  13          2HD2      ASN  13  -5.873   0.310  -8.446
   89    H    LYS  14           H        LYS  14  -2.574  -3.737  -4.548
   90    HA   LYS  14           HA       LYS  14  -2.579  -2.494  -1.890
   91    HB2  LYS  14           1HB      LYS  14  -2.703  -4.959  -1.990
   92    HB3  LYS  14           2HB      LYS  14  -1.170  -4.991  -2.851
   93    HG2  LYS  14           1HG      LYS  14  -0.380  -3.627  -0.717
   94    HG3  LYS  14           2HG      LYS  14  -1.732  -4.495   0.014
   95    HD2  LYS  14           1HD      LYS  14  -0.786  -6.601  -0.525
   96    HD3  LYS  14           2HD      LYS  14   0.413  -5.868  -1.593
   97    HE2  LYS  14           1HE      LYS  14   1.307  -4.677   0.453
   98    HE3  LYS  14           2HE      LYS  14   0.270  -5.733   1.411
   99    HZ1  LYS  14           1HZ      LYS  14   2.205  -6.827  -0.536
  100    HZ2  LYS  14           2HZ      LYS  14   1.465  -7.610   0.767
  101    HZ3  LYS  14           3HZ      LYS  14   2.666  -6.452   1.048
  102    H    CYS  15           H        CYS  15  -1.128  -0.985  -1.439
  103    HA   CYS  15           HA       CYS  15   0.751   0.035  -3.164
  104    HB2  CYS  15           1HB      CYS  15   0.023   1.216  -1.154
  105    HB3  CYS  15           2HB      CYS  15   0.838   0.031  -0.139
  106    H    GLU  16           H        GLU  16   3.077  -0.034  -3.176
  107    HA   GLU  16           HA       GLU  16   4.100  -2.708  -2.501
  108    HB2  GLU  16           1HB      GLU  16   5.122  -0.717  -4.535
  109    HB3  GLU  16           2HB      GLU  16   5.806  -2.307  -4.230
  110    HG2  GLU  16           1HG      GLU  16   3.398  -3.138  -4.779
  111    HG3  GLU  16           2HG      GLU  16   3.252  -1.571  -5.573
  112    H    ARG  17           H        ARG  17   3.922  -0.350  -0.703
  113    HA   ARG  17           HA       ARG  17   6.776   0.165  -0.229
  114    HB2  ARG  17           1HB      ARG  17   4.848   1.994  -0.406
  115    HB3  ARG  17           2HB      ARG  17   4.659   1.599   1.297
  116    HG2  ARG  17           1HG      ARG  17   7.397   2.167   0.314
  117    HG3  ARG  17           2HG      ARG  17   6.274   3.520   0.462
  118    HD2  ARG  17           1HD      ARG  17   5.833   2.363   2.822
  119    HD3  ARG  17           2HD      ARG  17   7.486   1.808   2.558
  120    HE   ARG  17           HE       ARG  17   7.086   4.638   2.162
  121   HH11  ARG  17          2HH1      ARG  17   7.886   2.113   4.421
  122   HH12  ARG  17          1HH1      ARG  17   8.721   3.172   5.509
  123   HH21  ARG  17          2HH2      ARG  17   8.183   6.043   3.587
  124   HH22  ARG  17          1HH2      ARG  17   8.888   5.407   5.034
  125    H    ALA  18           H        ALA  18   7.659  -0.086   1.858
  126    HA   ALA  18           HA       ALA  18   6.659  -2.344   3.287
  127    HB1  ALA  18           1HB      ALA  18   8.647  -0.923   4.781
  128    HB2  ALA  18           2HB      ALA  18   8.770  -2.478   3.958
  129    HB3  ALA  18           3HB      ALA  18   9.111  -0.987   3.080
  130    H    GLY  19           H        GLY  19   5.639  -2.463   5.241
  131    HA2  GLY  19           1HA      GLY  19   4.337  -1.791   7.007
  132    HA3  GLY  19           2HA      GLY  19   5.409  -0.403   7.124
  133    H    CYS  20           H        CYS  20   3.332  -1.252   4.396
  134    HA   CYS  20           HA       CYS  20   1.603   1.033   5.036
  135    HB2  CYS  20           1HB      CYS  20   3.441   1.559   3.310
  136    HB3  CYS  20           2HB      CYS  20   2.536   0.513   2.221
  137    H    ARG  21           H        ARG  21   1.980  -1.462   2.510
  138    HA   ARG  21           HA       ARG  21   0.386  -2.702   1.418
  139    HB2  ARG  21           1HB      ARG  21  -0.768  -4.254   2.885
  140    HB3  ARG  21           2HB      ARG  21   0.878  -4.010   3.452
  141    HG2  ARG  21           1HG      ARG  21   0.054  -2.456   5.156
  142    HG3  ARG  21           2HG      ARG  21  -1.596  -2.730   4.594
  143    HD2  ARG  21           1HD      ARG  21  -1.229  -5.176   5.074
  144    HD3  ARG  21           2HD      ARG  21   0.277  -4.715   5.865
  145    HE   ARG  21           HE       ARG  21  -2.083  -3.346   6.822
  146   HH11  ARG  21          2HH1      ARG  21   0.061  -6.063   7.200
  147   HH12  ARG  21          1HH1      ARG  21  -0.367  -6.337   8.856
  148   HH21  ARG  21          2HH2      ARG  21  -2.655  -3.697   9.002
  149   HH22  ARG  21          1HH2      ARG  21  -1.913  -4.991   9.880
  150    H    GLN  22           H        GLN  22  -0.359   0.078   1.789
  151    HA   GLN  22           HA       GLN  22  -2.981   0.436   2.663
  152    HB2  GLN  22           1HB      GLN  22  -1.112   1.892   0.900
  153    HB3  GLN  22           2HB      GLN  22  -2.816   2.247   0.650
  154    HG2  GLN  22           1HG      GLN  22  -1.151   2.670   3.099
  155    HG3  GLN  22           2HG      GLN  22  -2.104   3.840   2.188
  156   HE21  GLN  22          1HE2      GLN  22  -2.043   2.826   5.066
  157   HE22  GLN  22          2HE2      GLN  22  -3.704   2.513   5.421
  158    H    ARG  23           H        ARG  23  -4.829   1.062   1.146
  159    HA   ARG  23           HA       ARG  23  -4.962  -0.754  -1.161
  160    HB2  ARG  23           1HB      ARG  23  -6.718  -0.681   1.237
  161    HB3  ARG  23           2HB      ARG  23  -7.495  -0.935  -0.320
  162    HG2  ARG  23           1HG      ARG  23  -6.400  -2.952  -0.680
  163    HG3  ARG  23           2HG      ARG  23  -5.146  -2.592   0.509
  164    HD2  ARG  23           1HD      ARG  23  -6.517  -4.184   1.549
  165    HD3  ARG  23           2HD      ARG  23  -7.013  -2.641   2.243
  166    HE   ARG  23           HE       ARG  23  -8.747  -2.909   0.224
  167   HH11  ARG  23          2HH1      ARG  23  -7.719  -5.138   2.693
  168   HH12  ARG  23          1HH1      ARG  23  -9.228  -5.989   2.737
  169   HH21  ARG  23          2HH2      ARG  23 -10.738  -4.021   0.272
  170   HH22  ARG  23          1HH2      ARG  23 -10.944  -5.353   1.358
  171    H    GLU  24           H        GLU  24  -4.658   1.097  -2.478
  172    HA   GLU  24           HA       GLU  24  -6.570   3.263  -2.342
  173    HB2  GLU  24           1HB      GLU  24  -4.120   2.668  -3.928
  174    HB3  GLU  24           2HB      GLU  24  -5.286   3.791  -4.614
  175    HG2  GLU  24           1HG      GLU  24  -4.270   4.138  -1.822
  176    HG3  GLU  24           2HG      GLU  24  -3.354   4.723  -3.210
  177    H    MET  25           H        MET  25  -8.253   3.643  -3.710
  178    HA   MET  25           HA       MET  25  -9.460   1.446  -5.003
  179    HB2  MET  25           1HB      MET  25 -10.023   4.407  -5.080
  180    HB3  MET  25           2HB      MET  25 -11.006   3.235  -5.948
  181    HG2  MET  25           1HG      MET  25 -12.196   3.485  -4.009
  182    HG3  MET  25           2HG      MET  25 -11.201   2.082  -3.629
  183    HE1  MET  25           1HE      MET  25  -9.768   2.992  -0.378
  184    HE2  MET  25           2HE      MET  25 -11.124   2.112  -1.081
  185    HE3  MET  25           3HE      MET  25  -9.510   1.943  -1.772
  186    H    MET  26           H        MET  26  -7.583   4.186  -6.205
  187    HA   MET  26           HA       MET  26  -7.774   3.127  -8.931
  188    HB2  MET  26           1HB      MET  26  -6.960   5.248  -9.686
  189    HB3  MET  26           2HB      MET  26  -8.222   5.555  -8.500
  190    HG2  MET  26           1HG      MET  26  -6.478   5.932  -6.796
  191    HG3  MET  26           2HG      MET  26  -5.253   5.723  -8.045
  192    HE1  MET  26           1HE      MET  26  -5.300   6.815 -10.141
  193    HE2  MET  26           2HE      MET  26  -6.297   8.189 -10.618
  194    HE3  MET  26           3HE      MET  26  -4.737   8.459  -9.839
  195    H    LYS  27           H        LYS  27  -5.784   3.080 -10.241
  196    HA   LYS  27           HA       LYS  27  -3.626   1.865  -8.713
  197    HB2  LYS  27           1HB      LYS  27  -4.402   0.658 -10.661
  198    HB3  LYS  27           2HB      LYS  27  -4.138   2.063 -11.685
  199    HG2  LYS  27           1HG      LYS  27  -1.715   1.904 -11.204
  200    HG3  LYS  27           2HG      LYS  27  -2.029   0.423 -10.297
  201    HD2  LYS  27           1HD      LYS  27  -2.835   0.782 -13.176
  202    HD3  LYS  27           2HD      LYS  27  -1.268   0.127 -12.694
  203    HE2  LYS  27           1HE      LYS  27  -3.919  -1.011 -11.819
  204    HE3  LYS  27           2HE      LYS  27  -3.006  -1.596 -13.209
  205    HZ1  LYS  27           1HZ      LYS  27  -1.155  -1.635 -11.261
  206    HZ2  LYS  27           2HZ      LYS  27  -2.087  -2.969 -11.723
  207    HZ3  LYS  27           3HZ      LYS  27  -2.552  -2.032 -10.393
  208    H    LEU  28           H        LEU  28  -1.871   2.947  -8.132
  209    HA   LEU  28           HA       LEU  28  -1.098   5.321  -9.698
  210    HB2  LEU  28           1HB      LEU  28  -0.876   4.869  -6.727
  211    HB3  LEU  28           2HB      LEU  28  -0.179   6.241  -7.585
  212    HG   LEU  28           HG       LEU  28  -3.108   5.765  -7.826
  213   HD11  LEU  28          1HD1      LEU  28  -3.615   6.152  -5.699
  214   HD12  LEU  28          2HD1      LEU  28  -2.491   7.507  -5.609
  215   HD13  LEU  28          3HD1      LEU  28  -1.918   5.865  -5.315
  216   HD21  LEU  28          1HD2      LEU  28  -1.550   8.316  -7.480
  217   HD22  LEU  28          2HD2      LEU  28  -3.191   8.115  -8.097
  218   HD23  LEU  28          3HD2      LEU  28  -1.815   7.554  -9.048
  219    H    THR  29           H        THR  29   0.622   4.751 -10.864
  220    HA   THR  29           HA       THR  29   2.711   3.116  -9.585
  221    HB   THR  29           HB       THR  29   2.257   3.564 -12.541
  222    HG1  THR  29           1HG      THR  29   1.916   1.026 -11.744
  223   HG21  THR  29          1HG2      THR  29   4.030   2.163 -12.963
  224   HG22  THR  29          2HG2      THR  29   3.899   1.350 -11.404
  225   HG23  THR  29          3HG2      THR  29   4.603   2.963 -11.501
  226    H    CYS  30           H        CYS  30   4.768   3.855  -9.433
  227    HA   CYS  30           HA       CYS  30   5.276   6.605  -9.501
  228    HB2  CYS  30           1HB      CYS  30   6.526   4.681  -8.270
  229    HB3  CYS  30           2HB      CYS  30   7.479   4.578  -9.747
  230    H    GLU  31           H        GLU  31   7.231   7.522 -10.756
  231    HA   GLU  31           HA       GLU  31   6.821   6.885 -13.598
  232    HB2  GLU  31           1HB      GLU  31   7.565   9.173 -14.065
  233    HB3  GLU  31           2HB      GLU  31   6.185   9.160 -12.976
  234    HG2  GLU  31           1HG      GLU  31   7.844   9.372 -11.082
  235    HG3  GLU  31           2HG      GLU  31   9.061   9.704 -12.313
  236    H    ARG  32           H        ARG  32   9.094   6.821 -11.065
  237    HA   ARG  32           HA       ARG  32  11.367   6.709 -12.911
  238    HB2  ARG  32           1HB      ARG  32  11.147   7.012  -9.925
  239    HB3  ARG  32           2HB      ARG  32  12.671   6.589 -10.695
  240    HG2  ARG  32           1HG      ARG  32  12.653   8.645 -11.957
  241    HG3  ARG  32           2HG      ARG  32  11.060   9.055 -11.316
  242    HD2  ARG  32           1HD      ARG  32  12.751  10.287 -10.115
  243    HD3  ARG  32           2HD      ARG  32  12.021   9.093  -9.043
  244    HE   ARG  32           HE       ARG  32  14.451   8.246 -10.364
  245   HH11  ARG  32          2HH1      ARG  32  13.021   9.705  -7.545
  246   HH12  ARG  32          1HH1      ARG  32  14.367   9.345  -6.516
  247   HH21  ARG  32          2HH2      ARG  32  16.230   7.767  -9.019
  248   HH22  ARG  32          1HH2      ARG  32  16.192   8.243  -7.355
  249    H    CYS  33           H        CYS  33  10.015   4.861 -10.178
  250    HA   CYS  33           HA       CYS  33  11.539   2.516 -10.983
  251    HB2  CYS  33           1HB      CYS  33  10.523   1.499  -8.928
  252    HB3  CYS  33           2HB      CYS  33  11.480   2.944  -8.621
  253    H    SER  34           H        SER  34   8.410   3.839 -11.383
  254    HA   SER  34           HA       SER  34   6.528   3.102 -12.427
  255    HB2  SER  34           1HB      SER  34   8.414   0.974 -13.467
  256    HB3  SER  34           2HB      SER  34   6.782   1.252 -14.074
  257    HG   SER  34           HG       SER  34   7.429   3.032 -15.051
  258    H    ARG  35           H        ARG  35   6.777   2.390  -9.777
  259    HA   ARG  35           HA       ARG  35   5.602  -0.313  -9.718
  260    HB2  ARG  35           1HB      ARG  35   7.314   1.124  -7.698
  261    HB3  ARG  35           2HB      ARG  35   6.325  -0.263  -7.262
  262    HG2  ARG  35           1HG      ARG  35   7.539  -1.472  -9.176
  263    HG3  ARG  35           2HG      ARG  35   8.698  -0.145  -9.080
  264    HD2  ARG  35           1HD      ARG  35   8.936  -0.647  -6.639
  265    HD3  ARG  35           2HD      ARG  35   7.944  -2.082  -6.899
  266    HE   ARG  35           HE       ARG  35   9.922  -2.364  -8.719
  267   HH11  ARG  35          2HH1      ARG  35   9.899  -1.743  -5.294
  268   HH12  ARG  35          1HH1      ARG  35  11.407  -2.545  -5.006
  269   HH21  ARG  35          2HH2      ARG  35  11.909  -3.423  -8.353
  270   HH22  ARG  35          1HH2      ARG  35  12.550  -3.499  -6.747
  271    H    ASN  36           H        ASN  36   3.837  -0.670  -8.301
  272    HA   ASN  36           HA       ASN  36   2.021   1.529  -8.160
  273    HB2  ASN  36           1HB      ASN  36   1.480  -0.969  -8.511
  274    HB3  ASN  36           2HB      ASN  36   1.628  -1.108  -6.761
  275   HD21  ASN  36          1HD2      ASN  36  -0.707  -1.594  -8.306
  276   HD22  ASN  36          2HD2      ASN  36  -1.908  -0.460  -7.800
  277    H    PHE  37           H        PHE  37   1.193   2.574  -6.357
  278    HA   PHE  37           HA       PHE  37   2.107   1.947  -3.706
  279    HB2  PHE  37           1HB      PHE  37   3.034   4.522  -4.996
  280    HB3  PHE  37           2HB      PHE  37   3.250   4.087  -3.304
  281    HD1  PHE  37           2HD      PHE  37   4.508   1.826  -2.889
  282    HD2  PHE  37           1HD      PHE  37   4.732   4.094  -6.484
  283    HE1  PHE  37           2HE      PHE  37   6.640   0.731  -3.443
  284    HE2  PHE  37           1HE      PHE  37   6.865   3.002  -7.043
  285    HZ   PHE  37           HZ       PHE  37   7.823   1.319  -5.522
  286    H    CYS  38           H        CYS  38   1.394   3.814  -2.163
  287    HA   CYS  38           HA       CYS  38  -1.349   4.504  -2.936
  288    HB2  CYS  38           1HB      CYS  38  -1.794   4.739  -0.555
  289    HB3  CYS  38           2HB      CYS  38  -1.036   3.181  -0.870
  290    H    ILE  39           H        ILE  39  -2.199   6.590  -2.534
  291    HA   ILE  39           HA       ILE  39  -0.917   8.748  -3.453
  292    HB   ILE  39           HB       ILE  39  -2.971   8.597  -1.269
  293   HG12  ILE  39          1HG1      ILE  39  -3.121   9.739  -4.063
  294   HG13  ILE  39          2HG1      ILE  39  -3.521   8.071  -3.672
  295   HG21  ILE  39          1HG2      ILE  39  -1.836  11.119  -2.470
  296   HG22  ILE  39          2HG2      ILE  39  -3.235  11.026  -1.402
  297   HG23  ILE  39          3HG2      ILE  39  -1.637  10.581  -0.803
  298   HD11  ILE  39          1HD1      ILE  39  -5.321  10.049  -3.781
  299   HD12  ILE  39          2HD1      ILE  39  -5.498   8.625  -2.754
  300   HD13  ILE  39          3HD1      ILE  39  -4.885  10.132  -2.074
  301    H    LYS  40           H        LYS  40  -0.624   7.496  -0.178
  302    HA   LYS  40           HA       LYS  40   0.861   9.652   0.892
  303    HB2  LYS  40           1HB      LYS  40   0.429   6.794   1.681
  304    HB3  LYS  40           2HB      LYS  40   1.646   7.751   2.515
  305    HG2  LYS  40           1HG      LYS  40  -0.145   8.118   3.870
  306    HG3  LYS  40           2HG      LYS  40  -0.340   9.464   2.745
  307    HD2  LYS  40           1HD      LYS  40  -2.471   8.378   3.074
  308    HD3  LYS  40           2HD      LYS  40  -1.913   8.081   1.426
  309    HE2  LYS  40           1HE      LYS  40  -1.551   5.859   1.804
  310    HE3  LYS  40           2HE      LYS  40  -1.191   6.096   3.513
  311    HZ1  LYS  40           1HZ      LYS  40  -3.532   5.157   2.478
  312    HZ2  LYS  40           2HZ      LYS  40  -3.895   6.762   2.869
  313    HZ3  LYS  40           3HZ      LYS  40  -3.298   5.717   4.058
  314    H    HIS  41           H        HIS  41   1.825   6.590  -0.610
  315    HA   HIS  41           HA       HIS  41   4.611   7.538  -0.629
  316    HB2  HIS  41           1HB      HIS  41   3.527   4.735  -0.980
  317    HB3  HIS  41           2HB      HIS  41   5.231   5.179  -1.014
  318    HD2  HIS  41           2HD      HIS  41   4.913   7.168   1.738
  319    HE1  HIS  41           1HE      HIS  41   4.081   3.430   3.562
  320    HE2  HIS  41           2HE      HIS  41   4.659   5.850   3.949
  321    H    ARG  42           H        ARG  42   2.212   8.034  -2.515
  322    HA   ARG  42           HA       ARG  42   2.807   6.826  -4.993
  323    HB2  ARG  42           1HB      ARG  42   0.692   7.730  -4.986
  324    HB3  ARG  42           2HB      ARG  42   1.192   9.164  -4.099
  325    HG2  ARG  42           1HG      ARG  42   0.614   9.873  -6.275
  326    HG3  ARG  42           2HG      ARG  42   2.376   9.914  -6.184
  327    HD2  ARG  42           1HD      ARG  42   2.122   7.455  -7.118
  328    HD3  ARG  42           2HD      ARG  42   0.586   8.089  -7.706
  329    HE   ARG  42           HE       ARG  42   3.171   8.645  -8.753
  330   HH11  ARG  42          2HH1      ARG  42   0.034  10.050  -8.200
  331   HH12  ARG  42          1HH1      ARG  42   0.168  11.185  -9.502
  332   HH21  ARG  42          2HH2      ARG  42   3.360  10.134 -10.470
  333   HH22  ARG  42          1HH2      ARG  42   2.060  11.231 -10.793
  334    H    HIS  43           H        HIS  43   4.179   9.522  -3.308
  335    HA   HIS  43           HA       HIS  43   5.583  10.473  -5.681
  336    HB2  HIS  43           1HB      HIS  43   4.546  11.867  -3.642
  337    HB3  HIS  43           2HB      HIS  43   6.165  11.613  -2.997
  338    HD1  HIS  43           1HD      HIS  43   8.076  12.919  -4.060
  339    HD2  HIS  43           2HD      HIS  43   4.430  13.484  -5.970
  340    HE1  HIS  43           1HE      HIS  43   8.435  14.843  -5.639
  341    HA   PRO  44           HA       PRO  44   9.233   8.147  -4.878
  342    HB2  PRO  44           1HB      PRO  44  11.023   9.694  -6.210
  343    HB3  PRO  44           2HB      PRO  44   9.850   8.659  -7.032
  344    HG2  PRO  44           1HG      PRO  44   9.736  11.603  -6.504
  345    HG3  PRO  44           2HG      PRO  44   9.310  10.713  -7.978
  346    HD2  PRO  44           1HD      PRO  44   7.450  11.586  -6.215
  347    HD3  PRO  44           2HD      PRO  44   7.245  10.098  -7.160
  348    H    LEU  45           H        LEU  45   8.471  10.912  -3.339
  349    HA   LEU  45           HA       LEU  45  11.113  11.294  -2.120
  350    HB2  LEU  45           1HB      LEU  45   8.635  12.967  -2.256
  351    HB3  LEU  45           2HB      LEU  45   9.850  13.265  -1.014
  352    HG   LEU  45           HG       LEU  45  10.287  13.411  -3.997
  353   HD11  LEU  45          1HD1      LEU  45   9.507  15.369  -1.953
  354   HD12  LEU  45          2HD1      LEU  45   9.291  15.401  -3.703
  355   HD13  LEU  45          3HD1      LEU  45  10.839  15.866  -2.998
  356   HD21  LEU  45          1HD2      LEU  45  12.376  12.843  -3.266
  357   HD22  LEU  45          2HD2      LEU  45  12.118  13.513  -1.655
  358   HD23  LEU  45          3HD2      LEU  45  12.436  14.588  -3.017
  359    H    ASP  46           H        ASP  46   7.937  10.082  -1.513
  360    HA   ASP  46           HA       ASP  46   8.522   9.823   1.355
  361    HB2  ASP  46           1HB      ASP  46   5.975   9.836  -0.231
  362    HB3  ASP  46           2HB      ASP  46   6.020   9.081   1.360
  363    H    HIS  47           H        HIS  47   9.638   8.161  -0.852
  364    HA   HIS  47           HA       HIS  47   9.363   5.630   0.422
  365    HB2  HIS  47           1HB      HIS  47   8.149   4.396  -1.121
  366    HB3  HIS  47           2HB      HIS  47   7.276   5.926  -1.125
  367    HD1  HIS  47           1HD      HIS  47   6.692   6.638  -3.406
  368    HD2  HIS  47           2HD      HIS  47  10.277   4.541  -3.330
  369    HE1  HIS  47           1HE      HIS  47   7.469   6.548  -5.796
  370    H    ASP  48           H        ASP  48  11.152   4.445   0.087
  371    HA   ASP  48           HA       ASP  48  13.391   5.491  -1.174
  372    HB2  ASP  48           1HB      ASP  48  12.638   2.797  -0.144
  373    HB3  ASP  48           2HB      ASP  48  14.068   2.916  -1.167
  374    H    CYS  49           H        CYS  49  12.958   6.164  -3.266
  375    HA   CYS  49           HA       CYS  49  11.925   4.321  -5.230
  376    HB2  CYS  49           1HB      CYS  49  11.525   6.838  -5.200
  377    HB3  CYS  49           2HB      CYS  49  13.183   7.011  -5.766
  378    H    SER  50           H        SER  50  13.129   2.819  -6.162
  379    HA   SER  50           HA       SER  50  16.025   3.052  -6.166
  380    HB2  SER  50           1HB      SER  50  14.749   0.920  -5.570
  381    HB3  SER  50           2HB      SER  50  14.406   0.767  -7.293
  382    HG   SER  50           HG       SER  50  16.409  -0.261  -6.285
  383    H    GLY  51           H        GLY  51  13.476   2.411  -8.580
  384    HA2  GLY  51           1HA      GLY  51  13.335   3.395 -10.711
  385    HA3  GLY  51           2HA      GLY  51  14.989   3.962 -10.534
  386    H    GLU  52           H        GLU  52  12.998   1.129 -11.200
  387    HA   GLU  52           HA       GLU  52  14.671  -0.891 -11.650
  388    HB2  GLU  52           1HB      GLU  52  12.290  -0.954 -12.249
  389    HB3  GLU  52           2HB      GLU  52  12.615   0.041 -13.661
  390    HG2  GLU  52           1HG      GLU  52  14.026  -1.725 -14.585
  391    HG3  GLU  52           2HG      GLU  52  13.696  -2.725 -13.171
  392    H    GLY  53           H        GLY  53  14.367   1.905 -13.808
  393    HA2  GLY  53           1HA      GLY  53  16.097   1.050 -15.831
  394    HA3  GLY  53           2HA      GLY  53  15.768   2.728 -15.428
  395    H    HIS  54           H        HIS  54  17.886   0.001 -14.875
  396    HA   HIS  54           HA       HIS  54  19.882   1.864 -13.770
  397    HB2  HIS  54           1HB      HIS  54  20.756   0.052 -12.382
  398    HB3  HIS  54           2HB      HIS  54  19.058   0.342 -12.019
  399    HD1  HIS  54           1HD      HIS  54  20.694  -1.861 -14.662
  400    HD2  HIS  54           2HD      HIS  54  17.996  -2.087 -11.511
  401    HE1  HIS  54           1HE      HIS  54  19.870  -4.237 -14.652
  402    HA   PRO  55           HA       PRO  55  22.538   0.611 -17.037
  403    HB2  PRO  55           1HB      PRO  55  24.957   1.003 -15.870
  404    HB3  PRO  55           2HB      PRO  55  23.917   2.332 -16.395
  405    HG2  PRO  55           1HG      PRO  55  24.289   1.186 -13.654
  406    HG3  PRO  55           2HG      PRO  55  24.180   2.884 -14.151
  407    HD2  PRO  55           1HD      PRO  55  22.089   1.546 -13.072
  408    HD3  PRO  55           2HD      PRO  55  21.880   2.831 -14.279
  409    H    THR  56           H        THR  56  24.016  -1.021 -17.700
  410    HA   THR  56           HA       THR  56  23.649  -3.521 -16.433
  411    HB   THR  56           HB       THR  56  24.062  -3.216 -18.882
  412    HG1  THR  56           1HG      THR  56  25.097  -5.100 -17.222
  413   HG21  THR  56          1HG2      THR  56  26.170  -2.736 -19.752
  414   HG22  THR  56          2HG2      THR  56  26.987  -3.089 -18.230
  415   HG23  THR  56          3HG2      THR  56  26.036  -1.614 -18.399
  416    H    SER  57           H        SER  57  24.970  -4.742 -15.155
  417    HA   SER  57           HA       SER  57  27.471  -3.478 -14.242
  418    HB2  SER  57           1HB      SER  57  27.045  -4.217 -12.000
  419    HB3  SER  57           2HB      SER  57  25.586  -3.401 -12.563
  420    HG   SER  57           HG       SER  57  25.334  -5.928 -13.233
  421    H    SER  58           H        SER  58  29.236  -4.786 -13.938
  422    HA   SER  58           HA       SER  58  29.658  -6.962 -15.519
  423    HB2  SER  58           1HB      SER  58  30.946  -5.999 -13.005
  424    HB3  SER  58           2HB      SER  58  31.395  -7.594 -13.607
  425    HG   SER  58           HG       SER  58  32.351  -6.708 -15.290
  426    H    GLY  59           H        GLY  59  28.608  -7.025 -12.123
  427    HA2  GLY  59           1HA      GLY  59  26.826  -9.071 -12.236
  428    HA3  GLY  59           2HA      GLY  59  28.371  -9.899 -12.108
  429    HA   PRO  60           HA       PRO  60  26.647  -8.533  -7.894
  430    HB2  PRO  60           1HB      PRO  60  25.881 -10.975  -6.987
  431    HB3  PRO  60           2HB      PRO  60  24.797  -9.896  -7.873
  432    HG2  PRO  60           1HG      PRO  60  26.357 -12.249  -8.869
  433    HG3  PRO  60           2HG      PRO  60  24.683 -11.784  -9.225
  434    HD2  PRO  60           1HD      PRO  60  26.728 -11.286 -10.929
  435    HD3  PRO  60           2HD      PRO  60  25.319 -10.215 -10.789
  436    H    SER  61           H        SER  61  27.991  -8.533  -6.177
  437    HA   SER  61           HA       SER  61  30.489  -9.934  -6.377
  438    HB2  SER  61           1HB      SER  61  29.320  -7.899  -4.528
  439    HB3  SER  61           2HB      SER  61  30.713  -8.831  -3.977
  440    HG   SER  61           HG       SER  61  31.687  -8.166  -6.057
  441    H    SER  62           H        SER  62  29.821 -12.126  -6.267
  442    HA   SER  62           HA       SER  62  28.575 -13.064  -3.814
  443    HB2  SER  62           1HB      SER  62  28.717 -15.307  -4.932
  444    HB3  SER  62           2HB      SER  62  27.814 -14.104  -5.853
  445    HG   SER  62           HG       SER  62  30.086 -15.437  -6.512
  446    H    GLY  63           H        GLY  63  29.523 -14.640  -2.433
  447    HA2  GLY  63           1HA      GLY  63  32.396 -15.103  -2.702
  448    HA3  GLY  63           2HA      GLY  63  31.865 -14.211  -1.284
  Start of MODEL   16
    1    H1   GLY   1           H        GLY   1 -24.669 -14.003  -4.084
    2    HA2  GLY   1           1HA      GLY   1 -24.111 -11.480  -5.368
    3    HA3  GLY   1           2HA      GLY   1 -24.710 -11.314  -3.724
    4    H    SER   2           H        SER   2 -23.494 -12.370  -2.007
    5    HA   SER   2           HA       SER   2 -20.657 -12.756  -2.701
    6    HB2  SER   2           1HB      SER   2 -21.876 -11.114  -0.495
    7    HB3  SER   2           2HB      SER   2 -20.243 -11.761  -0.341
    8    HG   SER   2           HG       SER   2 -21.201  -9.726  -1.943
    9    H    SER   3           H        SER   3 -22.460 -14.858  -2.523
   10    HA   SER   3           HA       SER   3 -22.442 -16.031   0.087
   11    HB2  SER   3           1HB      SER   3 -23.073 -17.175  -2.641
   12    HB3  SER   3           2HB      SER   3 -23.245 -18.079  -1.138
   13    HG   SER   3           HG       SER   3 -25.208 -17.086  -1.790
   14    H    GLY   4           H        GLY   4 -20.400 -16.303   0.875
   15    HA2  GLY   4           1HA      GLY   4 -18.811 -18.195   1.059
   16    HA3  GLY   4           2HA      GLY   4 -18.636 -18.089  -0.686
   17    H    SER   5           H        SER   5 -18.437 -15.319  -0.980
   18    HA   SER   5           HA       SER   5 -15.825 -14.843   0.289
   19    HB2  SER   5           1HB      SER   5 -16.954 -14.144  -2.393
   20    HB3  SER   5           2HB      SER   5 -15.711 -13.105  -1.694
   21    HG   SER   5           HG       SER   5 -15.127 -15.773  -1.517
   22    H    SER   6           H        SER   6 -15.608 -13.206   1.666
   23    HA   SER   6           HA       SER   6 -17.872 -11.540   2.278
   24    HB2  SER   6           1HB      SER   6 -15.061 -11.544   3.405
   25    HB3  SER   6           2HB      SER   6 -16.414 -10.620   4.056
   26    HG   SER   6           HG       SER   6 -15.787 -13.239   4.398
   27    H    GLY   7           H        GLY   7 -14.477 -10.760   1.476
   28    HA2  GLY   7           1HA      GLY   7 -15.293  -8.744  -0.410
   29    HA3  GLY   7           2HA      GLY   7 -14.668  -8.071   1.089
   30    H    ARG   8           H        ARG   8 -12.504  -8.009   1.432
   31    HA   ARG   8           HA       ARG   8 -10.362  -7.713   0.582
   32    HB2  ARG   8           1HB      ARG   8  -9.137  -9.765   0.750
   33    HB3  ARG   8           2HB      ARG   8 -10.419  -9.804   1.954
   34    HG2  ARG   8           1HG      ARG   8 -11.744 -11.075   0.112
   35    HG3  ARG   8           2HG      ARG   8 -10.142 -11.372  -0.567
   36    HD2  ARG   8           1HD      ARG   8 -10.741 -11.931   2.318
   37    HD3  ARG   8           2HD      ARG   8 -11.128 -13.105   1.061
   38    HE   ARG   8           HE       ARG   8  -8.405 -12.129   1.044
   39   HH11  ARG   8          2HH1      ARG   8 -10.619 -14.571   2.162
   40   HH12  ARG   8          1HH1      ARG   8  -9.382 -15.750   2.445
   41   HH21  ARG   8          2HH2      ARG   8  -6.766 -13.673   1.411
   42   HH22  ARG   8          1HH2      ARG   8  -7.190 -15.238   2.018
   43    H    LYS   9           H        LYS   9 -11.961  -7.147  -1.513
   44    HA   LYS   9           HA       LYS   9 -11.505  -8.795  -3.793
   45    HB2  LYS   9           1HB      LYS   9 -12.636  -6.070  -3.323
   46    HB3  LYS   9           2HB      LYS   9 -12.187  -6.526  -4.961
   47    HG2  LYS   9           1HG      LYS   9 -13.615  -8.648  -4.462
   48    HG3  LYS   9           2HG      LYS   9 -14.325  -7.633  -3.204
   49    HD2  LYS   9           1HD      LYS   9 -15.725  -7.189  -4.976
   50    HD3  LYS   9           2HD      LYS   9 -14.539  -5.893  -5.149
   51    HE2  LYS   9           1HE      LYS   9 -13.393  -7.081  -6.876
   52    HE3  LYS   9           2HE      LYS   9 -14.356  -8.530  -6.594
   53    HZ1  LYS   9           1HZ      LYS   9 -15.252  -5.958  -7.760
   54    HZ2  LYS   9           2HZ      LYS   9 -16.332  -7.153  -7.242
   55    HZ3  LYS   9           3HZ      LYS   9 -15.242  -7.483  -8.494
   56    H    ILE  10           H        ILE  10 -10.494  -7.739  -5.820
   57    HA   ILE  10           HA       ILE  10  -7.794  -6.890  -5.066
   58    HB   ILE  10           HB       ILE  10  -8.791  -7.824  -7.759
   59   HG12  ILE  10          1HG1      ILE  10  -7.133  -9.394  -5.787
   60   HG13  ILE  10          2HG1      ILE  10  -8.888  -9.510  -5.849
   61   HG21  ILE  10          1HG2      ILE  10  -6.407  -6.525  -6.981
   62   HG22  ILE  10          2HG2      ILE  10  -5.999  -8.203  -7.335
   63   HG23  ILE  10          3HG2      ILE  10  -6.810  -7.218  -8.552
   64   HD11  ILE  10          1HD1      ILE  10  -7.717 -11.309  -7.072
   65   HD12  ILE  10          2HD1      ILE  10  -8.805 -10.361  -8.086
   66   HD13  ILE  10          3HD1      ILE  10  -7.064 -10.092  -8.168
   67    H    PHE  11           H        PHE  11 -10.675  -5.735  -6.554
   68    HA   PHE  11           HA       PHE  11  -9.968  -3.832  -8.327
   69    HB2  PHE  11           1HB      PHE  11 -11.943  -2.663  -7.799
   70    HB3  PHE  11           2HB      PHE  11 -12.281  -4.326  -7.330
   71    HD1  PHE  11           1HD      PHE  11 -10.988  -4.565  -4.746
   72    HD2  PHE  11           2HD      PHE  11 -13.172  -1.308  -6.399
   73    HE1  PHE  11           1HE      PHE  11 -11.567  -3.808  -2.478
   74    HE2  PHE  11           2HE      PHE  11 -13.754  -0.544  -4.133
   75    HZ   PHE  11           HZ       PHE  11 -12.951  -1.794  -2.169
   76    H    THR  12           H        THR  12  -9.209  -3.843  -4.949
   77    HA   THR  12           HA       THR  12  -8.129  -1.114  -5.134
   78    HB   THR  12           HB       THR  12  -7.866  -1.457  -2.573
   79    HG1  THR  12           1HG      THR  12  -8.440  -3.760  -2.778
   80   HG21  THR  12          1HG2      THR  12  -9.445   0.113  -3.552
   81   HG22  THR  12          2HG2      THR  12 -10.196  -0.735  -2.200
   82   HG23  THR  12          3HG2      THR  12 -10.587  -1.195  -3.857
   83    H    ASN  13           H        ASN  13  -6.195  -1.557  -6.191
   84    HA   ASN  13           HA       ASN  13  -4.400  -3.560  -5.863
   85    HB2  ASN  13           1HB      ASN  13  -3.360  -0.747  -5.950
   86    HB3  ASN  13           2HB      ASN  13  -2.781  -2.173  -6.806
   87   HD21  ASN  13          1HD2      ASN  13  -4.826   0.544  -6.891
   88   HD22  ASN  13          2HD2      ASN  13  -5.524   0.262  -8.446
   89    H    LYS  14           H        LYS  14  -2.260  -3.541  -4.723
   90    HA   LYS  14           HA       LYS  14  -2.588  -2.559  -1.963
   91    HB2  LYS  14           1HB      LYS  14  -2.725  -5.047  -2.241
   92    HB3  LYS  14           2HB      LYS  14  -1.069  -5.022  -2.833
   93    HG2  LYS  14           1HG      LYS  14  -0.678  -3.743  -0.538
   94    HG3  LYS  14           2HG      LYS  14  -2.111  -4.668  -0.085
   95    HD2  LYS  14           1HD      LYS  14  -0.306  -6.044   0.504
   96    HD3  LYS  14           2HD      LYS  14  -0.880  -6.700  -1.031
   97    HE2  LYS  14           1HE      LYS  14   0.887  -5.180  -2.108
   98    HE3  LYS  14           2HE      LYS  14   1.566  -5.047  -0.486
   99    HZ1  LYS  14           1HZ      LYS  14   2.338  -7.139  -0.545
  100    HZ2  LYS  14           2HZ      LYS  14   2.230  -6.956  -2.223
  101    HZ3  LYS  14           3HZ      LYS  14   0.996  -7.745  -1.378
  102    H    CYS  15           H        CYS  15  -1.228  -0.967  -1.512
  103    HA   CYS  15           HA       CYS  15   0.802   0.036  -3.002
  104    HB2  CYS  15           1HB      CYS  15  -0.063   1.125  -0.977
  105    HB3  CYS  15           2HB      CYS  15   0.738  -0.085   0.021
  106    H    GLU  16           H        GLU  16   2.937  -0.339  -3.362
  107    HA   GLU  16           HA       GLU  16   3.949  -2.945  -2.533
  108    HB2  GLU  16           1HB      GLU  16   5.061  -0.944  -4.508
  109    HB3  GLU  16           2HB      GLU  16   5.710  -2.550  -4.212
  110    HG2  GLU  16           1HG      GLU  16   3.225  -3.252  -4.804
  111    HG3  GLU  16           2HG      GLU  16   3.276  -1.725  -5.682
  112    H    ARG  17           H        ARG  17   3.795  -0.549  -0.738
  113    HA   ARG  17           HA       ARG  17   6.607   0.035  -0.238
  114    HB2  ARG  17           1HB      ARG  17   4.966   1.872  -0.149
  115    HB3  ARG  17           2HB      ARG  17   4.123   1.049   1.156
  116    HG2  ARG  17           1HG      ARG  17   5.455   2.758   2.123
  117    HG3  ARG  17           2HG      ARG  17   6.218   1.213   2.506
  118    HD2  ARG  17           1HD      ARG  17   7.547   1.711   0.284
  119    HD3  ARG  17           2HD      ARG  17   7.113   3.377   0.668
  120    HE   ARG  17           HE       ARG  17   8.966   1.679   2.103
  121   HH11  ARG  17          2HH1      ARG  17   7.037   4.576   2.133
  122   HH12  ARG  17          1HH1      ARG  17   7.975   5.344   3.371
  123   HH21  ARG  17          2HH2      ARG  17  10.209   2.679   3.733
  124   HH22  ARG  17          1HH2      ARG  17   9.780   4.265   4.280
  125    H    ALA  18           H        ALA  18   7.591  -0.313   1.814
  126    HA   ALA  18           HA       ALA  18   6.825  -2.824   3.007
  127    HB1  ALA  18           1HB      ALA  18   9.003  -1.181   4.175
  128    HB2  ALA  18           2HB      ALA  18   8.933  -2.915   3.862
  129    HB3  ALA  18           3HB      ALA  18   9.221  -1.791   2.534
  130    H    GLY  19           H        GLY  19   5.746  -3.131   4.857
  131    HA2  GLY  19           1HA      GLY  19   4.707  -2.700   6.864
  132    HA3  GLY  19           2HA      GLY  19   5.772  -1.314   7.039
  133    H    CYS  20           H        CYS  20   3.546  -1.820   4.364
  134    HA   CYS  20           HA       CYS  20   1.879   0.376   5.400
  135    HB2  CYS  20           1HB      CYS  20   3.428   1.112   3.565
  136    HB3  CYS  20           2HB      CYS  20   2.611  -0.021   2.494
  137    H    ARG  21           H        ARG  21  -0.293   0.142   5.198
  138    HA   ARG  21           HA       ARG  21  -1.257  -2.268   3.802
  139    HB2  ARG  21           1HB      ARG  21  -1.806  -1.256   6.541
  140    HB3  ARG  21           2HB      ARG  21  -3.161  -1.951   5.661
  141    HG2  ARG  21           1HG      ARG  21  -2.394  -3.820   6.690
  142    HG3  ARG  21           2HG      ARG  21  -1.414  -3.887   5.224
  143    HD2  ARG  21           1HD      ARG  21  -0.355  -2.368   7.548
  144    HD3  ARG  21           2HD      ARG  21  -0.351  -4.129   7.640
  145    HE   ARG  21           HE       ARG  21   1.319  -2.473   5.986
  146   HH11  ARG  21          2HH1      ARG  21  -0.084  -5.633   6.389
  147   HH12  ARG  21          1HH1      ARG  21   1.125  -6.434   5.440
  148   HH21  ARG  21          2HH2      ARG  21   2.917  -3.516   4.735
  149   HH22  ARG  21          1HH2      ARG  21   2.832  -5.229   4.500
  150    H    GLN  22           H        GLN  22  -1.043   0.454   2.792
  151    HA   GLN  22           HA       GLN  22  -3.635   1.655   2.827
  152    HB2  GLN  22           1HB      GLN  22  -1.062   2.142   1.421
  153    HB3  GLN  22           2HB      GLN  22  -2.517   2.796   0.681
  154    HG2  GLN  22           1HG      GLN  22  -1.296   3.452   3.330
  155    HG3  GLN  22           2HG      GLN  22  -1.725   4.530   2.003
  156   HE21  GLN  22          1HE2      GLN  22  -4.205   4.219   1.440
  157   HE22  GLN  22          2HE2      GLN  22  -5.251   4.391   2.805
  158    H    ARG  23           H        ARG  23  -4.988   1.962   0.918
  159    HA   ARG  23           HA       ARG  23  -4.729  -0.017  -1.197
  160    HB2  ARG  23           1HB      ARG  23  -7.087   0.070   0.690
  161    HB3  ARG  23           2HB      ARG  23  -7.094  -0.779  -0.850
  162    HG2  ARG  23           1HG      ARG  23  -5.520  -2.352  -0.120
  163    HG3  ARG  23           2HG      ARG  23  -5.050  -1.362   1.264
  164    HD2  ARG  23           1HD      ARG  23  -6.393  -2.874   2.319
  165    HD3  ARG  23           2HD      ARG  23  -7.600  -1.664   1.888
  166    HE   ARG  23           HE       ARG  23  -7.421  -3.505  -0.206
  167   HH11  ARG  23          2HH1      ARG  23  -8.437  -3.373   3.121
  168   HH12  ARG  23          1HH1      ARG  23  -9.620  -4.626   2.946
  169   HH21  ARG  23          2HH2      ARG  23  -8.975  -5.157  -0.450
  170   HH22  ARG  23          1HH2      ARG  23  -9.925  -5.641   0.914
  171    H    GLU  24           H        GLU  24  -4.756   1.349  -2.877
  172    HA   GLU  24           HA       GLU  24  -6.754   3.498  -2.927
  173    HB2  GLU  24           1HB      GLU  24  -4.112   3.081  -4.252
  174    HB3  GLU  24           2HB      GLU  24  -5.305   4.087  -5.061
  175    HG2  GLU  24           1HG      GLU  24  -4.545   4.565  -2.205
  176    HG3  GLU  24           2HG      GLU  24  -3.593   5.220  -3.536
  177    H    MET  25           H        MET  25  -8.584   3.087  -3.960
  178    HA   MET  25           HA       MET  25  -9.234   0.880  -5.434
  179    HB2  MET  25           1HB      MET  25 -11.005   2.375  -6.512
  180    HB3  MET  25           2HB      MET  25 -11.008   2.268  -4.756
  181    HG2  MET  25           1HG      MET  25 -11.205   4.506  -4.954
  182    HG3  MET  25           2HG      MET  25  -9.447   4.398  -5.012
  183    HE1  MET  25           1HE      MET  25 -11.984   6.543  -7.829
  184    HE2  MET  25           2HE      MET  25 -12.735   5.008  -7.394
  185    HE3  MET  25           3HE      MET  25 -12.179   6.107  -6.131
  186    H    MET  26           H        MET  26  -7.646   3.806  -6.542
  187    HA   MET  26           HA       MET  26  -7.690   2.886  -9.309
  188    HB2  MET  26           1HB      MET  26  -6.753   5.040  -9.871
  189    HB3  MET  26           2HB      MET  26  -8.118   5.273  -8.787
  190    HG2  MET  26           1HG      MET  26  -6.461   5.436  -6.907
  191    HG3  MET  26           2HG      MET  26  -5.194   5.468  -8.131
  192    HE1  MET  26           1HE      MET  26  -8.309   8.287  -6.851
  193    HE2  MET  26           2HE      MET  26  -7.469   6.976  -6.023
  194    HE3  MET  26           3HE      MET  26  -6.775   8.598  -6.038
  195    H    LYS  27           H        LYS  27  -5.532   3.227 -10.519
  196    HA   LYS  27           HA       LYS  27  -3.472   1.772  -9.020
  197    HB2  LYS  27           1HB      LYS  27  -4.156   0.643 -11.026
  198    HB3  LYS  27           2HB      LYS  27  -3.958   2.105 -11.982
  199    HG2  LYS  27           1HG      LYS  27  -1.596   2.010 -11.801
  200    HG3  LYS  27           2HG      LYS  27  -1.677   0.746 -10.572
  201    HD2  LYS  27           1HD      LYS  27  -1.199  -0.518 -12.422
  202    HD3  LYS  27           2HD      LYS  27  -2.964  -0.550 -12.473
  203    HE2  LYS  27           1HE      LYS  27  -2.683   1.586 -13.938
  204    HE3  LYS  27           2HE      LYS  27  -1.041   0.988 -14.171
  205    HZ1  LYS  27           1HZ      LYS  27  -1.761  -0.811 -15.345
  206    HZ2  LYS  27           2HZ      LYS  27  -2.965   0.296 -15.777
  207    HZ3  LYS  27           3HZ      LYS  27  -3.272  -0.866 -14.587
  208    H    LEU  28           H        LEU  28  -1.795   2.877  -8.278
  209    HA   LEU  28           HA       LEU  28  -0.984   5.329  -9.698
  210    HB2  LEU  28           1HB      LEU  28  -0.727   4.660  -6.770
  211    HB3  LEU  28           2HB      LEU  28  -0.106   6.120  -7.536
  212    HG   LEU  28           HG       LEU  28  -3.025   5.495  -7.695
  213   HD11  LEU  28          1HD1      LEU  28  -1.946   7.098  -5.420
  214   HD12  LEU  28          2HD1      LEU  28  -2.060   5.343  -5.283
  215   HD13  LEU  28          3HD1      LEU  28  -3.509   6.299  -5.593
  216   HD21  LEU  28          1HD2      LEU  28  -3.233   7.647  -8.333
  217   HD22  LEU  28          2HD2      LEU  28  -1.532   7.466  -8.766
  218   HD23  LEU  28          3HD2      LEU  28  -1.977   8.209  -7.229
  219    H    THR  29           H        THR  29   0.594   4.524 -11.011
  220    HA   THR  29           HA       THR  29   2.756   2.966  -9.778
  221    HB   THR  29           HB       THR  29   2.233   3.451 -12.717
  222    HG1  THR  29           1HG      THR  29   0.652   2.081 -12.197
  223   HG21  THR  29          1HG2      THR  29   4.006   2.084 -13.198
  224   HG22  THR  29          2HG2      THR  29   3.877   1.199 -11.678
  225   HG23  THR  29          3HG2      THR  29   4.596   2.809 -11.703
  226    H    CYS  30           H        CYS  30   4.699   3.834  -9.429
  227    HA   CYS  30           HA       CYS  30   5.224   6.543  -9.579
  228    HB2  CYS  30           1HB      CYS  30   6.486   4.676  -8.316
  229    HB3  CYS  30           2HB      CYS  30   7.419   4.498  -9.798
  230    H    GLU  31           H        GLU  31   7.135   7.508 -10.834
  231    HA   GLU  31           HA       GLU  31   6.759   6.846 -13.674
  232    HB2  GLU  31           1HB      GLU  31   7.237   9.108 -14.202
  233    HB3  GLU  31           2HB      GLU  31   6.131   9.150 -12.836
  234    HG2  GLU  31           1HG      GLU  31   9.041   9.208 -12.269
  235    HG3  GLU  31           2HG      GLU  31   8.293  10.658 -12.937
  236    H    ARG  32           H        ARG  32   8.981   6.671 -11.151
  237    HA   ARG  32           HA       ARG  32  11.275   6.631 -12.988
  238    HB2  ARG  32           1HB      ARG  32  11.071   6.963 -10.001
  239    HB3  ARG  32           2HB      ARG  32  12.596   6.592 -10.794
  240    HG2  ARG  32           1HG      ARG  32  12.445   8.641 -12.091
  241    HG3  ARG  32           2HG      ARG  32  10.884   9.006 -11.352
  242    HD2  ARG  32           1HD      ARG  32  12.684  10.266 -10.288
  243    HD3  ARG  32           2HD      ARG  32  11.943   9.133  -9.159
  244    HE   ARG  32           HE       ARG  32  14.025   7.722 -10.102
  245   HH11  ARG  32          2HH1      ARG  32  13.768  10.950  -8.825
  246   HH12  ARG  32          1HH1      ARG  32  15.377  10.964  -8.182
  247   HH21  ARG  32          2HH2      ARG  32  16.145   7.728  -9.259
  248   HH22  ARG  32          1HH2      ARG  32  16.728   9.131  -8.430
  249    H    CYS  33           H        CYS  33   9.947   4.824 -10.216
  250    HA   CYS  33           HA       CYS  33  11.501   2.482 -10.966
  251    HB2  CYS  33           1HB      CYS  33  10.459   1.494  -8.899
  252    HB3  CYS  33           2HB      CYS  33  11.427   2.937  -8.616
  253    H    SER  34           H        SER  34   8.327   3.740 -11.348
  254    HA   SER  34           HA       SER  34   6.464   2.958 -12.394
  255    HB2  SER  34           1HB      SER  34   8.622   1.232 -13.522
  256    HB3  SER  34           2HB      SER  34   6.947   0.775 -13.830
  257    HG   SER  34           HG       SER  34   7.948   3.380 -14.311
  258    H    ARG  35           H        ARG  35   6.514   2.347  -9.799
  259    HA   ARG  35           HA       ARG  35   5.444  -0.395  -9.713
  260    HB2  ARG  35           1HB      ARG  35   7.202   1.015  -7.715
  261    HB3  ARG  35           2HB      ARG  35   6.207  -0.364  -7.266
  262    HG2  ARG  35           1HG      ARG  35   7.379  -1.558  -9.232
  263    HG3  ARG  35           2HG      ARG  35   8.565  -0.258  -9.098
  264    HD2  ARG  35           1HD      ARG  35   9.120  -0.864  -6.883
  265    HD3  ARG  35           2HD      ARG  35   7.715  -1.919  -6.741
  266    HE   ARG  35           HE       ARG  35   8.905  -3.586  -7.764
  267   HH11  ARG  35          2HH1      ARG  35  10.535  -0.549  -8.254
  268   HH12  ARG  35          1HH1      ARG  35  11.947  -1.270  -8.951
  269   HH21  ARG  35          2HH2      ARG  35  10.760  -4.547  -8.680
  270   HH22  ARG  35          1HH2      ARG  35  12.074  -3.544  -9.193
  271    H    ASN  36           H        ASN  36   3.714  -0.755  -8.241
  272    HA   ASN  36           HA       ASN  36   1.900   1.442  -8.071
  273    HB2  ASN  36           1HB      ASN  36   1.129  -0.863  -8.471
  274    HB3  ASN  36           2HB      ASN  36   1.698  -1.329  -6.871
  275   HD21  ASN  36          1HD2      ASN  36  -0.543   0.792  -8.567
  276   HD22  ASN  36          2HD2      ASN  36  -1.714   0.867  -7.300
  277    H    PHE  37           H        PHE  37   1.130   2.516  -6.266
  278    HA   PHE  37           HA       PHE  37   2.066   1.898  -3.625
  279    HB2  PHE  37           1HB      PHE  37   3.034   4.458  -4.915
  280    HB3  PHE  37           2HB      PHE  37   3.302   3.970  -3.245
  281    HD1  PHE  37           2HD      PHE  37   4.525   1.682  -2.930
  282    HD2  PHE  37           1HD      PHE  37   4.648   4.009  -6.491
  283    HE1  PHE  37           2HE      PHE  37   6.604   0.547  -3.595
  284    HE2  PHE  37           1HE      PHE  37   6.727   2.877  -7.163
  285    HZ   PHE  37           HZ       PHE  37   7.708   1.145  -5.714
  286    H    CYS  38           H        CYS  38   1.385   3.727  -2.068
  287    HA   CYS  38           HA       CYS  38  -1.339   4.489  -2.808
  288    HB2  CYS  38           1HB      CYS  38  -1.752   4.752  -0.449
  289    HB3  CYS  38           2HB      CYS  38  -0.923   3.218  -0.698
  290    H    ILE  39           H        ILE  39  -2.143   6.597  -2.487
  291    HA   ILE  39           HA       ILE  39  -0.814   8.700  -3.486
  292    HB   ILE  39           HB       ILE  39  -2.845   8.731  -1.262
  293   HG12  ILE  39          1HG1      ILE  39  -3.085   9.466  -4.186
  294   HG13  ILE  39          2HG1      ILE  39  -3.501   7.887  -3.529
  295   HG21  ILE  39          1HG2      ILE  39  -1.470  10.767  -1.150
  296   HG22  ILE  39          2HG2      ILE  39  -1.841  11.095  -2.841
  297   HG23  ILE  39          3HG2      ILE  39  -3.129  11.109  -1.638
  298   HD11  ILE  39          1HD1      ILE  39  -5.270   8.821  -2.232
  299   HD12  ILE  39          2HD1      ILE  39  -4.776  10.463  -2.648
  300   HD13  ILE  39          3HD1      ILE  39  -5.436   9.398  -3.890
  301    H    LYS  40           H        LYS  40  -0.616   7.598  -0.144
  302    HA   LYS  40           HA       LYS  40   0.912   9.765   0.841
  303    HB2  LYS  40           1HB      LYS  40   0.244   7.020   1.773
  304    HB3  LYS  40           2HB      LYS  40   1.627   7.810   2.519
  305    HG2  LYS  40           1HG      LYS  40  -0.107   8.384   3.927
  306    HG3  LYS  40           2HG      LYS  40   0.009   9.793   2.870
  307    HD2  LYS  40           1HD      LYS  40  -2.310   9.197   3.128
  308    HD3  LYS  40           2HD      LYS  40  -1.806   8.833   1.475
  309    HE2  LYS  40           1HE      LYS  40  -1.672   6.507   1.941
  310    HE3  LYS  40           2HE      LYS  40  -1.834   6.779   3.676
  311    HZ1  LYS  40           1HZ      LYS  40  -4.014   6.592   3.463
  312    HZ2  LYS  40           2HZ      LYS  40  -3.860   6.339   1.798
  313    HZ3  LYS  40           3HZ      LYS  40  -4.053   7.908   2.400
  314    H    HIS  41           H        HIS  41   1.798   6.629  -0.535
  315    HA   HIS  41           HA       HIS  41   4.619   7.467  -0.503
  316    HB2  HIS  41           1HB      HIS  41   3.460   4.690  -0.822
  317    HB3  HIS  41           2HB      HIS  41   5.174   5.089  -0.766
  318    HD2  HIS  41           2HD      HIS  41   5.102   7.016   1.906
  319    HE1  HIS  41           1HE      HIS  41   3.452   3.586   3.781
  320    HE2  HIS  41           2HE      HIS  41   4.502   5.848   4.135
  321    H    ARG  42           H        ARG  42   2.349   8.071  -2.459
  322    HA   ARG  42           HA       ARG  42   3.011   6.740  -4.890
  323    HB2  ARG  42           1HB      ARG  42   0.878   7.571  -5.009
  324    HB3  ARG  42           2HB      ARG  42   1.276   9.021  -4.097
  325    HG2  ARG  42           1HG      ARG  42   0.791   9.740  -6.281
  326    HG3  ARG  42           2HG      ARG  42   2.549   9.800  -6.135
  327    HD2  ARG  42           1HD      ARG  42   2.303   7.318  -7.073
  328    HD3  ARG  42           2HD      ARG  42   0.829   8.006  -7.753
  329    HE   ARG  42           HE       ARG  42   3.296   9.483  -8.199
  330   HH11  ARG  42          2HH1      ARG  42   0.906   7.271  -9.429
  331   HH12  ARG  42          1HH1      ARG  42   1.334   7.526 -11.088
  332   HH21  ARG  42          2HH2      ARG  42   3.869   9.828 -10.379
  333   HH22  ARG  42          1HH2      ARG  42   3.020   8.981 -11.628
  334    H    HIS  43           H        HIS  43   4.132   9.627  -3.282
  335    HA   HIS  43           HA       HIS  43   5.586  10.575  -5.600
  336    HB2  HIS  43           1HB      HIS  43   4.517  11.901  -3.526
  337    HB3  HIS  43           2HB      HIS  43   6.150  11.686  -2.903
  338    HD1  HIS  43           1HD      HIS  43   7.955  13.171  -3.847
  339    HD2  HIS  43           2HD      HIS  43   4.379  13.448  -5.944
  340    HE1  HIS  43           1HE      HIS  43   8.250  15.105  -5.427
  341    HA   PRO  44           HA       PRO  44   9.290   8.319  -4.836
  342    HB2  PRO  44           1HB      PRO  44  11.039   9.923  -6.155
  343    HB3  PRO  44           2HB      PRO  44   9.887   8.870  -6.985
  344    HG2  PRO  44           1HG      PRO  44   9.706  11.805  -6.423
  345    HG3  PRO  44           2HG      PRO  44   9.297  10.922  -7.905
  346    HD2  PRO  44           1HD      PRO  44   7.422  11.731  -6.127
  347    HD3  PRO  44           2HD      PRO  44   7.249  10.250  -7.089
  348    H    LEU  45           H        LEU  45   8.504  11.140  -3.338
  349    HA   LEU  45           HA       LEU  45  11.128  11.542  -2.101
  350    HB2  LEU  45           1HB      LEU  45   8.582  13.142  -2.064
  351    HB3  LEU  45           2HB      LEU  45   9.952  13.506  -1.017
  352    HG   LEU  45           HG       LEU  45  10.061  13.507  -4.032
  353   HD11  LEU  45          1HD1      LEU  45   9.955  15.889  -3.941
  354   HD12  LEU  45          2HD1      LEU  45   9.946  15.877  -2.178
  355   HD13  LEU  45          3HD1      LEU  45   8.560  15.253  -3.070
  356   HD21  LEU  45          1HD2      LEU  45  12.029  13.902  -1.865
  357   HD22  LEU  45          2HD2      LEU  45  12.108  15.034  -3.215
  358   HD23  LEU  45          3HD2      LEU  45  12.251  13.301  -3.508
  359    H    ASP  46           H        ASP  46   7.949  10.313  -1.457
  360    HA   ASP  46           HA       ASP  46   8.617   9.977   1.387
  361    HB2  ASP  46           1HB      ASP  46   6.008  10.055  -0.105
  362    HB3  ASP  46           2HB      ASP  46   6.111   9.325   1.494
  363    H    HIS  47           H        HIS  47   9.561   8.348  -0.956
  364    HA   HIS  47           HA       HIS  47   9.216   5.781   0.277
  365    HB2  HIS  47           1HB      HIS  47   7.946   4.671  -1.288
  366    HB3  HIS  47           2HB      HIS  47   7.198   6.264  -1.363
  367    HD1  HIS  47           1HD      HIS  47   6.764   6.929  -3.691
  368    HD2  HIS  47           2HD      HIS  47  10.226   4.654  -3.370
  369    HE1  HIS  47           1HE      HIS  47   7.667   6.745  -6.031
  370    H    ASP  48           H        ASP  48  10.958   4.526  -0.077
  371    HA   ASP  48           HA       ASP  48  13.259   5.552  -1.271
  372    HB2  ASP  48           1HB      ASP  48  12.974   3.616   0.435
  373    HB3  ASP  48           2HB      ASP  48  12.804   2.594  -0.990
  374    H    CYS  49           H        CYS  49  12.873   6.247  -3.365
  375    HA   CYS  49           HA       CYS  49  11.828   4.441  -5.356
  376    HB2  CYS  49           1HB      CYS  49  11.483   6.963  -5.321
  377    HB3  CYS  49           2HB      CYS  49  13.156   7.105  -5.851
  378    H    SER  50           H        SER  50  12.952   3.120  -6.630
  379    HA   SER  50           HA       SER  50  15.865   3.130  -6.415
  380    HB2  SER  50           1HB      SER  50  14.271   1.050  -6.184
  381    HB3  SER  50           2HB      SER  50  14.338   1.055  -7.946
  382    HG   SER  50           HG       SER  50  16.057  -0.131  -7.471
  383    H    GLY  51           H        GLY  51  13.372   2.984  -8.960
  384    HA2  GLY  51           1HA      GLY  51  13.373   3.978 -11.050
  385    HA3  GLY  51           2HA      GLY  51  14.925   4.707 -10.663
  386    H    GLU  52           H        GLU  52  13.568   1.464 -11.274
  387    HA   GLU  52           HA       GLU  52  14.363  -0.311 -12.456
  388    HB2  GLU  52           1HB      GLU  52  14.113   1.452 -14.264
  389    HB3  GLU  52           2HB      GLU  52  15.843   1.727 -14.117
  390    HG2  GLU  52           1HG      GLU  52  16.206  -0.674 -14.652
  391    HG3  GLU  52           2HG      GLU  52  14.476  -0.816 -14.957
  392    H    GLY  53           H        GLY  53  15.800   0.266 -10.148
  393    HA2  GLY  53           1HA      GLY  53  18.580  -0.310 -10.967
  394    HA3  GLY  53           2HA      GLY  53  18.149   0.521  -9.480
  395    H    HIS  54           H        HIS  54  18.169  -2.570 -11.139
  396    HA   HIS  54           HA       HIS  54  17.962  -3.891  -8.515
  397    HB2  HIS  54           1HB      HIS  54  15.920  -4.447  -9.531
  398    HB3  HIS  54           2HB      HIS  54  16.653  -4.616 -11.123
  399    HD1  HIS  54           1HD      HIS  54  15.467  -6.571  -8.351
  400    HD2  HIS  54           2HD      HIS  54  18.447  -6.995 -11.215
  401    HE1  HIS  54           1HE      HIS  54  16.038  -9.020  -8.370
  402    HA   PRO  55           HA       PRO  55  21.994  -5.310  -9.825
  403    HB2  PRO  55           1HB      PRO  55  22.561  -6.622  -7.517
  404    HB3  PRO  55           2HB      PRO  55  22.687  -4.867  -7.679
  405    HG2  PRO  55           1HG      PRO  55  20.483  -6.505  -6.489
  406    HG3  PRO  55           2HG      PRO  55  21.209  -5.003  -5.889
  407    HD2  PRO  55           1HD      PRO  55  18.847  -5.052  -7.212
  408    HD3  PRO  55           2HD      PRO  55  19.975  -3.686  -7.324
  409    H    THR  56           H        THR  56  21.616  -6.827 -11.393
  410    HA   THR  56           HA       THR  56  20.131  -9.164 -11.169
  411    HB   THR  56           HB       THR  56  21.374  -9.995 -13.119
  412    HG1  THR  56           1HG      THR  56  23.366  -9.356 -13.373
  413   HG21  THR  56          1HG2      THR  56  19.968  -8.661 -14.222
  414   HG22  THR  56          2HG2      THR  56  21.231  -7.430 -14.235
  415   HG23  THR  56          3HG2      THR  56  20.033  -7.450 -12.941
  416    H    SER  57           H        SER  57  20.530 -11.205 -10.478
  417    HA   SER  57           HA       SER  57  23.070 -11.635  -9.062
  418    HB2  SER  57           1HB      SER  57  20.459 -13.130  -8.727
  419    HB3  SER  57           2HB      SER  57  21.898 -13.284  -7.718
  420    HG   SER  57           HG       SER  57  21.494 -11.373  -6.811
  421    H    SER  58           H        SER  58  24.490 -13.019  -9.874
  422    HA   SER  58           HA       SER  58  23.657 -15.413 -11.251
  423    HB2  SER  58           1HB      SER  58  25.055 -13.172 -12.713
  424    HB3  SER  58           2HB      SER  58  25.111 -14.844 -13.271
  425    HG   SER  58           HG       SER  58  22.748 -13.330 -12.832
  426    H    GLY  59           H        GLY  59  25.347 -16.937 -11.509
  427    HA2  GLY  59           1HA      GLY  59  27.881 -17.139 -11.399
  428    HA3  GLY  59           2HA      GLY  59  27.712 -16.313  -9.858
  429    HA   PRO  60           HA       PRO  60  25.669 -20.658  -9.265
  430    HB2  PRO  60           1HB      PRO  60  25.989 -22.439 -11.289
  431    HB3  PRO  60           2HB      PRO  60  24.610 -21.338 -11.187
  432    HG2  PRO  60           1HG      PRO  60  27.115 -21.093 -12.809
  433    HG3  PRO  60           2HG      PRO  60  25.438 -20.759 -13.281
  434    HD2  PRO  60           1HD      PRO  60  27.176 -18.800 -12.592
  435    HD3  PRO  60           2HD      PRO  60  25.434 -18.687 -12.270
  436    H    SER  61           H        SER  61  26.627 -22.529  -8.395
  437    HA   SER  61           HA       SER  61  29.485 -22.400  -8.167
  438    HB2  SER  61           1HB      SER  61  28.166 -22.974  -6.210
  439    HB3  SER  61           2HB      SER  61  27.476 -24.367  -7.044
  440    HG   SER  61           HG       SER  61  30.261 -24.166  -6.813
  441    H    SER  62           H        SER  62  29.993 -22.784 -10.426
  442    HA   SER  62           HA       SER  62  30.735 -24.075 -12.146
  443    HB2  SER  62           1HB      SER  62  31.830 -25.203 -10.082
  444    HB3  SER  62           2HB      SER  62  30.632 -26.473 -10.331
  445    HG   SER  62           HG       SER  62  32.838 -26.539 -11.444
  446    H    GLY  63           H        GLY  63  27.964 -23.674 -11.999
  447    HA2  GLY  63           1HA      GLY  63  26.241 -25.772 -12.120
  448    HA3  GLY  63           2HA      GLY  63  26.132 -24.394 -13.205
  Start of MODEL   17
    1    H1   GLY   1           H        GLY   1 -15.099 -20.981  15.946
    2    HA2  GLY   1           1HA      GLY   1 -16.082 -18.627  14.562
    3    HA3  GLY   1           2HA      GLY   1 -14.631 -18.730  15.548
    4    H    SER   2           H        SER   2 -15.190 -17.648  12.793
    5    HA   SER   2           HA       SER   2 -13.045 -19.122  11.413
    6    HB2  SER   2           1HB      SER   2 -15.022 -19.637  10.192
    7    HB3  SER   2           2HB      SER   2 -15.590 -17.969  10.267
    8    HG   SER   2           HG       SER   2 -14.587 -18.691   8.230
    9    H    SER   3           H        SER   3 -11.550 -17.908  10.258
   10    HA   SER   3           HA       SER   3 -11.558 -15.036  10.896
   11    HB2  SER   3           1HB      SER   3  -9.197 -16.780  10.157
   12    HB3  SER   3           2HB      SER   3  -9.136 -15.106  10.708
   13    HG   SER   3           HG       SER   3 -10.321 -16.058  12.633
   14    H    GLY   4           H        GLY   4 -12.486 -14.019   9.206
   15    HA2  GLY   4           1HA      GLY   4 -11.139 -14.265   6.617
   16    HA3  GLY   4           2HA      GLY   4 -12.876 -14.529   6.661
   17    H    SER   5           H        SER   5 -11.126 -12.425   5.395
   18    HA   SER   5           HA       SER   5 -12.307 -10.049   6.667
   19    HB2  SER   5           1HB      SER   5  -9.861 -10.386   4.931
   20    HB3  SER   5           2HB      SER   5 -10.566  -8.807   5.275
   21    HG   SER   5           HG       SER   5  -8.910  -9.332   6.755
   22    H    SER   6           H        SER   6 -13.821  -8.925   5.625
   23    HA   SER   6           HA       SER   6 -14.694  -9.837   3.018
   24    HB2  SER   6           1HB      SER   6 -16.257  -9.269   4.943
   25    HB3  SER   6           2HB      SER   6 -15.872  -7.575   4.638
   26    HG   SER   6           HG       SER   6 -16.500  -8.257   2.339
   27    H    GLY   7           H        GLY   7 -14.501  -8.773   1.119
   28    HA2  GLY   7           1HA      GLY   7 -14.362  -6.545   0.020
   29    HA3  GLY   7           2HA      GLY   7 -13.114  -6.163   1.197
   30    H    ARG   8           H        ARG   8 -13.621  -9.096  -0.741
   31    HA   ARG   8           HA       ARG   8 -10.855  -8.855  -1.677
   32    HB2  ARG   8           1HB      ARG   8 -12.745 -11.126  -1.286
   33    HB3  ARG   8           2HB      ARG   8 -11.521 -11.280  -2.539
   34    HG2  ARG   8           1HG      ARG   8  -9.872 -10.575  -0.670
   35    HG3  ARG   8           2HG      ARG   8 -11.178 -11.050   0.418
   36    HD2  ARG   8           1HD      ARG   8  -9.944 -13.002   0.223
   37    HD3  ARG   8           2HD      ARG   8 -11.221 -13.230  -0.971
   38    HE   ARG   8           HE       ARG   8  -9.135 -12.066  -2.333
   39   HH11  ARG   8          2HH1      ARG   8  -9.620 -14.967  -0.470
   40   HH12  ARG   8          1HH1      ARG   8  -8.449 -15.887  -1.356
   41   HH21  ARG   8          2HH2      ARG   8  -7.592 -13.267  -3.506
   42   HH22  ARG   8          1HH2      ARG   8  -7.296 -14.919  -3.082
   43    H    LYS   9           H        LYS   9 -11.353  -7.207  -3.233
   44    HA   LYS   9           HA       LYS   9 -12.606  -8.297  -5.665
   45    HB2  LYS   9           1HB      LYS   9 -12.863  -5.540  -4.476
   46    HB3  LYS   9           2HB      LYS   9 -13.219  -5.865  -6.167
   47    HG2  LYS   9           1HG      LYS   9 -14.552  -7.294  -3.881
   48    HG3  LYS   9           2HG      LYS   9 -15.202  -5.845  -4.651
   49    HD2  LYS   9           1HD      LYS   9 -15.315  -7.003  -6.785
   50    HD3  LYS   9           2HD      LYS   9 -14.587  -8.441  -6.065
   51    HE2  LYS   9           1HE      LYS   9 -17.163  -7.244  -5.074
   52    HE3  LYS   9           2HE      LYS   9 -17.107  -8.466  -6.344
   53    HZ1  LYS   9           1HZ      LYS   9 -17.032  -9.995  -4.765
   54    HZ2  LYS   9           2HZ      LYS   9 -16.963  -8.818  -3.552
   55    HZ3  LYS   9           3HZ      LYS   9 -15.535  -9.395  -4.253
   56    H    ILE  10           H        ILE  10 -11.657  -7.745  -7.632
   57    HA   ILE  10           HA       ILE  10  -8.858  -6.984  -7.436
   58    HB   ILE  10           HB       ILE  10 -10.374  -7.796  -9.914
   59   HG12  ILE  10          1HG1      ILE  10  -8.613  -9.689  -8.419
   60   HG13  ILE  10          2HG1      ILE  10 -10.246  -9.420  -7.822
   61   HG21  ILE  10          1HG2      ILE  10  -7.598  -8.527  -9.822
   62   HG22  ILE  10          2HG2      ILE  10  -8.453  -7.526 -10.995
   63   HG23  ILE  10          3HG2      ILE  10  -7.787  -6.797  -9.534
   64   HD11  ILE  10          1HD1      ILE  10 -11.026  -9.972 -10.173
   65   HD12  ILE  10          2HD1      ILE  10  -9.388 -10.562 -10.455
   66   HD13  ILE  10          3HD1      ILE  10 -10.388 -11.299  -9.203
   67    H    PHE  11           H        PHE  11 -11.046  -5.005  -7.085
   68    HA   PHE  11           HA       PHE  11 -10.740  -3.292  -9.427
   69    HB2  PHE  11           1HB      PHE  11 -12.577  -3.381  -7.090
   70    HB3  PHE  11           2HB      PHE  11 -12.248  -1.800  -7.793
   71    HD1  PHE  11           2HD      PHE  11 -13.269  -5.245  -8.770
   72    HD2  PHE  11           1HD      PHE  11 -13.512  -1.073  -9.578
   73    HE1  PHE  11           2HE      PHE  11 -14.935  -5.685 -10.526
   74    HE2  PHE  11           1HE      PHE  11 -15.179  -1.507 -11.335
   75    HZ   PHE  11           HZ       PHE  11 -15.891  -3.815 -11.812
   76    H    THR  12           H        THR  12  -9.873  -3.418  -6.019
   77    HA   THR  12           HA       THR  12  -8.525  -0.838  -6.182
   78    HB   THR  12           HB       THR  12  -8.072  -1.141  -3.777
   79    HG1  THR  12           1HG      THR  12  -8.219  -3.076  -2.951
   80   HG21  THR  12          1HG2      THR  12 -10.744  -1.618  -3.314
   81   HG22  THR  12          2HG2      THR  12 -10.726  -1.058  -4.986
   82   HG23  THR  12          3HG2      THR  12 -10.032  -0.056  -3.713
   83    H    ASN  13           H        ASN  13  -6.301  -0.720  -5.153
   84    HA   ASN  13           HA       ASN  13  -4.682  -3.056  -5.927
   85    HB2  ASN  13           1HB      ASN  13  -3.591  -0.280  -6.197
   86    HB3  ASN  13           2HB      ASN  13  -3.132  -1.747  -7.056
   87   HD21  ASN  13          1HD2      ASN  13  -5.591   0.736  -6.763
   88   HD22  ASN  13          2HD2      ASN  13  -6.229   0.556  -8.359
   89    H    LYS  14           H        LYS  14  -2.552  -3.140  -4.874
   90    HA   LYS  14           HA       LYS  14  -2.691  -2.034  -2.148
   91    HB2  LYS  14           1HB      LYS  14  -1.657  -3.953  -1.325
   92    HB3  LYS  14           2HB      LYS  14  -2.726  -4.585  -2.571
   93    HG2  LYS  14           1HG      LYS  14   0.165  -3.965  -3.094
   94    HG3  LYS  14           2HG      LYS  14  -0.382  -5.531  -2.490
   95    HD2  LYS  14           1HD      LYS  14  -2.029  -5.405  -4.518
   96    HD3  LYS  14           2HD      LYS  14  -0.857  -4.244  -5.145
   97    HE2  LYS  14           1HE      LYS  14   0.892  -6.060  -4.588
   98    HE3  LYS  14           2HE      LYS  14  -0.490  -7.153  -4.520
   99    HZ1  LYS  14           1HZ      LYS  14   0.645  -7.032  -6.717
  100    HZ2  LYS  14           2HZ      LYS  14   0.119  -5.431  -6.857
  101    HZ3  LYS  14           3HZ      LYS  14  -1.011  -6.688  -6.773
  102    H    CYS  15           H        CYS  15  -0.813  -1.203  -1.185
  103    HA   CYS  15           HA       CYS  15   0.978   0.090  -3.018
  104    HB2  CYS  15           1HB      CYS  15   0.186   1.236  -0.996
  105    HB3  CYS  15           2HB      CYS  15   0.978   0.026   0.008
  106    H    GLU  16           H        GLU  16   3.184  -0.214  -3.252
  107    HA   GLU  16           HA       GLU  16   4.121  -2.888  -2.565
  108    HB2  GLU  16           1HB      GLU  16   5.210  -0.758  -4.406
  109    HB3  GLU  16           2HB      GLU  16   6.039  -2.275  -4.086
  110    HG2  GLU  16           1HG      GLU  16   3.761  -3.326  -4.820
  111    HG3  GLU  16           2HG      GLU  16   3.535  -1.767  -5.611
  112    H    ARG  17           H        ARG  17   3.939  -0.490  -0.689
  113    HA   ARG  17           HA       ARG  17   6.758  -0.212   0.055
  114    HB2  ARG  17           1HB      ARG  17   5.325   1.823  -0.124
  115    HB3  ARG  17           2HB      ARG  17   4.346   1.204   1.199
  116    HG2  ARG  17           1HG      ARG  17   5.784   2.721   2.216
  117    HG3  ARG  17           2HG      ARG  17   6.524   1.152   2.540
  118    HD2  ARG  17           1HD      ARG  17   7.360   2.532   0.061
  119    HD3  ARG  17           2HD      ARG  17   7.886   3.253   1.582
  120    HE   ARG  17           HE       ARG  17   8.583   0.708   1.948
  121   HH11  ARG  17          2HH1      ARG  17   9.031   2.824  -0.780
  122   HH12  ARG  17          1HH1      ARG  17  10.497   2.060  -1.298
  123   HH21  ARG  17          2HH2      ARG  17  10.512  -0.307   1.276
  124   HH22  ARG  17          1HH2      ARG  17  11.338   0.279  -0.128
  125    H    ALA  18           H        ALA  18   7.512  -0.714   2.129
  126    HA   ALA  18           HA       ALA  18   6.262  -2.991   3.334
  127    HB1  ALA  18           1HB      ALA  18   8.192  -2.559   5.051
  128    HB2  ALA  18           2HB      ALA  18   8.550  -3.164   3.433
  129    HB3  ALA  18           3HB      ALA  18   8.774  -1.455   3.804
  130    H    GLY  19           H        GLY  19   5.175  -3.153   5.245
  131    HA2  GLY  19           1HA      GLY  19   3.966  -2.500   7.085
  132    HA3  GLY  19           2HA      GLY  19   5.097  -1.164   7.246
  133    H    CYS  20           H        CYS  20   3.130  -1.699   4.396
  134    HA   CYS  20           HA       CYS  20   1.429   0.573   5.170
  135    HB2  CYS  20           1HB      CYS  20   3.311   1.151   3.526
  136    HB3  CYS  20           2HB      CYS  20   2.427   0.178   2.354
  137    H    ARG  21           H        ARG  21   1.694  -1.580   2.343
  138    HA   ARG  21           HA       ARG  21   0.103  -2.754   1.202
  139    HB2  ARG  21           1HB      ARG  21  -0.607  -3.385   4.067
  140    HB3  ARG  21           2HB      ARG  21  -1.356  -4.190   2.695
  141    HG2  ARG  21           1HG      ARG  21   1.619  -4.146   3.065
  142    HG3  ARG  21           2HG      ARG  21   0.596  -5.361   3.835
  143    HD2  ARG  21           1HD      ARG  21   0.401  -4.838   0.893
  144    HD3  ARG  21           2HD      ARG  21   1.668  -5.883   1.537
  145    HE   ARG  21           HE       ARG  21  -0.519  -6.943   2.648
  146   HH11  ARG  21          2HH1      ARG  21   0.159  -5.972  -0.626
  147   HH12  ARG  21          1HH1      ARG  21  -0.887  -7.158  -1.333
  148   HH21  ARG  21          2HH2      ARG  21  -1.900  -8.509   1.729
  149   HH22  ARG  21          1HH2      ARG  21  -2.058  -8.600   0.008
  150    H    GLN  22           H        GLN  22  -0.517   0.021   1.688
  151    HA   GLN  22           HA       GLN  22  -3.131   0.477   2.541
  152    HB2  GLN  22           1HB      GLN  22  -1.153   1.910   0.889
  153    HB3  GLN  22           2HB      GLN  22  -2.829   2.355   0.598
  154    HG2  GLN  22           1HG      GLN  22  -1.236   2.597   3.120
  155    HG3  GLN  22           2HG      GLN  22  -2.086   3.853   2.221
  156   HE21  GLN  22          1HE2      GLN  22  -2.174   2.123   4.959
  157   HE22  GLN  22          2HE2      GLN  22  -3.872   2.125   5.274
  158    H    ARG  23           H        ARG  23  -4.920   1.262   1.028
  159    HA   ARG  23           HA       ARG  23  -5.104  -0.426  -1.369
  160    HB2  ARG  23           1HB      ARG  23  -6.891  -0.409   1.010
  161    HB3  ARG  23           2HB      ARG  23  -7.648  -0.563  -0.570
  162    HG2  ARG  23           1HG      ARG  23  -6.471  -2.567  -1.035
  163    HG3  ARG  23           2HG      ARG  23  -5.416  -2.347   0.363
  164    HD2  ARG  23           1HD      ARG  23  -6.981  -3.966   1.028
  165    HD3  ARG  23           2HD      ARG  23  -7.528  -2.465   1.775
  166    HE   ARG  23           HE       ARG  23  -8.721  -3.081  -0.788
  167   HH11  ARG  23          2HH1      ARG  23  -8.959  -3.333   2.676
  168   HH12  ARG  23          1HH1      ARG  23 -10.673  -3.587   2.670
  169   HH21  ARG  23          2HH2      ARG  23 -10.978  -3.414  -0.809
  170   HH22  ARG  23          1HH2      ARG  23 -11.820  -3.633   0.687
  171    H    GLU  24           H        GLU  24  -4.817   1.363  -2.696
  172    HA   GLU  24           HA       GLU  24  -6.612   3.634  -2.421
  173    HB2  GLU  24           1HB      GLU  24  -4.165   3.033  -4.005
  174    HB3  GLU  24           2HB      GLU  24  -5.288   4.215  -4.662
  175    HG2  GLU  24           1HG      GLU  24  -4.213   4.393  -1.867
  176    HG3  GLU  24           2HG      GLU  24  -3.390   5.105  -3.253
  177    H    MET  25           H        MET  25  -8.443   3.891  -3.523
  178    HA   MET  25           HA       MET  25  -9.694   1.908  -4.958
  179    HB2  MET  25           1HB      MET  25 -10.040   4.882  -4.878
  180    HB3  MET  25           2HB      MET  25 -10.989   3.928  -6.010
  181    HG2  MET  25           1HG      MET  25 -11.620   2.517  -3.952
  182    HG3  MET  25           2HG      MET  25 -11.030   3.893  -3.022
  183    HE1  MET  25           1HE      MET  25 -12.248   5.568  -2.269
  184    HE2  MET  25           2HE      MET  25 -12.300   6.619  -3.683
  185    HE3  MET  25           3HE      MET  25 -13.790   6.212  -2.831
  186    H    MET  26           H        MET  26  -7.615   4.495  -6.167
  187    HA   MET  26           HA       MET  26  -7.805   3.351  -8.867
  188    HB2  MET  26           1HB      MET  26  -7.006   5.443  -9.709
  189    HB3  MET  26           2HB      MET  26  -8.286   5.792  -8.555
  190    HG2  MET  26           1HG      MET  26  -6.273   5.994  -6.881
  191    HG3  MET  26           2HG      MET  26  -5.365   6.292  -8.361
  192    HE1  MET  26           1HE      MET  26  -5.324   9.684  -8.612
  193    HE2  MET  26           2HE      MET  26  -4.949   8.086  -9.259
  194    HE3  MET  26           3HE      MET  26  -6.255   9.040  -9.965
  195    H    LYS  27           H        LYS  27  -5.850   3.096 -10.113
  196    HA   LYS  27           HA       LYS  27  -3.698   2.023  -8.506
  197    HB2  LYS  27           1HB      LYS  27  -4.736   1.096 -10.741
  198    HB3  LYS  27           2HB      LYS  27  -3.583   2.191 -11.491
  199    HG2  LYS  27           1HG      LYS  27  -1.748   1.031 -10.654
  200    HG3  LYS  27           2HG      LYS  27  -2.710   0.214  -9.420
  201    HD2  LYS  27           1HD      LYS  27  -2.195  -1.380 -11.127
  202    HD3  LYS  27           2HD      LYS  27  -3.910  -0.982 -11.258
  203    HE2  LYS  27           1HE      LYS  27  -3.143  -0.951 -13.465
  204    HE3  LYS  27           2HE      LYS  27  -3.181   0.748 -12.999
  205    HZ1  LYS  27           1HZ      LYS  27  -1.136   0.037 -14.198
  206    HZ2  LYS  27           2HZ      LYS  27  -0.738  -0.929 -12.868
  207    HZ3  LYS  27           3HZ      LYS  27  -0.842   0.750 -12.692
  208    H    LEU  28           H        LEU  28  -1.814   2.983  -8.077
  209    HA   LEU  28           HA       LEU  28  -1.076   5.372  -9.632
  210    HB2  LEU  28           1HB      LEU  28  -0.821   4.962  -6.656
  211    HB3  LEU  28           2HB      LEU  28  -0.144   6.325  -7.546
  212    HG   LEU  28           HG       LEU  28  -3.078   5.817  -7.708
  213   HD11  LEU  28          1HD1      LEU  28  -3.376   6.020  -5.519
  214   HD12  LEU  28          2HD1      LEU  28  -2.716   7.651  -5.637
  215   HD13  LEU  28          3HD1      LEU  28  -1.654   6.297  -5.251
  216   HD21  LEU  28          1HD2      LEU  28  -3.202   8.112  -8.147
  217   HD22  LEU  28          2HD2      LEU  28  -1.759   7.579  -9.010
  218   HD23  LEU  28          3HD2      LEU  28  -1.604   8.421  -7.467
  219    H    THR  29           H        THR  29   0.412   4.286 -10.897
  220    HA   THR  29           HA       THR  29   2.614   2.915  -9.526
  221    HB   THR  29           HB       THR  29   2.142   2.994 -12.504
  222    HG1  THR  29           1HG      THR  29   0.344   2.074 -11.228
  223   HG21  THR  29          1HG2      THR  29   4.381   2.300 -11.680
  224   HG22  THR  29          2HG2      THR  29   3.526   1.015 -12.534
  225   HG23  THR  29          3HG2      THR  29   3.607   1.001 -10.773
  226    H    CYS  30           H        CYS  30   4.646   3.695  -9.513
  227    HA   CYS  30           HA       CYS  30   5.145   6.397 -10.082
  228    HB2  CYS  30           1HB      CYS  30   6.391   4.787  -8.488
  229    HB3  CYS  30           2HB      CYS  30   7.324   4.331  -9.909
  230    H    GLU  31           H        GLU  31   6.906   7.190 -11.540
  231    HA   GLU  31           HA       GLU  31   6.606   5.934 -14.178
  232    HB2  GLU  31           1HB      GLU  31   7.114   8.090 -15.134
  233    HB3  GLU  31           2HB      GLU  31   5.844   8.285 -13.935
  234    HG2  GLU  31           1HG      GLU  31   7.649   8.960 -12.310
  235    HG3  GLU  31           2HG      GLU  31   8.744   9.022 -13.690
  236    H    ARG  32           H        ARG  32   8.891   6.721 -11.726
  237    HA   ARG  32           HA       ARG  32  11.188   6.409 -13.477
  238    HB2  ARG  32           1HB      ARG  32  10.899   6.959 -10.526
  239    HB3  ARG  32           2HB      ARG  32  12.457   6.667 -11.286
  240    HG2  ARG  32           1HG      ARG  32  12.501   8.688 -12.297
  241    HG3  ARG  32           2HG      ARG  32  10.752   8.733 -12.527
  242    HD2  ARG  32           1HD      ARG  32  11.767   8.871  -9.745
  243    HD3  ARG  32           2HD      ARG  32  12.013  10.287 -10.767
  244    HE   ARG  32           HE       ARG  32   9.529   9.350  -9.675
  245   HH11  ARG  32          2HH1      ARG  32  11.009  11.169 -12.248
  246   HH12  ARG  32          1HH1      ARG  32   9.596  12.119 -12.566
  247   HH21  ARG  32          2HH2      ARG  32   7.662  10.595 -10.083
  248   HH22  ARG  32          1HH2      ARG  32   7.692  11.792 -11.333
  249    H    CYS  33           H        CYS  33   9.969   4.800 -10.534
  250    HA   CYS  33           HA       CYS  33  11.634   2.481 -11.091
  251    HB2  CYS  33           1HB      CYS  33  10.702   1.642  -8.920
  252    HB3  CYS  33           2HB      CYS  33  11.555   3.177  -8.793
  253    H    SER  34           H        SER  34   8.391   3.527 -11.531
  254    HA   SER  34           HA       SER  34   6.568   2.554 -12.483
  255    HB2  SER  34           1HB      SER  34   8.790   0.789 -13.420
  256    HB3  SER  34           2HB      SER  34   7.129   0.259 -13.682
  257    HG   SER  34           HG       SER  34   7.227   2.787 -14.390
  258    H    ARG  35           H        ARG  35   6.685   2.233  -9.827
  259    HA   ARG  35           HA       ARG  35   5.728  -0.524  -9.428
  260    HB2  ARG  35           1HB      ARG  35   7.406   1.179  -7.591
  261    HB3  ARG  35           2HB      ARG  35   6.514  -0.226  -7.023
  262    HG2  ARG  35           1HG      ARG  35   7.774  -1.485  -8.898
  263    HG3  ARG  35           2HG      ARG  35   8.867  -0.100  -8.858
  264    HD2  ARG  35           1HD      ARG  35   9.360  -0.478  -6.544
  265    HD3  ARG  35           2HD      ARG  35   8.120  -1.726  -6.434
  266    HE   ARG  35           HE       ARG  35  10.791  -2.041  -7.389
  267   HH11  ARG  35          2HH1      ARG  35   7.528  -3.205  -7.736
  268   HH12  ARG  35          1HH1      ARG  35   8.008  -4.771  -8.301
  269   HH21  ARG  35          2HH2      ARG  35  11.435  -4.100  -8.131
  270   HH22  ARG  35          1HH2      ARG  35  10.231  -5.279  -8.525
  271    H    ASN  36           H        ASN  36   3.991  -0.797  -7.976
  272    HA   ASN  36           HA       ASN  36   2.151   1.404  -7.951
  273    HB2  ASN  36           1HB      ASN  36   1.562  -1.060  -8.267
  274    HB3  ASN  36           2HB      ASN  36   1.792  -1.233  -6.530
  275   HD21  ASN  36          1HD2      ASN  36  -0.604  -1.560  -8.181
  276   HD22  ASN  36          2HD2      ASN  36  -1.783  -0.486  -7.516
  277    H    PHE  37           H        PHE  37   1.435   2.600  -6.235
  278    HA   PHE  37           HA       PHE  37   2.301   2.008  -3.543
  279    HB2  PHE  37           1HB      PHE  37   3.209   4.567  -4.876
  280    HB3  PHE  37           2HB      PHE  37   3.479   4.118  -3.196
  281    HD1  PHE  37           2HD      PHE  37   4.683   1.763  -2.905
  282    HD2  PHE  37           1HD      PHE  37   4.925   4.243  -6.356
  283    HE1  PHE  37           2HE      PHE  37   6.797   0.674  -3.536
  284    HE2  PHE  37           1HE      PHE  37   7.039   3.157  -6.993
  285    HZ   PHE  37           HZ       PHE  37   7.978   1.371  -5.581
  286    H    CYS  38           H        CYS  38   1.479   3.702  -1.990
  287    HA   CYS  38           HA       CYS  38  -1.216   4.465  -2.820
  288    HB2  CYS  38           1HB      CYS  38  -1.703   4.687  -0.455
  289    HB3  CYS  38           2HB      CYS  38  -0.906   3.144  -0.741
  290    H    ILE  39           H        ILE  39  -2.076   6.553  -2.387
  291    HA   ILE  39           HA       ILE  39  -0.766   8.709  -3.308
  292    HB   ILE  39           HB       ILE  39  -2.874   8.563  -1.175
  293   HG12  ILE  39          1HG1      ILE  39  -2.930   9.653  -3.995
  294   HG13  ILE  39          2HG1      ILE  39  -3.407   8.017  -3.556
  295   HG21  ILE  39          1HG2      ILE  39  -3.136  10.990  -1.318
  296   HG22  ILE  39          2HG2      ILE  39  -1.551  10.549  -0.686
  297   HG23  ILE  39          3HG2      ILE  39  -1.716  11.082  -2.359
  298   HD11  ILE  39          1HD1      ILE  39  -4.707  10.557  -2.601
  299   HD12  ILE  39          2HD1      ILE  39  -5.342   9.448  -3.818
  300   HD13  ILE  39          3HD1      ILE  39  -5.182   8.921  -2.143
  301    H    LYS  40           H        LYS  40  -0.608   7.510   0.006
  302    HA   LYS  40           HA       LYS  40   0.875   9.655   1.086
  303    HB2  LYS  40           1HB      LYS  40   0.434   6.800   1.902
  304    HB3  LYS  40           2HB      LYS  40   1.577   7.808   2.780
  305    HG2  LYS  40           1HG      LYS  40  -0.297   8.150   4.026
  306    HG3  LYS  40           2HG      LYS  40  -0.462   9.469   2.865
  307    HD2  LYS  40           1HD      LYS  40  -2.584   8.431   2.983
  308    HD3  LYS  40           2HD      LYS  40  -1.861   7.887   1.468
  309    HE2  LYS  40           1HE      LYS  40  -2.906   6.021   2.598
  310    HE3  LYS  40           2HE      LYS  40  -1.157   5.806   2.581
  311    HZ1  LYS  40           1HZ      LYS  40  -2.662   6.916   4.884
  312    HZ2  LYS  40           2HZ      LYS  40  -1.029   6.477   4.848
  313    HZ3  LYS  40           3HZ      LYS  40  -2.227   5.288   4.740
  314    H    HIS  41           H        HIS  41   1.848   6.588  -0.388
  315    HA   HIS  41           HA       HIS  41   4.644   7.507  -0.322
  316    HB2  HIS  41           1HB      HIS  41   3.563   4.701  -0.662
  317    HB3  HIS  41           2HB      HIS  41   5.268   5.144  -0.628
  318    HD2  HIS  41           2HD      HIS  41   4.906   7.154   2.073
  319    HE1  HIS  41           1HE      HIS  41   3.859   3.481   3.921
  320    HE2  HIS  41           2HE      HIS  41   4.513   5.885   4.293
  321    H    ARG  42           H        ARG  42   2.423   8.144  -2.271
  322    HA   ARG  42           HA       ARG  42   3.056   6.833  -4.720
  323    HB2  ARG  42           1HB      ARG  42   0.931   7.721  -4.781
  324    HB3  ARG  42           2HB      ARG  42   1.401   9.180  -3.917
  325    HG2  ARG  42           1HG      ARG  42   0.908   9.873  -6.100
  326    HG3  ARG  42           2HG      ARG  42   2.670   9.838  -6.010
  327    HD2  ARG  42           1HD      ARG  42   2.268   7.355  -6.875
  328    HD3  ARG  42           2HD      ARG  42   0.802   8.094  -7.517
  329    HE   ARG  42           HE       ARG  42   3.282   9.480  -8.101
  330   HH11  ARG  42          2HH1      ARG  42   0.871   7.205  -9.164
  331   HH12  ARG  42          1HH1      ARG  42   1.275   7.361 -10.841
  332   HH21  ARG  42          2HH2      ARG  42   3.824   9.695 -10.306
  333   HH22  ARG  42          1HH2      ARG  42   2.955   8.777 -11.490
  334    H    HIS  43           H        HIS  43   4.040   9.873  -3.219
  335    HA   HIS  43           HA       HIS  43   5.436  10.960  -5.393
  336    HB2  HIS  43           1HB      HIS  43   4.817  11.908  -2.982
  337    HB3  HIS  43           2HB      HIS  43   6.471  11.413  -2.635
  338    HD1  HIS  43           1HD      HIS  43   8.366  12.757  -3.733
  339    HD2  HIS  43           2HD      HIS  43   4.561  14.075  -4.758
  340    HE1  HIS  43           1HE      HIS  43   8.705  14.981  -4.856
  341    HA   PRO  44           HA       PRO  44   8.981   8.371  -5.738
  342    HB2  PRO  44           1HB      PRO  44  10.648  10.109  -6.994
  343    HB3  PRO  44           2HB      PRO  44   9.287   9.326  -7.806
  344    HG2  PRO  44           1HG      PRO  44   9.474  12.082  -6.651
  345    HG3  PRO  44           2HG      PRO  44   8.757  11.558  -8.186
  346    HD2  PRO  44           1HD      PRO  44   7.267  12.086  -5.988
  347    HD3  PRO  44           2HD      PRO  44   6.807  10.854  -7.181
  348    H    LEU  45           H        LEU  45   8.668  10.722  -3.522
  349    HA   LEU  45           HA       LEU  45  11.460  10.480  -2.609
  350    HB2  LEU  45           1HB      LEU  45   9.499  12.733  -2.223
  351    HB3  LEU  45           2HB      LEU  45  11.031  12.608  -1.361
  352    HG   LEU  45           HG       LEU  45  10.788  12.807  -4.360
  353   HD11  LEU  45          1HD1      LEU  45  10.052  14.804  -2.791
  354   HD12  LEU  45          2HD1      LEU  45  10.987  15.073  -4.261
  355   HD13  LEU  45          3HD1      LEU  45  11.796  15.048  -2.695
  356   HD21  LEU  45          1HD2      LEU  45  13.248  13.593  -2.959
  357   HD22  LEU  45          2HD2      LEU  45  13.031  12.690  -4.459
  358   HD23  LEU  45          3HD2      LEU  45  12.872  11.871  -2.904
  359    H    ASP  46           H        ASP  46   8.126  10.038  -1.877
  360    HA   ASP  46           HA       ASP  46   8.474   9.785   0.969
  361    HB2  ASP  46           1HB      ASP  46   6.192   9.245  -0.920
  362    HB3  ASP  46           2HB      ASP  46   6.106   8.783   0.778
  363    H    HIS  47           H        HIS  47   8.272   7.614  -1.795
  364    HA   HIS  47           HA       HIS  47   8.605   5.299  -0.030
  365    HB2  HIS  47           1HB      HIS  47   7.980   3.935  -1.900
  366    HB3  HIS  47           2HB      HIS  47   6.842   5.276  -1.821
  367    HD1  HIS  47           1HD      HIS  47   6.641   6.730  -3.857
  368    HD2  HIS  47           2HD      HIS  47   9.924   4.188  -4.025
  369    HE1  HIS  47           1HE      HIS  47   7.550   6.959  -6.191
  370    H    ASP  48           H        ASP  48  10.739   7.256  -0.584
  371    HA   ASP  48           HA       ASP  48  12.917   7.376  -1.300
  372    HB2  ASP  48           1HB      ASP  48  12.816   5.708   0.660
  373    HB3  ASP  48           2HB      ASP  48  13.038   4.459  -0.563
  374    H    CYS  49           H        CYS  49  11.563   7.247  -3.535
  375    HA   CYS  49           HA       CYS  49  11.623   5.172  -5.272
  376    HB2  CYS  49           1HB      CYS  49  10.839   7.532  -5.730
  377    HB3  CYS  49           2HB      CYS  49  12.517   7.946  -6.065
  378    H    SER  50           H        SER  50  13.072   4.169  -6.630
  379    HA   SER  50           HA       SER  50  15.913   4.709  -6.070
  380    HB2  SER  50           1HB      SER  50  14.380   2.179  -6.473
  381    HB3  SER  50           2HB      SER  50  16.058   2.231  -7.014
  382    HG   SER  50           HG       SER  50  15.241   3.000  -4.412
  383    H    GLY  51           H        GLY  51  13.651   3.670  -8.607
  384    HA2  GLY  51           1HA      GLY  51  13.651   4.491 -10.816
  385    HA3  GLY  51           2HA      GLY  51  15.286   5.088 -10.570
  386    H    GLU  52           H        GLU  52  13.996   3.357 -12.680
  387    HA   GLU  52           HA       GLU  52  14.854   0.722 -12.531
  388    HB2  GLU  52           1HB      GLU  52  13.385   1.727 -14.305
  389    HB3  GLU  52           2HB      GLU  52  14.831   2.408 -15.036
  390    HG2  GLU  52           1HG      GLU  52  14.000   0.282 -16.061
  391    HG3  GLU  52           2HG      GLU  52  15.690   0.272 -15.560
  392    H    GLY  53           H        GLY  53  16.594   3.576 -13.733
  393    HA2  GLY  53           1HA      GLY  53  19.009   3.574 -13.026
  394    HA3  GLY  53           2HA      GLY  53  19.065   1.956 -13.712
  395    H    HIS  54           H        HIS  54  20.086   1.924 -15.589
  396    HA   HIS  54           HA       HIS  54  20.439   4.284 -17.170
  397    HB2  HIS  54           1HB      HIS  54  21.382   2.404 -18.801
  398    HB3  HIS  54           2HB      HIS  54  22.290   2.954 -17.396
  399    HD1  HIS  54           1HD      HIS  54  23.267   1.064 -16.161
  400    HD2  HIS  54           2HD      HIS  54  19.627   0.046 -17.885
  401    HE1  HIS  54           1HE      HIS  54  22.877  -1.341 -15.537
  402    HA   PRO  55           HA       PRO  55  16.809   3.926 -19.658
  403    HB2  PRO  55           1HB      PRO  55  17.568   5.595 -21.661
  404    HB3  PRO  55           2HB      PRO  55  17.064   6.172 -20.068
  405    HG2  PRO  55           1HG      PRO  55  19.826   5.793 -21.159
  406    HG3  PRO  55           2HG      PRO  55  19.177   7.135 -20.199
  407    HD2  PRO  55           1HD      PRO  55  20.679   5.160 -19.114
  408    HD3  PRO  55           2HD      PRO  55  19.388   5.982 -18.214
  409    H    THR  56           H        THR  56  19.819   2.684 -20.418
  410    HA   THR  56           HA       THR  56  19.068   1.802 -23.101
  411    HB   THR  56           HB       THR  56  21.357   0.863 -23.213
  412    HG1  THR  56           1HG      THR  56  22.016   0.438 -21.195
  413   HG21  THR  56          1HG2      THR  56  22.262   3.426 -22.446
  414   HG22  THR  56          2HG2      THR  56  20.622   3.624 -23.063
  415   HG23  THR  56          3HG2      THR  56  21.855   2.859 -24.065
  416    H    SER  57           H        SER  57  18.819  -0.345 -23.676
  417    HA   SER  57           HA       SER  57  17.826  -2.076 -21.633
  418    HB2  SER  57           1HB      SER  57  17.123  -1.882 -24.144
  419    HB3  SER  57           2HB      SER  57  18.443  -3.020 -24.415
  420    HG   SER  57           HG       SER  57  17.381  -4.545 -23.325
  421    H    SER  58           H        SER  58  20.656  -2.166 -23.780
  422    HA   SER  58           HA       SER  58  21.780  -4.559 -23.151
  423    HB2  SER  58           1HB      SER  58  23.964  -3.568 -23.627
  424    HB3  SER  58           2HB      SER  58  22.755  -2.939 -24.746
  425    HG   SER  58           HG       SER  58  22.886  -1.009 -23.836
  426    H    GLY  59           H        GLY  59  21.695  -5.398 -21.139
  427    HA2  GLY  59           1HA      GLY  59  22.155  -3.875 -18.771
  428    HA3  GLY  59           2HA      GLY  59  22.027  -5.625 -18.872
  429    HA   PRO  60           HA       PRO  60  26.440  -4.292 -17.930
  430    HB2  PRO  60           1HB      PRO  60  26.621  -5.525 -15.518
  431    HB3  PRO  60           2HB      PRO  60  26.046  -3.864 -15.707
  432    HG2  PRO  60           1HG      PRO  60  24.470  -6.386 -15.365
  433    HG3  PRO  60           2HG      PRO  60  24.223  -4.801 -14.609
  434    HD2  PRO  60           1HD      PRO  60  22.764  -5.648 -16.727
  435    HD3  PRO  60           2HD      PRO  60  23.167  -3.939 -16.468
  436    H    SER  61           H        SER  61  27.101  -5.694 -19.586
  437    HA   SER  61           HA       SER  61  27.512  -8.489 -18.743
  438    HB2  SER  61           1HB      SER  61  25.862  -8.212 -20.618
  439    HB3  SER  61           2HB      SER  61  27.166  -7.535 -21.594
  440    HG   SER  61           HG       SER  61  27.252  -9.630 -22.093
  441    H    SER  62           H        SER  62  28.775  -5.845 -20.745
  442    HA   SER  62           HA       SER  62  31.475  -6.962 -20.359
  443    HB2  SER  62           1HB      SER  62  30.165  -5.802 -22.780
  444    HB3  SER  62           2HB      SER  62  31.893  -5.531 -22.554
  445    HG   SER  62           HG       SER  62  31.140  -7.513 -23.733
  446    H    GLY  63           H        GLY  63  33.201  -5.201 -20.697
  447    HA2  GLY  63           1HA      GLY  63  34.164  -3.244 -19.981
  448    HA3  GLY  63           2HA      GLY  63  32.597  -2.488 -20.229
  Start of MODEL   18
    1    H1   GLY   1           H        GLY   1 -18.899  -7.963   7.230
    2    HA2  GLY   1           1HA      GLY   1 -20.169  -9.707   8.841
    3    HA3  GLY   1           2HA      GLY   1 -20.629  -9.504   7.158
    4    H    SER   2           H        SER   2 -20.470 -11.858   9.103
    5    HA   SER   2           HA       SER   2 -18.496 -13.652   8.286
    6    HB2  SER   2           1HB      SER   2 -20.185 -13.847  10.228
    7    HB3  SER   2           2HB      SER   2 -21.280 -14.533   9.028
    8    HG   SER   2           HG       SER   2 -19.521 -16.050   8.573
    9    H    SER   3           H        SER   3 -21.855 -13.366   7.129
   10    HA   SER   3           HA       SER   3 -20.979 -14.435   4.542
   11    HB2  SER   3           1HB      SER   3 -22.981 -15.866   4.413
   12    HB3  SER   3           2HB      SER   3 -21.958 -16.318   5.776
   13    HG   SER   3           HG       SER   3 -23.456 -14.744   6.943
   14    H    GLY   4           H        GLY   4 -22.511 -13.990   2.785
   15    HA2  GLY   4           1HA      GLY   4 -24.530 -12.799   2.080
   16    HA3  GLY   4           2HA      GLY   4 -24.202 -11.636   3.355
   17    H    SER   5           H        SER   5 -23.003 -12.892   0.277
   18    HA   SER   5           HA       SER   5 -21.694 -11.968  -1.345
   19    HB2  SER   5           1HB      SER   5 -23.807 -10.463  -1.240
   20    HB3  SER   5           2HB      SER   5 -22.735  -9.276  -0.497
   21    HG   SER   5           HG       SER   5 -21.464  -9.316  -2.346
   22    H    SER   6           H        SER   6 -20.316 -12.399   1.018
   23    HA   SER   6           HA       SER   6 -18.473 -10.099   1.075
   24    HB2  SER   6           1HB      SER   6 -19.821 -10.576   3.210
   25    HB3  SER   6           2HB      SER   6 -18.821 -12.019   3.374
   26    HG   SER   6           HG       SER   6 -18.111  -9.319   3.579
   27    H    GLY   7           H        GLY   7 -16.981 -10.812  -0.386
   28    HA2  GLY   7           1HA      GLY   7 -15.513 -13.251   0.384
   29    HA3  GLY   7           2HA      GLY   7 -15.960 -12.972  -1.293
   30    H    ARG   8           H        ARG   8 -14.438 -12.111  -2.528
   31    HA   ARG   8           HA       ARG   8 -12.715 -10.016  -1.549
   32    HB2  ARG   8           1HB      ARG   8 -11.746 -12.803  -1.951
   33    HB3  ARG   8           2HB      ARG   8 -10.704 -11.492  -2.486
   34    HG2  ARG   8           1HG      ARG   8 -11.182 -10.554  -0.084
   35    HG3  ARG   8           2HG      ARG   8 -11.546 -12.245   0.264
   36    HD2  ARG   8           1HD      ARG   8  -9.250 -11.911   0.771
   37    HD3  ARG   8           2HD      ARG   8  -9.317 -12.825  -0.735
   38    HE   ARG   8           HE       ARG   8  -9.175 -10.129  -1.402
   39   HH11  ARG   8          2HH1      ARG   8  -7.215 -12.530   0.183
   40   HH12  ARG   8          1HH1      ARG   8  -5.714 -11.797  -0.276
   41   HH21  ARG   8          2HH2      ARG   8  -7.205  -9.154  -2.013
   42   HH22  ARG   8          1HH2      ARG   8  -5.710  -9.876  -1.524
   43    H    LYS   9           H        LYS   9 -11.959  -8.734  -3.170
   44    HA   LYS   9           HA       LYS   9 -12.368  -9.655  -5.935
   45    HB2  LYS   9           1HB      LYS   9 -13.422  -7.219  -4.586
   46    HB3  LYS   9           2HB      LYS   9 -12.892  -7.059  -6.255
   47    HG2  LYS   9           1HG      LYS   9 -15.145  -7.527  -6.463
   48    HG3  LYS   9           2HG      LYS   9 -14.393  -9.107  -6.697
   49    HD2  LYS   9           1HD      LYS   9 -14.842  -9.670  -4.362
   50    HD3  LYS   9           2HD      LYS   9 -15.575  -8.084  -4.114
   51    HE2  LYS   9           1HE      LYS   9 -17.171  -8.715  -5.998
   52    HE3  LYS   9           2HE      LYS   9 -16.565 -10.360  -5.810
   53    HZ1  LYS   9           1HZ      LYS   9 -17.535 -10.583  -3.769
   54    HZ2  LYS   9           2HZ      LYS   9 -18.660  -9.562  -4.510
   55    HZ3  LYS   9           3HZ      LYS   9 -17.520  -8.925  -3.436
   56    H    ILE  10           H        ILE  10 -11.280  -8.027  -7.502
   57    HA   ILE  10           HA       ILE  10  -8.681  -7.221  -6.371
   58    HB   ILE  10           HB       ILE  10  -7.789  -7.713  -8.728
   59   HG12  ILE  10          1HG1      ILE  10  -9.120  -9.731  -9.701
   60   HG13  ILE  10          2HG1      ILE  10 -10.471  -9.064  -8.790
   61   HG21  ILE  10          1HG2      ILE  10  -8.602 -10.216  -7.317
   62   HG22  ILE  10          2HG2      ILE  10  -7.052  -9.787  -8.039
   63   HG23  ILE  10          3HG2      ILE  10  -7.545  -9.057  -6.512
   64   HD11  ILE  10          1HD1      ILE  10  -8.922  -7.304 -10.629
   65   HD12  ILE  10          2HD1      ILE  10 -10.128  -8.416 -11.277
   66   HD13  ILE  10          3HD1      ILE  10 -10.602  -7.186 -10.105
   67    H    PHE  11           H        PHE  11 -10.930  -5.517  -6.621
   68    HA   PHE  11           HA       PHE  11 -10.336  -3.849  -8.950
   69    HB2  PHE  11           1HB      PHE  11 -12.442  -2.948  -8.747
   70    HB3  PHE  11           2HB      PHE  11 -12.725  -4.531  -8.031
   71    HD1  PHE  11           1HD      PHE  11 -12.663  -4.741  -5.516
   72    HD2  PHE  11           2HD      PHE  11 -12.797  -0.990  -7.524
   73    HE1  PHE  11           1HE      PHE  11 -13.451  -3.666  -3.448
   74    HE2  PHE  11           2HE      PHE  11 -13.584   0.091  -5.459
   75    HZ   PHE  11           HZ       PHE  11 -13.911  -1.247  -3.417
   76    H    THR  12           H        THR  12  -8.585  -4.123  -6.548
   77    HA   THR  12           HA       THR  12  -8.423  -1.256  -5.900
   78    HB   THR  12           HB       THR  12  -7.548  -1.918  -3.634
   79    HG1  THR  12           1HG      THR  12  -8.329  -4.095  -2.995
   80   HG21  THR  12          1HG2      THR  12 -10.369  -2.344  -4.519
   81   HG22  THR  12          2HG2      THR  12  -9.689  -1.074  -3.502
   82   HG23  THR  12          3HG2      THR  12  -9.930  -2.693  -2.848
   83    H    ASN  13           H        ASN  13  -6.201  -0.741  -4.916
   84    HA   ASN  13           HA       ASN  13  -4.124  -2.295  -6.313
   85    HB2  ASN  13           1HB      ASN  13  -3.933   0.679  -5.891
   86    HB3  ASN  13           2HB      ASN  13  -3.023  -0.332  -7.010
   87   HD21  ASN  13          1HD2      ASN  13  -6.056   1.250  -6.390
   88   HD22  ASN  13          2HD2      ASN  13  -6.674   1.135  -7.999
   89    H    LYS  14           H        LYS  14  -3.009  -3.319  -4.783
   90    HA   LYS  14           HA       LYS  14  -2.713  -2.258  -2.127
   91    HB2  LYS  14           1HB      LYS  14  -2.939  -4.700  -2.647
   92    HB3  LYS  14           2HB      LYS  14  -1.331  -4.648  -3.357
   93    HG2  LYS  14           1HG      LYS  14  -0.672  -3.666  -1.018
   94    HG3  LYS  14           2HG      LYS  14  -2.154  -4.475  -0.503
   95    HD2  LYS  14           1HD      LYS  14  -0.425  -6.044  -0.170
   96    HD3  LYS  14           2HD      LYS  14  -1.244  -6.551  -1.649
   97    HE2  LYS  14           1HE      LYS  14   0.969  -6.708  -2.270
   98    HE3  LYS  14           2HE      LYS  14   0.564  -5.083  -2.820
   99    HZ1  LYS  14           1HZ      LYS  14   2.001  -4.181  -1.399
  100    HZ2  LYS  14           2HZ      LYS  14   2.645  -5.733  -1.206
  101    HZ3  LYS  14           3HZ      LYS  14   1.497  -5.152  -0.108
  102    H    CYS  15           H        CYS  15  -1.237  -0.821  -1.547
  103    HA   CYS  15           HA       CYS  15   0.755   0.213  -3.165
  104    HB2  CYS  15           1HB      CYS  15  -0.117   1.282  -1.093
  105    HB3  CYS  15           2HB      CYS  15   0.790   0.110  -0.142
  106    H    GLU  16           H        GLU  16   2.984  -0.072  -3.309
  107    HA   GLU  16           HA       GLU  16   3.910  -2.735  -2.488
  108    HB2  GLU  16           1HB      GLU  16   5.000  -0.866  -4.600
  109    HB3  GLU  16           2HB      GLU  16   5.639  -2.461  -4.228
  110    HG2  GLU  16           1HG      GLU  16   3.148  -3.183  -4.720
  111    HG3  GLU  16           2HG      GLU  16   3.160  -1.695  -5.663
  112    H    ARG  17           H        ARG  17   3.846  -0.210  -0.848
  113    HA   ARG  17           HA       ARG  17   6.698   0.262  -0.414
  114    HB2  ARG  17           1HB      ARG  17   4.720   2.042  -0.470
  115    HB3  ARG  17           2HB      ARG  17   4.611   1.606   1.231
  116    HG2  ARG  17           1HG      ARG  17   7.288   2.274   0.142
  117    HG3  ARG  17           2HG      ARG  17   6.136   3.588   0.384
  118    HD2  ARG  17           1HD      ARG  17   5.835   2.375   2.727
  119    HD3  ARG  17           2HD      ARG  17   7.475   1.834   2.371
  120    HE   ARG  17           HE       ARG  17   6.653   4.472   3.118
  121   HH11  ARG  17          2HH1      ARG  17   9.034   2.638   1.362
  122   HH12  ARG  17          1HH1      ARG  17  10.265   3.849   1.507
  123   HH21  ARG  17          2HH2      ARG  17   8.265   6.075   3.316
  124   HH22  ARG  17          1HH2      ARG  17   9.826   5.803   2.619
  125    H    ALA  18           H        ALA  18   7.621  -1.265   0.807
  126    HA   ALA  18           HA       ALA  18   6.675  -3.112   2.471
  127    HB1  ALA  18           1HB      ALA  18   8.903  -3.321   2.534
  128    HB2  ALA  18           2HB      ALA  18   9.168  -1.581   2.410
  129    HB3  ALA  18           3HB      ALA  18   8.804  -2.308   3.975
  130    H    GLY  19           H        GLY  19   5.753  -3.324   4.448
  131    HA2  GLY  19           1HA      GLY  19   4.978  -2.724   6.552
  132    HA3  GLY  19           2HA      GLY  19   5.747  -1.156   6.355
  133    H    CYS  20           H        CYS  20   4.485  -0.459   3.891
  134    HA   CYS  20           HA       CYS  20   2.044   0.601   4.925
  135    HB2  CYS  20           1HB      CYS  20   3.629   1.676   3.214
  136    HB3  CYS  20           2HB      CYS  20   2.860   0.630   2.025
  137    H    ARG  21           H        ARG  21   0.148  -0.388   4.995
  138    HA   ARG  21           HA       ARG  21  -0.391  -2.539   3.054
  139    HB2  ARG  21           1HB      ARG  21  -1.096  -2.218   5.947
  140    HB3  ARG  21           2HB      ARG  21  -2.140  -3.176   4.905
  141    HG2  ARG  21           1HG      ARG  21   0.814  -3.666   5.169
  142    HG3  ARG  21           2HG      ARG  21  -0.398  -4.454   6.181
  143    HD2  ARG  21           1HD      ARG  21  -1.476  -5.025   3.843
  144    HD3  ARG  21           2HD      ARG  21   0.179  -4.796   3.281
  145    HE   ARG  21           HE       ARG  21   0.659  -6.839   4.153
  146   HH11  ARG  21          2HH1      ARG  21  -2.062  -5.528   5.884
  147   HH12  ARG  21          1HH1      ARG  21  -2.275  -6.933   6.874
  148   HH21  ARG  21          2HH2      ARG  21   0.389  -8.695   5.450
  149   HH22  ARG  21          1HH2      ARG  21  -0.880  -8.734   6.628
  150    H    GLN  22           H        GLN  22  -0.861   0.262   2.569
  151    HA   GLN  22           HA       GLN  22  -3.649   0.808   2.939
  152    HB2  GLN  22           1HB      GLN  22  -1.436   2.136   1.401
  153    HB3  GLN  22           2HB      GLN  22  -3.104   2.661   1.218
  154    HG2  GLN  22           1HG      GLN  22  -1.527   3.823   2.934
  155    HG3  GLN  22           2HG      GLN  22  -3.217   3.519   3.332
  156   HE21  GLN  22          1HE2      GLN  22  -0.217   3.410   4.546
  157   HE22  GLN  22          2HE2      GLN  22  -0.401   2.157   5.722
  158    H    ARG  23           H        ARG  23  -5.238   0.988   1.285
  159    HA   ARG  23           HA       ARG  23  -4.665  -0.525  -1.169
  160    HB2  ARG  23           1HB      ARG  23  -7.004  -0.901   0.702
  161    HB3  ARG  23           2HB      ARG  23  -6.984  -1.512  -0.947
  162    HG2  ARG  23           1HG      ARG  23  -5.227  -3.012  -0.477
  163    HG3  ARG  23           2HG      ARG  23  -4.875  -2.230   1.065
  164    HD2  ARG  23           1HD      ARG  23  -6.885  -3.042   2.033
  165    HD3  ARG  23           2HD      ARG  23  -7.502  -3.569   0.468
  166    HE   ARG  23           HE       ARG  23  -5.616  -4.960   2.158
  167   HH11  ARG  23          2HH1      ARG  23  -6.969  -4.634  -1.033
  168   HH12  ARG  23          1HH1      ARG  23  -6.533  -6.238  -1.524
  169   HH21  ARG  23          2HH2      ARG  23  -5.037  -7.073   1.524
  170   HH22  ARG  23          1HH2      ARG  23  -5.435  -7.625  -0.068
  171    H    GLU  24           H        GLU  24  -4.587   1.395  -2.353
  172    HA   GLU  24           HA       GLU  24  -6.747   3.288  -2.269
  173    HB2  GLU  24           1HB      GLU  24  -4.201   3.003  -3.783
  174    HB3  GLU  24           2HB      GLU  24  -5.460   4.003  -4.496
  175    HG2  GLU  24           1HG      GLU  24  -4.613   4.413  -1.659
  176    HG3  GLU  24           2HG      GLU  24  -3.685   5.101  -2.990
  177    H    MET  25           H        MET  25  -8.339   3.637  -3.798
  178    HA   MET  25           HA       MET  25  -9.286   1.326  -5.170
  179    HB2  MET  25           1HB      MET  25 -10.224   4.197  -5.311
  180    HB3  MET  25           2HB      MET  25 -11.092   2.814  -5.963
  181    HG2  MET  25           1HG      MET  25 -11.027   1.898  -3.570
  182    HG3  MET  25           2HG      MET  25 -10.599   3.542  -3.104
  183    HE1  MET  25           1HE      MET  25 -13.677   5.622  -4.085
  184    HE2  MET  25           2HE      MET  25 -12.446   5.500  -2.828
  185    HE3  MET  25           3HE      MET  25 -11.973   5.518  -4.527
  186    H    MET  26           H        MET  26  -7.720   4.328  -6.170
  187    HA   MET  26           HA       MET  26  -7.833   3.552  -8.971
  188    HB2  MET  26           1HB      MET  26  -6.946   5.716  -9.458
  189    HB3  MET  26           2HB      MET  26  -8.175   5.924  -8.217
  190    HG2  MET  26           1HG      MET  26  -6.081   5.700  -6.620
  191    HG3  MET  26           2HG      MET  26  -5.235   6.266  -8.059
  192    HE1  MET  26           1HE      MET  26  -5.329   8.177  -9.115
  193    HE2  MET  26           2HE      MET  26  -6.865   9.028  -9.277
  194    HE3  MET  26           3HE      MET  26  -5.573   9.719  -8.293
  195    H    LYS  27           H        LYS  27  -5.985   3.244 -10.275
  196    HA   LYS  27           HA       LYS  27  -3.817   1.922  -8.893
  197    HB2  LYS  27           1HB      LYS  27  -4.990   1.227 -11.120
  198    HB3  LYS  27           2HB      LYS  27  -3.888   2.383 -11.856
  199    HG2  LYS  27           1HG      LYS  27  -1.982   1.160 -11.051
  200    HG3  LYS  27           2HG      LYS  27  -3.025   0.061 -10.144
  201    HD2  LYS  27           1HD      LYS  27  -2.410  -1.082 -12.127
  202    HD3  LYS  27           2HD      LYS  27  -4.082  -0.562 -12.352
  203    HE2  LYS  27           1HE      LYS  27  -3.214   0.096 -14.354
  204    HE3  LYS  27           2HE      LYS  27  -2.897   1.552 -13.412
  205    HZ1  LYS  27           1HZ      LYS  27  -0.850  -0.539 -13.444
  206    HZ2  LYS  27           2HZ      LYS  27  -0.675   1.141 -13.348
  207    HZ3  LYS  27           3HZ      LYS  27  -1.029   0.411 -14.832
  208    H    LEU  28           H        LEU  28  -2.188   3.073  -8.100
  209    HA   LEU  28           HA       LEU  28  -1.232   5.398  -9.638
  210    HB2  LEU  28           1HB      LEU  28  -1.157   4.868  -6.674
  211    HB3  LEU  28           2HB      LEU  28  -0.312   6.202  -7.457
  212    HG   LEU  28           HG       LEU  28  -3.269   5.925  -7.796
  213   HD11  LEU  28          1HD1      LEU  28  -1.815   6.730  -5.325
  214   HD12  LEU  28          2HD1      LEU  28  -3.331   5.849  -5.506
  215   HD13  LEU  28          3HD1      LEU  28  -3.286   7.591  -5.775
  216   HD21  LEU  28          1HD2      LEU  28  -3.193   8.241  -8.198
  217   HD22  LEU  28          2HD2      LEU  28  -1.800   7.576  -9.050
  218   HD23  LEU  28          3HD2      LEU  28  -1.579   8.393  -7.502
  219    H    THR  29           H        THR  29   0.463   4.719 -10.797
  220    HA   THR  29           HA       THR  29   2.474   3.022  -9.477
  221    HB   THR  29           HB       THR  29   2.094   3.478 -12.443
  222    HG1  THR  29           1HG      THR  29   0.374   2.263 -11.607
  223   HG21  THR  29          1HG2      THR  29   3.555   1.421 -12.568
  224   HG22  THR  29          2HG2      THR  29   3.893   1.656 -10.852
  225   HG23  THR  29          3HG2      THR  29   4.359   2.891 -12.022
  226    H    CYS  30           H        CYS  30   4.641   3.581  -9.525
  227    HA   CYS  30           HA       CYS  30   5.234   6.349  -9.514
  228    HB2  CYS  30           1HB      CYS  30   6.394   4.386  -8.262
  229    HB3  CYS  30           2HB      CYS  30   7.344   4.222  -9.736
  230    H    GLU  31           H        GLU  31   7.075   7.297 -10.791
  231    HA   GLU  31           HA       GLU  31   6.720   6.593 -13.620
  232    HB2  GLU  31           1HB      GLU  31   7.244   8.833 -14.171
  233    HB3  GLU  31           2HB      GLU  31   6.160   8.924 -12.790
  234    HG2  GLU  31           1HG      GLU  31   9.083   8.906 -12.278
  235    HG3  GLU  31           2HG      GLU  31   8.354  10.371 -12.932
  236    H    ARG  32           H        ARG  32   8.997   6.609 -11.071
  237    HA   ARG  32           HA       ARG  32  11.286   6.484 -12.879
  238    HB2  ARG  32           1HB      ARG  32  11.073   6.548  -9.868
  239    HB3  ARG  32           2HB      ARG  32  12.595   6.353 -10.727
  240    HG2  ARG  32           1HG      ARG  32  12.609   8.517 -11.480
  241    HG3  ARG  32           2HG      ARG  32  10.853   8.671 -11.398
  242    HD2  ARG  32           1HD      ARG  32  10.864   9.174  -9.170
  243    HD3  ARG  32           2HD      ARG  32  12.329   8.245  -8.857
  244    HE   ARG  32           HE       ARG  32  12.160  11.013  -9.689
  245   HH11  ARG  32          2HH1      ARG  32  14.163   8.190  -9.317
  246   HH12  ARG  32          1HH1      ARG  32  15.646   9.086  -9.294
  247   HH21  ARG  32          2HH2      ARG  32  14.105  12.203  -9.661
  248   HH22  ARG  32          1HH2      ARG  32  15.612  11.368  -9.490
  249    H    CYS  33           H        CYS  33  10.021   4.551 -10.156
  250    HA   CYS  33           HA       CYS  33  11.462   2.220 -11.127
  251    HB2  CYS  33           1HB      CYS  33  10.665   1.143  -9.057
  252    HB3  CYS  33           2HB      CYS  33  11.483   2.667  -8.728
  253    H    SER  34           H        SER  34   8.340   3.588 -11.334
  254    HA   SER  34           HA       SER  34   6.408   2.910 -12.327
  255    HB2  SER  34           1HB      SER  34   6.555   1.500 -14.176
  256    HB3  SER  34           2HB      SER  34   8.213   2.083 -14.029
  257    HG   SER  34           HG       SER  34   7.926  -0.255 -14.294
  258    H    ARG  35           H        ARG  35   6.565   2.265  -9.723
  259    HA   ARG  35           HA       ARG  35   5.420  -0.448  -9.598
  260    HB2  ARG  35           1HB      ARG  35   7.125   1.032  -7.602
  261    HB3  ARG  35           2HB      ARG  35   6.143  -0.354  -7.147
  262    HG2  ARG  35           1HG      ARG  35   7.367  -1.597  -9.022
  263    HG3  ARG  35           2HG      ARG  35   8.512  -0.254  -8.975
  264    HD2  ARG  35           1HD      ARG  35   8.725  -0.689  -6.497
  265    HD3  ARG  35           2HD      ARG  35   7.816  -2.175  -6.765
  266    HE   ARG  35           HE       ARG  35   9.817  -2.395  -8.546
  267   HH11  ARG  35          2HH1      ARG  35   9.772  -1.628  -5.150
  268   HH12  ARG  35          1HH1      ARG  35  11.332  -2.315  -4.841
  269   HH21  ARG  35          2HH2      ARG  35  11.872  -3.303  -8.151
  270   HH22  ARG  35          1HH2      ARG  35  12.526  -3.267  -6.549
  271    H    ASN  36           H        ASN  36   3.636  -0.770  -8.212
  272    HA   ASN  36           HA       ASN  36   1.836   1.440  -8.104
  273    HB2  ASN  36           1HB      ASN  36   1.238  -1.020  -8.450
  274    HB3  ASN  36           2HB      ASN  36   1.456  -1.210  -6.713
  275   HD21  ASN  36          1HD2      ASN  36   0.124   0.114  -5.312
  276   HD22  ASN  36          2HD2      ASN  36  -1.462   0.558  -5.833
  277    H    PHE  37           H        PHE  37   1.098   2.598  -6.364
  278    HA   PHE  37           HA       PHE  37   1.929   1.973  -3.678
  279    HB2  PHE  37           1HB      PHE  37   2.961   4.495  -4.993
  280    HB3  PHE  37           2HB      PHE  37   3.153   4.065  -3.297
  281    HD1  PHE  37           2HD      PHE  37   4.268   1.684  -2.917
  282    HD2  PHE  37           1HD      PHE  37   4.709   4.074  -6.411
  283    HE1  PHE  37           2HE      PHE  37   6.362   0.509  -3.452
  284    HE2  PHE  37           1HE      PHE  37   6.804   2.902  -6.952
  285    HZ   PHE  37           HZ       PHE  37   7.634   1.118  -5.471
  286    H    CYS  38           H        CYS  38   1.295   3.956  -2.207
  287    HA   CYS  38           HA       CYS  38  -1.424   4.702  -3.018
  288    HB2  CYS  38           1HB      CYS  38  -1.898   5.000  -0.663
  289    HB3  CYS  38           2HB      CYS  38  -1.138   3.430  -0.900
  290    H    ILE  39           H        ILE  39  -2.190   6.823  -2.767
  291    HA   ILE  39           HA       ILE  39  -0.829   8.902  -3.719
  292    HB   ILE  39           HB       ILE  39  -2.873   8.938  -1.512
  293   HG12  ILE  39          1HG1      ILE  39  -3.036   9.823  -4.399
  294   HG13  ILE  39          2HG1      ILE  39  -3.507   8.224  -3.832
  295   HG21  ILE  39          1HG2      ILE  39  -1.738  11.332  -2.951
  296   HG22  ILE  39          2HG2      ILE  39  -3.078  11.345  -1.806
  297   HG23  ILE  39          3HG2      ILE  39  -1.456  10.920  -1.260
  298   HD11  ILE  39          1HD1      ILE  39  -4.724  10.763  -2.788
  299   HD12  ILE  39          2HD1      ILE  39  -5.376   9.856  -4.153
  300   HD13  ILE  39          3HD1      ILE  39  -5.292   9.110  -2.557
  301    H    LYS  40           H        LYS  40  -0.697   7.860  -0.343
  302    HA   LYS  40           HA       LYS  40   0.898   9.966   0.625
  303    HB2  LYS  40           1HB      LYS  40   0.252   7.202   1.549
  304    HB3  LYS  40           2HB      LYS  40   1.584   8.051   2.322
  305    HG2  LYS  40           1HG      LYS  40  -0.132   8.652   3.694
  306    HG3  LYS  40           2HG      LYS  40  -0.193   9.977   2.529
  307    HD2  LYS  40           1HD      LYS  40  -2.426   9.246   2.814
  308    HD3  LYS  40           2HD      LYS  40  -1.897   8.608   1.256
  309    HE2  LYS  40           1HE      LYS  40  -2.837   6.722   2.119
  310    HE3  LYS  40           2HE      LYS  40  -1.206   6.539   2.762
  311    HZ1  LYS  40           1HZ      LYS  40  -2.401   8.014   4.664
  312    HZ2  LYS  40           2HZ      LYS  40  -2.255   6.329   4.709
  313    HZ3  LYS  40           3HZ      LYS  40  -3.685   7.039   4.150
  314    H    HIS  41           H        HIS  41   1.769   6.745  -0.595
  315    HA   HIS  41           HA       HIS  41   4.587   7.573  -0.639
  316    HB2  HIS  41           1HB      HIS  41   3.391   4.808  -0.924
  317    HB3  HIS  41           2HB      HIS  41   5.110   5.186  -0.872
  318    HD2  HIS  41           2HD      HIS  41   4.734   7.281   1.784
  319    HE1  HIS  41           1HE      HIS  41   3.611   3.659   3.686
  320    HE2  HIS  41           2HE      HIS  41   4.288   6.062   4.021
  321    H    ARG  42           H        ARG  42   2.308   8.166  -2.601
  322    HA   ARG  42           HA       ARG  42   2.944   6.801  -5.015
  323    HB2  ARG  42           1HB      ARG  42   0.822   7.685  -5.107
  324    HB3  ARG  42           2HB      ARG  42   1.283   9.158  -4.264
  325    HG2  ARG  42           1HG      ARG  42   0.741   9.722  -6.515
  326    HG3  ARG  42           2HG      ARG  42   2.487   9.881  -6.316
  327    HD2  ARG  42           1HD      ARG  42   2.462   7.382  -7.156
  328    HD3  ARG  42           2HD      ARG  42   0.919   7.871  -7.853
  329    HE   ARG  42           HE       ARG  42   3.510   8.575  -8.788
  330   HH11  ARG  42          2HH1      ARG  42   0.256   9.768  -8.461
  331   HH12  ARG  42          1HH1      ARG  42   0.380  10.856  -9.804
  332   HH21  ARG  42          2HH2      ARG  42   3.686  10.003 -10.558
  333   HH22  ARG  42          1HH2      ARG  42   2.332  10.988 -10.996
  334    H    HIS  43           H        HIS  43   4.093   9.727  -3.478
  335    HA   HIS  43           HA       HIS  43   5.562  10.613  -5.798
  336    HB2  HIS  43           1HB      HIS  43   4.567  11.965  -3.711
  337    HB3  HIS  43           2HB      HIS  43   6.195  11.688  -3.098
  338    HD1  HIS  43           1HD      HIS  43   8.097  13.008  -4.164
  339    HD2  HIS  43           2HD      HIS  43   4.421  13.638  -5.996
  340    HE1  HIS  43           1HE      HIS  43   8.439  14.967  -5.703
  341    HA   PRO  44           HA       PRO  44   9.216   8.254  -5.117
  342    HB2  PRO  44           1HB      PRO  44  10.985   9.820  -6.455
  343    HB3  PRO  44           2HB      PRO  44   9.790   8.805  -7.272
  344    HG2  PRO  44           1HG      PRO  44   9.699  11.739  -6.685
  345    HG3  PRO  44           2HG      PRO  44   9.240  10.880  -8.167
  346    HD2  PRO  44           1HD      PRO  44   7.420  11.726  -6.349
  347    HD3  PRO  44           2HD      PRO  44   7.189  10.257  -7.319
  348    H    LEU  45           H        LEU  45   8.527  11.065  -3.569
  349    HA   LEU  45           HA       LEU  45  11.183  11.340  -2.349
  350    HB2  LEU  45           1HB      LEU  45   8.764  13.123  -2.400
  351    HB3  LEU  45           2HB      LEU  45  10.113  13.398  -1.300
  352    HG   LEU  45           HG       LEU  45  10.347  13.356  -4.307
  353   HD11  LEU  45          1HD1      LEU  45  10.590  15.809  -4.085
  354   HD12  LEU  45          2HD1      LEU  45  10.115  15.672  -2.393
  355   HD13  LEU  45          3HD1      LEU  45   8.979  15.227  -3.666
  356   HD21  LEU  45          1HD2      LEU  45  12.543  13.428  -4.000
  357   HD22  LEU  45          2HD2      LEU  45  12.277  13.140  -2.280
  358   HD23  LEU  45          3HD2      LEU  45  12.386  14.792  -2.892
  359    H    ASP  46           H        ASP  46   7.852  10.525  -1.664
  360    HA   ASP  46           HA       ASP  46   8.266  10.381   1.190
  361    HB2  ASP  46           1HB      ASP  46   5.940   9.510  -0.537
  362    HB3  ASP  46           2HB      ASP  46   5.947   9.480   1.224
  363    H    HIS  47           H        HIS  47   8.599   8.294  -1.518
  364    HA   HIS  47           HA       HIS  47   9.085   6.031   0.304
  365    HB2  HIS  47           1HB      HIS  47   8.009   4.525  -1.095
  366    HB3  HIS  47           2HB      HIS  47   6.982   5.947  -1.246
  367    HD1  HIS  47           1HD      HIS  47   6.766   6.989  -3.537
  368    HD2  HIS  47           2HD      HIS  47   9.674   4.026  -3.372
  369    HE1  HIS  47           1HE      HIS  47   7.439   6.574  -5.925
  370    H    ASP  48           H        ASP  48  11.180   5.588   0.327
  371    HA   ASP  48           HA       ASP  48  13.163   6.557  -1.257
  372    HB2  ASP  48           1HB      ASP  48  13.265   3.721  -0.243
  373    HB3  ASP  48           2HB      ASP  48  14.588   4.872  -0.403
  374    H    CYS  49           H        CYS  49  12.858   6.652  -3.431
  375    HA   CYS  49           HA       CYS  49  12.137   4.255  -4.910
  376    HB2  CYS  49           1HB      CYS  49  11.208   6.553  -5.436
  377    HB3  CYS  49           2HB      CYS  49  12.810   6.976  -6.033
  378    H    SER  50           H        SER  50  13.548   2.942  -5.858
  379    HA   SER  50           HA       SER  50  16.376   3.588  -5.750
  380    HB2  SER  50           1HB      SER  50  15.395   1.326  -5.107
  381    HB3  SER  50           2HB      SER  50  15.139   1.053  -6.831
  382    HG   SER  50           HG       SER  50  17.116   0.200  -6.339
  383    H    GLY  51           H        GLY  51  13.912   2.866  -8.190
  384    HA2  GLY  51           1HA      GLY  51  13.814   3.671 -10.372
  385    HA3  GLY  51           2HA      GLY  51  15.411   4.373 -10.156
  386    H    GLU  52           H        GLU  52  13.793   2.219 -11.943
  387    HA   GLU  52           HA       GLU  52  15.572  -0.013 -11.942
  388    HB2  GLU  52           1HB      GLU  52  14.369  -0.704 -13.969
  389    HB3  GLU  52           2HB      GLU  52  13.261  -0.253 -12.681
  390    HG2  GLU  52           1HG      GLU  52  12.314   0.729 -14.537
  391    HG3  GLU  52           2HG      GLU  52  13.227   2.056 -13.822
  392    H    GLY  53           H        GLY  53  17.187  -0.551 -13.402
  393    HA2  GLY  53           1HA      GLY  53  18.075   1.630 -15.186
  394    HA3  GLY  53           2HA      GLY  53  19.206   0.763 -14.158
  395    H    HIS  54           H        HIS  54  20.476  -0.177 -15.677
  396    HA   HIS  54           HA       HIS  54  19.243  -1.653 -17.868
  397    HB2  HIS  54           1HB      HIS  54  21.338  -1.671 -18.900
  398    HB3  HIS  54           2HB      HIS  54  21.327  -0.124 -18.058
  399    HD1  HIS  54           1HD      HIS  54  22.103  -1.117 -15.232
  400    HD2  HIS  54           2HD      HIS  54  23.990  -2.291 -18.742
  401    HE1  HIS  54           1HE      HIS  54  24.400  -1.873 -14.541
  402    HA   PRO  55           HA       PRO  55  19.476  -5.530 -15.779
  403    HB2  PRO  55           1HB      PRO  55  19.291  -7.151 -17.949
  404    HB3  PRO  55           2HB      PRO  55  17.911  -6.260 -17.296
  405    HG2  PRO  55           1HG      PRO  55  19.667  -5.591 -19.627
  406    HG3  PRO  55           2HG      PRO  55  17.903  -5.473 -19.484
  407    HD2  PRO  55           1HD      PRO  55  19.532  -3.324 -19.233
  408    HD3  PRO  55           2HD      PRO  55  18.004  -3.473 -18.343
  409    H    THR  56           H        THR  56  21.904  -4.196 -17.569
  410    HA   THR  56           HA       THR  56  24.044  -4.793 -18.144
  411    HB   THR  56           HB       THR  56  24.147  -4.543 -15.669
  412    HG1  THR  56           1HG      THR  56  25.959  -5.334 -17.190
  413   HG21  THR  56          1HG2      THR  56  22.833  -6.243 -14.767
  414   HG22  THR  56          2HG2      THR  56  24.475  -6.806 -14.453
  415   HG23  THR  56          3HG2      THR  56  23.554  -7.479 -15.797
  416    H    SER  57           H        SER  57  22.109  -6.526 -19.301
  417    HA   SER  57           HA       SER  57  23.709  -8.986 -19.487
  418    HB2  SER  57           1HB      SER  57  21.766  -9.580 -18.183
  419    HB3  SER  57           2HB      SER  57  20.693  -8.790 -19.339
  420    HG   SER  57           HG       SER  57  21.069 -10.384 -20.792
  421    H    SER  58           H        SER  58  23.530 -10.109 -21.520
  422    HA   SER  58           HA       SER  58  23.415  -8.287 -23.738
  423    HB2  SER  58           1HB      SER  58  24.110 -10.235 -25.082
  424    HB3  SER  58           2HB      SER  58  25.125 -10.043 -23.653
  425    HG   SER  58           HG       SER  58  24.003 -11.712 -22.668
  426    H    GLY  59           H        GLY  59  21.545 -11.112 -22.677
  427    HA2  GLY  59           1HA      GLY  59  19.267 -11.485 -23.000
  428    HA3  GLY  59           2HA      GLY  59  19.212 -10.083 -24.058
  429    HA   PRO  60           HA       PRO  60  19.598 -14.306 -26.353
  430    HB2  PRO  60           1HB      PRO  60  16.995 -15.048 -26.562
  431    HB3  PRO  60           2HB      PRO  60  18.042 -15.581 -25.242
  432    HG2  PRO  60           1HG      PRO  60  16.016 -13.378 -25.280
  433    HG3  PRO  60           2HG      PRO  60  16.328 -14.590 -24.024
  434    HD2  PRO  60           1HD      PRO  60  17.254 -12.050 -23.861
  435    HD3  PRO  60           2HD      PRO  60  18.135 -13.433 -23.180
  436    H    SER  61           H        SER  61  17.286 -11.666 -26.483
  437    HA   SER  61           HA       SER  61  17.704 -11.494 -29.373
  438    HB2  SER  61           1HB      SER  61  14.975 -11.449 -28.062
  439    HB3  SER  61           2HB      SER  61  15.294 -11.106 -29.762
  440    HG   SER  61           HG       SER  61  16.045 -13.541 -28.532
  441    H    SER  62           H        SER  62  16.898  -9.388 -30.254
  442    HA   SER  62           HA       SER  62  16.871  -7.113 -30.260
  443    HB2  SER  62           1HB      SER  62  15.053  -7.549 -28.507
  444    HB3  SER  62           2HB      SER  62  16.287  -7.187 -27.300
  445    HG   SER  62           HG       SER  62  16.495  -5.132 -28.175
  446    H    GLY  63           H        GLY  63  19.330  -8.367 -30.006
  447    HA2  GLY  63           1HA      GLY  63  20.968  -7.518 -27.915
  448    HA3  GLY  63           2HA      GLY  63  21.524  -7.881 -29.542
  Start of MODEL   19
    1    H1   GLY   1           H        GLY   1 -13.713  19.720 -15.862
    2    HA2  GLY   1           1HA      GLY   1 -14.582  19.567 -18.618
    3    HA3  GLY   1           2HA      GLY   1 -13.577  18.221 -18.101
    4    H    SER   2           H        SER   2 -14.349  16.811 -16.470
    5    HA   SER   2           HA       SER   2 -16.962  17.112 -15.352
    6    HB2  SER   2           1HB      SER   2 -17.712  16.486 -17.555
    7    HB3  SER   2           2HB      SER   2 -16.570  15.143 -17.615
    8    HG   SER   2           HG       SER   2 -18.278  14.094 -16.922
    9    H    SER   3           H        SER   3 -17.431  15.548 -13.782
   10    HA   SER   3           HA       SER   3 -15.454  13.440 -13.336
   11    HB2  SER   3           1HB      SER   3 -16.113  15.641 -11.377
   12    HB3  SER   3           2HB      SER   3 -15.388  14.113 -10.879
   13    HG   SER   3           HG       SER   3 -13.909  14.855 -12.840
   14    H    GLY   4           H        GLY   4 -16.522  11.606 -13.049
   15    HA2  GLY   4           1HA      GLY   4 -18.565  11.266 -11.127
   16    HA3  GLY   4           2HA      GLY   4 -19.286  11.395 -12.724
   17    H    SER   5           H        SER   5 -16.456   9.754 -11.298
   18    HA   SER   5           HA       SER   5 -17.278   7.324 -12.747
   19    HB2  SER   5           1HB      SER   5 -14.900   6.652 -12.668
   20    HB3  SER   5           2HB      SER   5 -15.120   8.186 -13.509
   21    HG   SER   5           HG       SER   5 -14.378   7.934 -10.781
   22    H    SER   6           H        SER   6 -18.404   6.121 -11.339
   23    HA   SER   6           HA       SER   6 -17.974   6.085  -8.543
   24    HB2  SER   6           1HB      SER   6 -20.130   5.482  -9.627
   25    HB3  SER   6           2HB      SER   6 -19.380   4.009 -10.241
   26    HG   SER   6           HG       SER   6 -19.625   3.128  -8.353
   27    H    GLY   7           H        GLY   7 -17.169   3.725 -11.089
   28    HA2  GLY   7           1HA      GLY   7 -14.669   3.020 -10.245
   29    HA3  GLY   7           2HA      GLY   7 -15.738   2.026  -9.266
   30    H    ARG   8           H        ARG   8 -13.814   1.124 -11.209
   31    HA   ARG   8           HA       ARG   8 -15.605  -0.056 -13.229
   32    HB2  ARG   8           1HB      ARG   8 -12.725   0.752 -13.319
   33    HB3  ARG   8           2HB      ARG   8 -13.286  -0.554 -14.355
   34    HG2  ARG   8           1HG      ARG   8 -14.783   0.868 -15.501
   35    HG3  ARG   8           2HG      ARG   8 -14.591   2.150 -14.304
   36    HD2  ARG   8           1HD      ARG   8 -12.048   1.921 -15.047
   37    HD3  ARG   8           2HD      ARG   8 -12.803   1.332 -16.527
   38    HE   ARG   8           HE       ARG   8 -13.829   3.841 -15.501
   39   HH11  ARG   8          2HH1      ARG   8 -11.624   2.244 -17.671
   40   HH12  ARG   8          1HH1      ARG   8 -11.444   3.620 -18.709
   41   HH21  ARG   8          2HH2      ARG   8 -13.600   5.659 -16.860
   42   HH22  ARG   8          1HH2      ARG   8 -12.568   5.562 -18.246
   43    H    LYS   9           H        LYS   9 -12.758  -0.754 -11.213
   44    HA   LYS   9           HA       LYS   9 -13.479  -3.607 -11.313
   45    HB2  LYS   9           1HB      LYS   9 -10.851  -2.197 -10.933
   46    HB3  LYS   9           2HB      LYS   9 -11.064  -3.865 -10.420
   47    HG2  LYS   9           1HG      LYS   9 -11.578  -4.544 -12.670
   48    HG3  LYS   9           2HG      LYS   9 -11.537  -2.867 -13.221
   49    HD2  LYS   9           1HD      LYS   9  -9.252  -2.754 -13.137
   50    HD3  LYS   9           2HD      LYS   9  -9.132  -3.954 -11.848
   51    HE2  LYS   9           1HE      LYS   9  -8.304  -5.108 -13.672
   52    HE3  LYS   9           2HE      LYS   9  -9.996  -5.604 -13.653
   53    HZ1  LYS   9           1HZ      LYS   9 -10.454  -3.917 -15.339
   54    HZ2  LYS   9           2HZ      LYS   9  -9.305  -5.034 -15.880
   55    HZ3  LYS   9           3HZ      LYS   9  -8.816  -3.494 -15.379
   56    H    ILE  10           H        ILE  10 -14.855  -3.876  -9.630
   57    HA   ILE  10           HA       ILE  10 -15.081  -2.619  -7.256
   58    HB   ILE  10           HB       ILE  10 -15.885  -4.729  -6.252
   59   HG12  ILE  10          1HG1      ILE  10 -15.343  -6.130  -8.844
   60   HG13  ILE  10          2HG1      ILE  10 -14.076  -6.051  -7.626
   61   HG21  ILE  10          1HG2      ILE  10 -16.837  -4.388  -9.091
   62   HG22  ILE  10          2HG2      ILE  10 -17.748  -5.046  -7.733
   63   HG23  ILE  10          3HG2      ILE  10 -17.300  -3.341  -7.750
   64   HD11  ILE  10          1HD1      ILE  10 -16.141  -6.891  -6.118
   65   HD12  ILE  10          2HD1      ILE  10 -16.560  -7.610  -7.674
   66   HD13  ILE  10          3HD1      ILE  10 -15.002  -7.967  -6.929
   67    H    PHE  11           H        PHE  11 -12.487  -4.718  -8.202
   68    HA   PHE  11           HA       PHE  11 -11.460  -5.306  -5.635
   69    HB2  PHE  11           1HB      PHE  11  -9.903  -5.104  -8.218
   70    HB3  PHE  11           2HB      PHE  11  -9.453  -6.013  -6.779
   71    HD1  PHE  11           2HD      PHE  11 -11.674  -5.893  -9.690
   72    HD2  PHE  11           1HD      PHE  11 -10.443  -8.142  -6.292
   73    HE1  PHE  11           2HE      PHE  11 -12.823  -7.874 -10.589
   74    HE2  PHE  11           1HE      PHE  11 -11.590 -10.127  -7.186
   75    HZ   PHE  11           HZ       PHE  11 -12.783  -9.994  -9.337
   76    H    THR  12           H        THR  12  -9.182  -4.556  -5.001
   77    HA   THR  12           HA       THR  12  -8.839  -1.682  -5.511
   78    HB   THR  12           HB       THR  12  -8.372  -1.266  -3.146
   79    HG1  THR  12           1HG      THR  12  -9.357  -3.857  -2.556
   80   HG21  THR  12          1HG2      THR  12 -10.670  -1.576  -2.259
   81   HG22  THR  12          2HG2      THR  12 -11.036  -2.596  -3.651
   82   HG23  THR  12          3HG2      THR  12 -10.643  -0.893  -3.884
   83    H    ASN  13           H        ASN  13  -6.801  -1.114  -5.941
   84    HA   ASN  13           HA       ASN  13  -4.761  -3.053  -6.182
   85    HB2  ASN  13           1HB      ASN  13  -4.266  -0.083  -6.077
   86    HB3  ASN  13           2HB      ASN  13  -3.389  -1.308  -6.991
   87   HD21  ASN  13          1HD2      ASN  13  -5.804   1.015  -7.075
   88   HD22  ASN  13          2HD2      ASN  13  -6.494   0.613  -8.607
   89    H    LYS  14           H        LYS  14  -2.562  -2.786  -5.182
   90    HA   LYS  14           HA       LYS  14  -2.793  -2.033  -2.342
   91    HB2  LYS  14           1HB      LYS  14  -2.690  -4.565  -2.998
   92    HB3  LYS  14           2HB      LYS  14  -0.978  -4.242  -3.244
   93    HG2  LYS  14           1HG      LYS  14  -1.134  -3.213  -0.845
   94    HG3  LYS  14           2HG      LYS  14  -2.569  -4.235  -0.726
   95    HD2  LYS  14           1HD      LYS  14  -0.887  -5.617   0.080
   96    HD3  LYS  14           2HD      LYS  14  -1.011  -6.106  -1.612
   97    HE2  LYS  14           1HE      LYS  14   0.888  -4.681  -2.170
   98    HE3  LYS  14           2HE      LYS  14   0.999  -4.154  -0.492
   99    HZ1  LYS  14           1HZ      LYS  14   1.797  -6.684  -1.701
  100    HZ2  LYS  14           2HZ      LYS  14   1.148  -6.760  -0.141
  101    HZ3  LYS  14           3HZ      LYS  14   2.516  -5.811  -0.443
  102    H    CYS  15           H        CYS  15  -0.791  -1.414  -1.304
  103    HA   CYS  15           HA       CYS  15   0.925   0.071  -3.128
  104    HB2  CYS  15           1HB      CYS  15   0.095   1.311  -1.241
  105    HB3  CYS  15           2HB      CYS  15   0.661   0.079  -0.118
  106    H    GLU  16           H        GLU  16   3.084  -0.268  -3.409
  107    HA   GLU  16           HA       GLU  16   4.117  -2.820  -2.423
  108    HB2  GLU  16           1HB      GLU  16   5.223  -0.967  -4.542
  109    HB3  GLU  16           2HB      GLU  16   5.846  -2.562  -4.144
  110    HG2  GLU  16           1HG      GLU  16   3.397  -3.313  -4.694
  111    HG3  GLU  16           2HG      GLU  16   3.367  -1.802  -5.601
  112    H    ARG  17           H        ARG  17   3.932  -0.519  -0.663
  113    HA   ARG  17           HA       ARG  17   6.723   0.273  -0.294
  114    HB2  ARG  17           1HB      ARG  17   4.935   2.002  -0.219
  115    HB3  ARG  17           2HB      ARG  17   4.260   1.200   1.193
  116    HG2  ARG  17           1HG      ARG  17   5.491   2.844   2.188
  117    HG3  ARG  17           2HG      ARG  17   6.674   1.535   2.154
  118    HD2  ARG  17           1HD      ARG  17   6.464   3.591  -0.030
  119    HD3  ARG  17           2HD      ARG  17   7.475   3.823   1.396
  120    HE   ARG  17           HE       ARG  17   7.990   2.079  -0.836
  121   HH11  ARG  17          2HH1      ARG  17   8.668   2.743   2.514
  122   HH12  ARG  17          1HH1      ARG  17  10.187   1.910   2.507
  123   HH21  ARG  17          2HH2      ARG  17   9.988   0.979  -0.858
  124   HH22  ARG  17          1HH2      ARG  17  10.937   0.907   0.588
  125    H    ALA  18           H        ALA  18   7.846  -0.078   1.637
  126    HA   ALA  18           HA       ALA  18   7.327  -2.565   2.906
  127    HB1  ALA  18           1HB      ALA  18   9.592  -1.923   2.660
  128    HB2  ALA  18           2HB      ALA  18   9.316  -0.378   3.468
  129    HB3  ALA  18           3HB      ALA  18   9.248  -1.880   4.390
  130    H    GLY  19           H        GLY  19   6.249  -3.035   4.725
  131    HA2  GLY  19           1HA      GLY  19   4.989  -2.768   6.625
  132    HA3  GLY  19           2HA      GLY  19   5.959  -1.339   6.946
  133    H    CYS  20           H        CYS  20   3.901  -1.837   4.131
  134    HA   CYS  20           HA       CYS  20   2.016   0.153   5.192
  135    HB2  CYS  20           1HB      CYS  20   3.729   1.131   3.568
  136    HB3  CYS  20           2HB      CYS  20   2.943   0.168   2.322
  137    H    ARG  21           H        ARG  21  -0.089  -0.271   4.817
  138    HA   ARG  21           HA       ARG  21  -0.739  -2.456   2.953
  139    HB2  ARG  21           1HB      ARG  21  -1.993  -1.976   5.663
  140    HB3  ARG  21           2HB      ARG  21  -2.459  -3.230   4.522
  141    HG2  ARG  21           1HG      ARG  21   0.369  -3.129   5.426
  142    HG3  ARG  21           2HG      ARG  21  -0.856  -3.733   6.543
  143    HD2  ARG  21           1HD      ARG  21  -1.484  -5.468   5.060
  144    HD3  ARG  21           2HD      ARG  21  -0.580  -4.751   3.727
  145    HE   ARG  21           HE       ARG  21   1.380  -5.239   5.452
  146   HH11  ARG  21          2HH1      ARG  21  -1.295  -7.233   4.457
  147   HH12  ARG  21          1HH1      ARG  21  -0.439  -8.722   4.687
  148   HH21  ARG  21          2HH2      ARG  21   2.517  -7.192   5.758
  149   HH22  ARG  21          1HH2      ARG  21   1.728  -8.697   5.428
  150    H    GLN  22           H        GLN  22  -0.811   0.351   2.420
  151    HA   GLN  22           HA       GLN  22  -3.410   1.423   2.712
  152    HB2  GLN  22           1HB      GLN  22  -0.981   2.088   1.150
  153    HB3  GLN  22           2HB      GLN  22  -2.501   2.732   0.542
  154    HG2  GLN  22           1HG      GLN  22  -1.126   3.281   3.138
  155    HG3  GLN  22           2HG      GLN  22  -1.693   4.416   1.914
  156   HE21  GLN  22          1HE2      GLN  22  -4.195   4.022   1.510
  157   HE22  GLN  22          2HE2      GLN  22  -5.143   4.071   2.954
  158    H    ARG  23           H        ARG  23  -5.104   1.603   1.224
  159    HA   ARG  23           HA       ARG  23  -4.996  -0.233  -1.073
  160    HB2  ARG  23           1HB      ARG  23  -7.143  -0.005   1.029
  161    HB3  ARG  23           2HB      ARG  23  -7.454  -0.708  -0.553
  162    HG2  ARG  23           1HG      ARG  23  -5.408  -2.213   0.017
  163    HG3  ARG  23           2HG      ARG  23  -5.768  -1.738   1.679
  164    HD2  ARG  23           1HD      ARG  23  -7.848  -2.863  -0.180
  165    HD3  ARG  23           2HD      ARG  23  -6.843  -3.881   0.850
  166    HE   ARG  23           HE       ARG  23  -8.251  -1.766   2.225
  167   HH11  ARG  23          2HH1      ARG  23  -8.303  -5.081   1.164
  168   HH12  ARG  23          1HH1      ARG  23  -9.478  -5.575   2.337
  169   HH21  ARG  23          2HH2      ARG  23  -9.799  -2.403   3.774
  170   HH22  ARG  23          1HH2      ARG  23 -10.329  -4.051   3.821
  171    H    GLU  24           H        GLU  24  -4.852   1.303  -2.644
  172    HA   GLU  24           HA       GLU  24  -6.743   3.530  -2.631
  173    HB2  GLU  24           1HB      GLU  24  -4.364   2.912  -4.387
  174    HB3  GLU  24           2HB      GLU  24  -5.416   4.300  -4.620
  175    HG2  GLU  24           1HG      GLU  24  -3.282   4.749  -3.389
  176    HG3  GLU  24           2HG      GLU  24  -4.755   5.271  -2.574
  177    H    MET  25           H        MET  25  -8.466   3.659  -3.939
  178    HA   MET  25           HA       MET  25  -9.434   1.396  -5.289
  179    HB2  MET  25           1HB      MET  25 -10.740   3.401  -4.371
  180    HB3  MET  25           2HB      MET  25 -10.319   4.215  -5.872
  181    HG2  MET  25           1HG      MET  25 -11.370   2.268  -7.080
  182    HG3  MET  25           2HG      MET  25 -11.989   1.747  -5.515
  183    HE1  MET  25           1HE      MET  25 -13.376   2.874  -4.078
  184    HE2  MET  25           2HE      MET  25 -14.464   4.220  -4.414
  185    HE3  MET  25           3HE      MET  25 -14.809   2.621  -5.075
  186    H    MET  26           H        MET  26  -7.725   4.262  -6.437
  187    HA   MET  26           HA       MET  26  -7.803   3.251  -9.179
  188    HB2  MET  26           1HB      MET  26  -7.049   5.399  -9.870
  189    HB3  MET  26           2HB      MET  26  -8.285   5.670  -8.649
  190    HG2  MET  26           1HG      MET  26  -6.349   5.847  -6.992
  191    HG3  MET  26           2HG      MET  26  -5.319   5.995  -8.414
  192    HE1  MET  26           1HE      MET  26  -5.267   7.750  -6.229
  193    HE2  MET  26           2HE      MET  26  -4.797   9.075  -7.294
  194    HE3  MET  26           3HE      MET  26  -6.189   9.254  -6.224
  195    H    LYS  27           H        LYS  27  -5.909   2.907 -10.401
  196    HA   LYS  27           HA       LYS  27  -3.741   1.788  -8.883
  197    HB2  LYS  27           1HB      LYS  27  -4.306   0.577 -10.824
  198    HB3  LYS  27           2HB      LYS  27  -4.344   2.025 -11.821
  199    HG2  LYS  27           1HG      LYS  27  -1.850   2.209 -11.384
  200    HG3  LYS  27           2HG      LYS  27  -1.952   0.566 -10.748
  201    HD2  LYS  27           1HD      LYS  27  -2.357  -0.350 -12.801
  202    HD3  LYS  27           2HD      LYS  27  -3.158   1.100 -13.410
  203    HE2  LYS  27           1HE      LYS  27  -1.182   2.106 -14.001
  204    HE3  LYS  27           2HE      LYS  27  -0.249   1.230 -12.789
  205    HZ1  LYS  27           1HZ      LYS  27  -0.271  -0.711 -14.113
  206    HZ2  LYS  27           2HZ      LYS  27   0.159   0.558 -15.146
  207    HZ3  LYS  27           3HZ      LYS  27  -1.411  -0.070 -15.186
  208    H    LEU  28           H        LEU  28  -1.871   2.719  -8.355
  209    HA   LEU  28           HA       LEU  28  -1.081   5.181  -9.762
  210    HB2  LEU  28           1HB      LEU  28  -0.938   4.643  -6.800
  211    HB3  LEU  28           2HB      LEU  28  -0.222   6.038  -7.604
  212    HG   LEU  28           HG       LEU  28  -3.154   5.545  -7.877
  213   HD11  LEU  28          1HD1      LEU  28  -3.162   5.413  -5.587
  214   HD12  LEU  28          2HD1      LEU  28  -3.265   7.157  -5.820
  215   HD13  LEU  28          3HD1      LEU  28  -1.719   6.413  -5.413
  216   HD21  LEU  28          1HD2      LEU  28  -1.254   7.626  -8.477
  217   HD22  LEU  28          2HD2      LEU  28  -2.546   8.235  -7.442
  218   HD23  LEU  28          3HD2      LEU  28  -2.937   7.462  -8.979
  219    H    THR  29           H        THR  29   0.673   4.635 -10.887
  220    HA   THR  29           HA       THR  29   2.723   2.979  -9.567
  221    HB   THR  29           HB       THR  29   2.125   3.304 -12.512
  222    HG1  THR  29           1HG      THR  29   2.227   0.840 -11.176
  223   HG21  THR  29          1HG2      THR  29   3.976   1.885 -12.988
  224   HG22  THR  29          2HG2      THR  29   4.260   1.571 -11.275
  225   HG23  THR  29          3HG2      THR  29   4.581   3.171 -11.944
  226    H    CYS  30           H        CYS  30   4.764   3.737  -9.379
  227    HA   CYS  30           HA       CYS  30   5.288   6.472  -9.513
  228    HB2  CYS  30           1HB      CYS  30   6.533   4.614  -8.223
  229    HB3  CYS  30           2HB      CYS  30   7.458   4.395  -9.705
  230    H    GLU  31           H        GLU  31   7.198   7.404 -10.786
  231    HA   GLU  31           HA       GLU  31   6.789   6.731 -13.617
  232    HB2  GLU  31           1HB      GLU  31   6.213   8.983 -13.295
  233    HB3  GLU  31           2HB      GLU  31   7.560   9.266 -12.201
  234    HG2  GLU  31           1HG      GLU  31   8.289  10.333 -14.085
  235    HG3  GLU  31           2HG      GLU  31   9.010   8.739 -14.302
  236    H    ARG  32           H        ARG  32   9.172   6.960 -11.106
  237    HA   ARG  32           HA       ARG  32  11.397   6.702 -12.957
  238    HB2  ARG  32           1HB      ARG  32  11.407   6.652  -9.935
  239    HB3  ARG  32           2HB      ARG  32  12.810   6.816 -10.982
  240    HG2  ARG  32           1HG      ARG  32  12.333   8.998 -11.512
  241    HG3  ARG  32           2HG      ARG  32  10.610   8.813 -11.181
  242    HD2  ARG  32           1HD      ARG  32  10.863   9.146  -8.941
  243    HD3  ARG  32           2HD      ARG  32  12.485   8.457  -8.913
  244    HE   ARG  32           HE       ARG  32  11.792  11.206  -9.263
  245   HH11  ARG  32          2HH1      ARG  32  14.153   8.773 -10.053
  246   HH12  ARG  32          1HH1      ARG  32  15.442   9.910 -10.273
  247   HH21  ARG  32          2HH2      ARG  32  13.481  12.712  -9.549
  248   HH22  ARG  32          1HH2      ARG  32  15.059  12.150  -9.985
  249    H    CYS  33           H        CYS  33  10.143   4.835 -10.186
  250    HA   CYS  33           HA       CYS  33  11.617   2.491 -11.048
  251    HB2  CYS  33           1HB      CYS  33  10.584   1.450  -9.009
  252    HB3  CYS  33           2HB      CYS  33  11.559   2.879  -8.683
  253    H    SER  34           H        SER  34   8.403   3.766 -11.238
  254    HA   SER  34           HA       SER  34   6.551   3.064 -12.362
  255    HB2  SER  34           1HB      SER  34   8.375   2.335 -14.043
  256    HB3  SER  34           2HB      SER  34   8.097   0.708 -13.422
  257    HG   SER  34           HG       SER  34   6.817   1.375 -15.310
  258    H    ARG  35           H        ARG  35   6.891   2.300  -9.705
  259    HA   ARG  35           HA       ARG  35   5.699  -0.394  -9.658
  260    HB2  ARG  35           1HB      ARG  35   7.412   1.052  -7.648
  261    HB3  ARG  35           2HB      ARG  35   6.422  -0.330  -7.196
  262    HG2  ARG  35           1HG      ARG  35   7.642  -1.501  -9.177
  263    HG3  ARG  35           2HG      ARG  35   8.831  -0.217  -8.948
  264    HD2  ARG  35           1HD      ARG  35   9.328  -0.912  -6.768
  265    HD3  ARG  35           2HD      ARG  35   7.858  -1.877  -6.647
  266    HE   ARG  35           HE       ARG  35   9.765  -2.732  -8.654
  267   HH11  ARG  35          2HH1      ARG  35   8.577  -3.087  -5.401
  268   HH12  ARG  35          1HH1      ARG  35   9.237  -4.676  -5.195
  269   HH21  ARG  35          2HH2      ARG  35  10.639  -4.823  -8.395
  270   HH22  ARG  35          1HH2      ARG  35  10.410  -5.662  -6.898
  271    H    ASN  36           H        ASN  36   3.930  -0.770  -8.258
  272    HA   ASN  36           HA       ASN  36   2.089   1.399  -8.116
  273    HB2  ASN  36           1HB      ASN  36   1.383  -0.939  -8.505
  274    HB3  ASN  36           2HB      ASN  36   1.899  -1.355  -6.873
  275   HD21  ASN  36          1HD2      ASN  36  -0.465  -2.054  -7.022
  276   HD22  ASN  36          2HD2      ASN  36  -1.625  -0.906  -6.455
  277    H    PHE  37           H        PHE  37   1.313   2.513  -6.353
  278    HA   PHE  37           HA       PHE  37   2.192   1.920  -3.682
  279    HB2  PHE  37           1HB      PHE  37   3.158   4.479  -4.975
  280    HB3  PHE  37           2HB      PHE  37   3.411   3.998  -3.301
  281    HD1  PHE  37           2HD      PHE  37   4.653   1.727  -2.960
  282    HD2  PHE  37           1HD      PHE  37   4.791   4.035  -6.534
  283    HE1  PHE  37           2HE      PHE  37   6.749   0.608  -3.598
  284    HE2  PHE  37           1HE      PHE  37   6.887   2.919  -7.178
  285    HZ   PHE  37           HZ       PHE  37   7.870   1.204  -5.708
  286    H    CYS  38           H        CYS  38   1.375   3.592  -2.115
  287    HA   CYS  38           HA       CYS  38  -1.308   4.377  -2.930
  288    HB2  CYS  38           1HB      CYS  38  -1.767   4.652  -0.578
  289    HB3  CYS  38           2HB      CYS  38  -0.922   3.124  -0.807
  290    H    ILE  39           H        ILE  39  -2.159   6.478  -2.564
  291    HA   ILE  39           HA       ILE  39  -0.847   8.599  -3.573
  292    HB   ILE  39           HB       ILE  39  -2.895   8.623  -1.361
  293   HG12  ILE  39          1HG1      ILE  39  -3.156   9.279  -4.301
  294   HG13  ILE  39          2HG1      ILE  39  -3.524   7.703  -3.610
  295   HG21  ILE  39          1HG2      ILE  39  -2.024  10.977  -3.027
  296   HG22  ILE  39          2HG2      ILE  39  -3.211  10.968  -1.723
  297   HG23  ILE  39          3HG2      ILE  39  -1.506  10.691  -1.365
  298   HD11  ILE  39          1HD1      ILE  39  -5.599   8.657  -3.696
  299   HD12  ILE  39          2HD1      ILE  39  -5.103   9.086  -2.059
  300   HD13  ILE  39          3HD1      ILE  39  -4.991  10.276  -3.355
  301    H    LYS  40           H        LYS  40  -0.704   7.529  -0.214
  302    HA   LYS  40           HA       LYS  40   0.787   9.714   0.780
  303    HB2  LYS  40           1HB      LYS  40   0.144   6.964   1.718
  304    HB3  LYS  40           2HB      LYS  40   1.497   7.785   2.486
  305    HG2  LYS  40           1HG      LYS  40  -0.236   8.378   3.861
  306    HG3  LYS  40           2HG      LYS  40  -0.201   9.745   2.745
  307    HD2  LYS  40           1HD      LYS  40  -2.481   9.072   3.016
  308    HD3  LYS  40           2HD      LYS  40  -1.963   8.590   1.399
  309    HE2  LYS  40           1HE      LYS  40  -2.027   6.364   1.894
  310    HE3  LYS  40           2HE      LYS  40  -1.636   6.619   3.594
  311    HZ1  LYS  40           1HZ      LYS  40  -3.978   5.861   3.034
  312    HZ2  LYS  40           2HZ      LYS  40  -4.245   7.431   2.466
  313    HZ3  LYS  40           3HZ      LYS  40  -3.832   7.177   4.087
  314    H    HIS  41           H        HIS  41   1.720   6.622  -0.640
  315    HA   HIS  41           HA       HIS  41   4.534   7.489  -0.550
  316    HB2  HIS  41           1HB      HIS  41   3.407   4.693  -0.809
  317    HB3  HIS  41           2HB      HIS  41   5.120   5.104  -0.801
  318    HD2  HIS  41           2HD      HIS  41   5.049   7.112   1.830
  319    HE1  HIS  41           1HE      HIS  41   3.542   3.678   3.815
  320    HE2  HIS  41           2HE      HIS  41   4.530   5.978   4.096
  321    H    ARG  42           H        ARG  42   2.340   8.107  -2.533
  322    HA   ARG  42           HA       ARG  42   3.049   6.727  -4.943
  323    HB2  ARG  42           1HB      ARG  42   0.876   7.483  -5.056
  324    HB3  ARG  42           2HB      ARG  42   1.242   8.987  -4.221
  325    HG2  ARG  42           1HG      ARG  42   0.737   9.587  -6.433
  326    HG3  ARG  42           2HG      ARG  42   2.494   9.683  -6.305
  327    HD2  ARG  42           1HD      ARG  42   2.327   7.174  -7.126
  328    HD3  ARG  42           2HD      ARG  42   0.792   7.742  -7.782
  329    HE   ARG  42           HE       ARG  42   3.411   8.359  -8.750
  330   HH11  ARG  42          2HH1      ARG  42   0.146   9.537  -8.484
  331   HH12  ARG  42          1HH1      ARG  42   0.268  10.572  -9.868
  332   HH21  ARG  42          2HH2      ARG  42   3.584   9.719 -10.574
  333   HH22  ARG  42          1HH2      ARG  42   2.224  10.674 -11.056
  334    H    HIS  43           H        HIS  43   4.015   9.692  -3.364
  335    HA   HIS  43           HA       HIS  43   5.439  10.708  -5.655
  336    HB2  HIS  43           1HB      HIS  43   4.375  11.972  -3.572
  337    HB3  HIS  43           2HB      HIS  43   5.985  11.721  -2.904
  338    HD1  HIS  43           1HD      HIS  43   7.928  13.039  -3.963
  339    HD2  HIS  43           2HD      HIS  43   4.230  13.796  -5.700
  340    HE1  HIS  43           1HE      HIS  43   8.264  15.075  -5.401
  341    HA   PRO  44           HA       PRO  44   9.203   8.505  -5.039
  342    HB2  PRO  44           1HB      PRO  44  10.881  10.171  -6.371
  343    HB3  PRO  44           2HB      PRO  44   9.729   9.111  -7.191
  344    HG2  PRO  44           1HG      PRO  44   9.502  12.029  -6.564
  345    HG3  PRO  44           2HG      PRO  44   9.071  11.168  -8.053
  346    HD2  PRO  44           1HD      PRO  44   7.229  11.901  -6.209
  347    HD3  PRO  44           2HD      PRO  44   7.061  10.435  -7.197
  348    H    LEU  45           H        LEU  45   8.335  11.055  -3.295
  349    HA   LEU  45           HA       LEU  45  11.005  11.506  -2.139
  350    HB2  LEU  45           1HB      LEU  45   8.516  13.185  -2.171
  351    HB3  LEU  45           2HB      LEU  45   9.829  13.487  -1.035
  352    HG   LEU  45           HG       LEU  45  10.027  13.608  -4.044
  353   HD11  LEU  45          1HD1      LEU  45   9.589  15.639  -1.918
  354   HD12  LEU  45          2HD1      LEU  45   8.937  15.553  -3.554
  355   HD13  LEU  45          3HD1      LEU  45  10.604  16.068  -3.295
  356   HD21  LEU  45          1HD2      LEU  45  12.057  14.050  -1.864
  357   HD22  LEU  45          2HD2      LEU  45  12.266  14.621  -3.520
  358   HD23  LEU  45          3HD2      LEU  45  12.127  12.893  -3.194
  359    H    ASP  46           H        ASP  46   7.741  10.467  -1.493
  360    HA   ASP  46           HA       ASP  46   8.384  10.075   1.344
  361    HB2  ASP  46           1HB      ASP  46   5.787  10.180  -0.176
  362    HB3  ASP  46           2HB      ASP  46   5.872   9.513   1.452
  363    H    HIS  47           H        HIS  47   9.394   8.410  -0.890
  364    HA   HIS  47           HA       HIS  47   8.897   5.857   0.311
  365    HB2  HIS  47           1HB      HIS  47   7.676   4.784  -1.315
  366    HB3  HIS  47           2HB      HIS  47   6.988   6.401  -1.441
  367    HD1  HIS  47           1HD      HIS  47   6.764   7.139  -3.778
  368    HD2  HIS  47           2HD      HIS  47  10.012   4.597  -3.280
  369    HE1  HIS  47           1HE      HIS  47   7.777   6.886  -6.066
  370    H    ASP  48           H        ASP  48  10.621   4.556   0.057
  371    HA   ASP  48           HA       ASP  48  13.009   5.513  -1.020
  372    HB2  ASP  48           1HB      ASP  48  12.106   2.738  -0.265
  373    HB3  ASP  48           2HB      ASP  48  13.732   3.059  -0.861
  374    H    CYS  49           H        CYS  49  12.729   6.205  -3.137
  375    HA   CYS  49           HA       CYS  49  11.753   4.403  -5.165
  376    HB2  CYS  49           1HB      CYS  49  11.462   6.934  -5.162
  377    HB3  CYS  49           2HB      CYS  49  13.160   7.033  -5.617
  378    H    SER  50           H        SER  50  12.926   2.942  -6.202
  379    HA   SER  50           HA       SER  50  15.826   2.975  -5.923
  380    HB2  SER  50           1HB      SER  50  13.987   0.878  -7.103
  381    HB3  SER  50           2HB      SER  50  15.722   0.691  -6.852
  382    HG   SER  50           HG       SER  50  15.142   1.239  -4.556
  383    H    GLY  51           H        GLY  51  13.439   2.644  -8.554
  384    HA2  GLY  51           1HA      GLY  51  13.587   3.866 -10.593
  385    HA3  GLY  51           2HA      GLY  51  15.313   4.053 -10.320
  386    H    GLU  52           H        GLU  52  13.040   1.312 -10.573
  387    HA   GLU  52           HA       GLU  52  14.584  -0.693 -11.398
  388    HB2  GLU  52           1HB      GLU  52  11.978  -0.456 -11.374
  389    HB3  GLU  52           2HB      GLU  52  12.177  -0.120 -13.089
  390    HG2  GLU  52           1HG      GLU  52  12.909  -2.248 -13.563
  391    HG3  GLU  52           2HG      GLU  52  13.452  -2.543 -11.913
  392    H    GLY  53           H        GLY  53  13.522   1.936 -13.540
  393    HA2  GLY  53           1HA      GLY  53  14.848   2.878 -15.248
  394    HA3  GLY  53           2HA      GLY  53  15.877   1.455 -15.204
  395    H    HIS  54           H        HIS  54  15.505  -0.194 -16.596
  396    HA   HIS  54           HA       HIS  54  13.442   0.260 -18.614
  397    HB2  HIS  54           1HB      HIS  54  14.663  -1.366 -19.965
  398    HB3  HIS  54           2HB      HIS  54  15.758  -0.122 -19.369
  399    HD1  HIS  54           1HD      HIS  54  17.725  -0.882 -18.002
  400    HD2  HIS  54           2HD      HIS  54  14.938  -3.902 -18.614
  401    HE1  HIS  54           1HE      HIS  54  18.811  -2.983 -17.147
  402    HA   PRO  55           HA       PRO  55  10.806  -2.881 -16.997
  403    HB2  PRO  55           1HB      PRO  55   9.340  -3.361 -19.231
  404    HB3  PRO  55           2HB      PRO  55   9.142  -1.906 -18.246
  405    HG2  PRO  55           1HG      PRO  55  10.663  -2.272 -20.799
  406    HG3  PRO  55           2HG      PRO  55   9.602  -0.938 -20.310
  407    HD2  PRO  55           1HD      PRO  55  12.301  -0.775 -20.180
  408    HD3  PRO  55           2HD      PRO  55  11.238   0.061 -19.030
  409    H    THR  56           H        THR  56  10.177  -5.131 -17.378
  410    HA   THR  56           HA       THR  56  12.073  -6.589 -19.097
  411    HB   THR  56           HB       THR  56  12.199  -8.368 -17.389
  412    HG1  THR  56           1HG      THR  56  10.131  -7.204 -16.355
  413   HG21  THR  56          1HG2      THR  56  13.117  -5.589 -16.798
  414   HG22  THR  56          2HG2      THR  56  14.059  -7.016 -17.228
  415   HG23  THR  56          3HG2      THR  56  13.392  -6.856 -15.604
  416    H    SER  57           H        SER  57  11.362  -8.721 -19.756
  417    HA   SER  57           HA       SER  57   9.852 -10.188 -20.621
  418    HB2  SER  57           1HB      SER  57   9.130 -10.468 -18.282
  419    HB3  SER  57           2HB      SER  57   8.023  -9.107 -18.462
  420    HG   SER  57           HG       SER  57   6.998 -11.153 -18.754
  421    H    SER  58           H        SER  58  10.130  -7.750 -21.902
  422    HA   SER  58           HA       SER  58   7.386  -7.072 -22.723
  423    HB2  SER  58           1HB      SER  58   9.964  -5.507 -22.899
  424    HB3  SER  58           2HB      SER  58   8.489  -5.021 -23.733
  425    HG   SER  58           HG       SER  58   7.532  -4.599 -21.836
  426    H    GLY  59           H        GLY  59   7.156  -8.853 -24.131
  427    HA2  GLY  59           1HA      GLY  59   8.950  -8.860 -26.469
  428    HA3  GLY  59           2HA      GLY  59   7.956 -10.214 -25.954
  429    HA   PRO  60           HA       PRO  60   5.301  -6.876 -28.328
  430    HB2  PRO  60           1HB      PRO  60   6.699  -5.732 -30.354
  431    HB3  PRO  60           2HB      PRO  60   6.588  -5.018 -28.741
  432    HG2  PRO  60           1HG      PRO  60   8.791  -6.651 -29.943
  433    HG3  PRO  60           2HG      PRO  60   8.898  -5.183 -28.954
  434    HD2  PRO  60           1HD      PRO  60   9.304  -7.658 -27.935
  435    HD3  PRO  60           2HD      PRO  60   8.597  -6.338 -26.982
  436    H    SER  61           H        SER  61   7.908  -8.623 -29.989
  437    HA   SER  61           HA       SER  61   6.113 -10.409 -31.264
  438    HB2  SER  61           1HB      SER  61   6.513  -9.714 -33.605
  439    HB3  SER  61           2HB      SER  61   5.641  -8.482 -32.693
  440    HG   SER  61           HG       SER  61   8.028  -7.762 -32.321
  441    H    SER  62           H        SER  62   7.249 -11.900 -32.753
  442    HA   SER  62           HA       SER  62  10.101 -12.097 -32.038
  443    HB2  SER  62           1HB      SER  62   8.896 -13.926 -31.051
  444    HB3  SER  62           2HB      SER  62   8.062 -14.267 -32.566
  445    HG   SER  62           HG       SER  62   9.895 -15.093 -33.407
  446    H    GLY  63           H        GLY  63  11.590 -12.724 -33.616
  447    HA2  GLY  63           1HA      GLY  63  10.774 -12.054 -36.330
  448    HA3  GLY  63           2HA      GLY  63  12.422 -12.266 -35.758
  Start of MODEL   20
    1    H1   GLY   1           H        GLY   1 -14.420 -29.447  -7.841
    2    HA2  GLY   1           1HA      GLY   1 -15.011 -27.897  -9.441
    3    HA3  GLY   1           2HA      GLY   1 -16.642 -28.432  -9.064
    4    H    SER   2           H        SER   2 -16.866 -26.071  -9.834
    5    HA   SER   2           HA       SER   2 -17.055 -23.811  -9.385
    6    HB2  SER   2           1HB      SER   2 -18.447 -25.239  -7.123
    7    HB3  SER   2           2HB      SER   2 -18.538 -23.489  -7.319
    8    HG   SER   2           HG       SER   2 -20.200 -24.967  -8.365
    9    H    SER   3           H        SER   3 -14.498 -24.612  -8.671
   10    HA   SER   3           HA       SER   3 -14.030 -23.000  -6.249
   11    HB2  SER   3           1HB      SER   3 -12.168 -24.419  -5.657
   12    HB3  SER   3           2HB      SER   3 -13.583 -25.442  -5.904
   13    HG   SER   3           HG       SER   3 -12.572 -25.422  -8.219
   14    H    GLY   4           H        GLY   4 -12.748 -21.287  -6.511
   15    HA2  GLY   4           1HA      GLY   4 -10.817 -21.276  -8.725
   16    HA3  GLY   4           2HA      GLY   4 -11.998 -19.978  -8.628
   17    H    SER   5           H        SER   5  -9.917 -18.729  -8.585
   18    HA   SER   5           HA       SER   5  -8.571 -18.738  -5.997
   19    HB2  SER   5           1HB      SER   5  -6.906 -17.368  -6.997
   20    HB3  SER   5           2HB      SER   5  -7.334 -18.564  -8.221
   21    HG   SER   5           HG       SER   5  -8.298 -15.897  -8.064
   22    H    SER   6           H        SER   6  -8.213 -16.698  -4.855
   23    HA   SER   6           HA       SER   6 -10.066 -14.532  -5.377
   24    HB2  SER   6           1HB      SER   6 -10.431 -16.484  -3.156
   25    HB3  SER   6           2HB      SER   6 -10.725 -14.783  -2.800
   26    HG   SER   6           HG       SER   6 -11.927 -16.273  -4.898
   27    H    GLY   7           H        GLY   7  -8.786 -12.815  -5.237
   28    HA2  GLY   7           1HA      GLY   7  -7.471 -12.107  -2.826
   29    HA3  GLY   7           2HA      GLY   7  -6.301 -12.696  -3.997
   30    H    ARG   8           H        ARG   8  -5.246 -10.920  -4.646
   31    HA   ARG   8           HA       ARG   8  -6.075  -8.326  -4.740
   32    HB2  ARG   8           1HB      ARG   8  -4.324  -7.903  -6.348
   33    HB3  ARG   8           2HB      ARG   8  -3.765  -9.111  -5.199
   34    HG2  ARG   8           1HG      ARG   8  -3.070 -10.120  -7.095
   35    HG3  ARG   8           2HG      ARG   8  -4.720 -10.745  -7.074
   36    HD2  ARG   8           1HD      ARG   8  -4.325  -9.956  -9.272
   37    HD3  ARG   8           2HD      ARG   8  -5.367  -8.768  -8.491
   38    HE   ARG   8           HE       ARG   8  -2.945  -7.732  -8.046
   39   HH11  ARG   8          2HH1      ARG   8  -4.400  -9.020 -10.935
   40   HH12  ARG   8          1HH1      ARG   8  -3.505  -7.989 -12.002
   41   HH21  ARG   8          2HH2      ARG   8  -1.761  -6.369  -9.441
   42   HH22  ARG   8          1HH2      ARG   8  -2.004  -6.482 -11.151
   43    H    LYS   9           H        LYS   9  -7.377  -7.096  -5.961
   44    HA   LYS   9           HA       LYS   9  -8.391  -8.195  -8.491
   45    HB2  LYS   9           1HB      LYS   9 -10.075  -6.888  -6.345
   46    HB3  LYS   9           2HB      LYS   9 -10.650  -7.384  -7.932
   47    HG2  LYS   9           1HG      LYS   9  -9.694  -9.721  -7.151
   48    HG3  LYS   9           2HG      LYS   9  -9.979  -9.025  -5.554
   49    HD2  LYS   9           1HD      LYS   9 -11.968 -10.159  -6.090
   50    HD3  LYS   9           2HD      LYS   9 -12.316  -8.456  -6.401
   51    HE2  LYS   9           1HE      LYS   9 -11.459  -9.119  -8.823
   52    HE3  LYS   9           2HE      LYS   9 -11.993 -10.717  -8.302
   53    HZ1  LYS   9           1HZ      LYS   9 -14.052  -9.120  -7.579
   54    HZ2  LYS   9           2HZ      LYS   9 -13.989 -10.046  -8.993
   55    HZ3  LYS   9           3HZ      LYS   9 -13.550  -8.413  -9.032
   56    H    ILE  10           H        ILE  10  -8.496  -6.769 -10.131
   57    HA   ILE  10           HA       ILE  10  -7.104  -4.482 -10.305
   58    HB   ILE  10           HB       ILE  10  -9.776  -4.925 -11.641
   59   HG12  ILE  10          1HG1      ILE  10  -8.193  -6.756 -12.041
   60   HG13  ILE  10          2HG1      ILE  10  -8.445  -5.814 -13.506
   61   HG21  ILE  10          1HG2      ILE  10  -9.356  -2.700 -12.058
   62   HG22  ILE  10          2HG2      ILE  10  -7.606  -2.918 -12.042
   63   HG23  ILE  10          3HG2      ILE  10  -8.550  -3.468 -13.426
   64   HD11  ILE  10          1HD1      ILE  10  -6.041  -5.975 -11.752
   65   HD12  ILE  10          2HD1      ILE  10  -6.169  -6.132 -13.504
   66   HD13  ILE  10          3HD1      ILE  10  -6.317  -4.546 -12.747
   67    H    PHE  11           H        PHE  11 -10.478  -4.684  -9.226
   68    HA   PHE  11           HA       PHE  11 -11.245  -2.116  -8.986
   69    HB2  PHE  11           1HB      PHE  11 -11.645  -4.466  -7.178
   70    HB3  PHE  11           2HB      PHE  11 -12.237  -2.888  -6.669
   71    HD1  PHE  11           1HD      PHE  11 -13.887  -1.684  -8.122
   72    HD2  PHE  11           2HD      PHE  11 -12.807  -5.751  -8.760
   73    HE1  PHE  11           1HE      PHE  11 -15.915  -2.006  -9.477
   74    HE2  PHE  11           2HE      PHE  11 -14.833  -6.080 -10.117
   75    HZ   PHE  11           HZ       PHE  11 -16.390  -4.206 -10.478
   76    H    THR  12           H        THR  12  -9.378  -3.792  -6.451
   77    HA   THR  12           HA       THR  12  -8.334  -1.163  -5.623
   78    HB   THR  12           HB       THR  12  -8.123  -2.125  -3.317
   79    HG1  THR  12           1HG      THR  12  -8.409  -4.226  -3.262
   80   HG21  THR  12          1HG2      THR  12 -10.047  -1.090  -2.861
   81   HG22  THR  12          2HG2      THR  12 -10.982  -2.370  -3.635
   82   HG23  THR  12          3HG2      THR  12 -10.355  -1.032  -4.596
   83    H    ASN  13           H        ASN  13  -6.186  -0.951  -5.603
   84    HA   ASN  13           HA       ASN  13  -4.561  -3.297  -6.216
   85    HB2  ASN  13           1HB      ASN  13  -2.757  -1.582  -6.611
   86    HB3  ASN  13           2HB      ASN  13  -4.163  -1.430  -7.662
   87   HD21  ASN  13          1HD2      ASN  13  -5.460   0.350  -7.512
   88   HD22  ASN  13          2HD2      ASN  13  -5.066   1.731  -6.551
   89    H    LYS  14           H        LYS  14  -2.252  -3.152  -5.206
   90    HA   LYS  14           HA       LYS  14  -2.511  -2.562  -2.332
   91    HB2  LYS  14           1HB      LYS  14  -2.661  -4.930  -2.498
   92    HB3  LYS  14           2HB      LYS  14  -1.349  -5.003  -3.667
   93    HG2  LYS  14           1HG      LYS  14   0.157  -4.129  -1.837
   94    HG3  LYS  14           2HG      LYS  14  -1.179  -4.433  -0.724
   95    HD2  LYS  14           1HD      LYS  14  -1.055  -6.727  -0.997
   96    HD3  LYS  14           2HD      LYS  14  -0.255  -6.600  -2.565
   97    HE2  LYS  14           1HE      LYS  14   1.067  -5.707  -0.019
   98    HE3  LYS  14           2HE      LYS  14   1.154  -7.376  -0.581
   99    HZ1  LYS  14           1HZ      LYS  14   2.663  -5.150  -1.425
  100    HZ2  LYS  14           2HZ      LYS  14   1.797  -5.760  -2.743
  101    HZ3  LYS  14           3HZ      LYS  14   2.832  -6.774  -1.870
  102    H    CYS  15           H        CYS  15  -1.106  -1.062  -1.735
  103    HA   CYS  15           HA       CYS  15   0.911   0.016  -3.275
  104    HB2  CYS  15           1HB      CYS  15   0.016   1.117  -1.278
  105    HB3  CYS  15           2HB      CYS  15   0.763  -0.106  -0.255
  106    H    GLU  16           H        GLU  16   3.203  -0.125  -3.196
  107    HA   GLU  16           HA       GLU  16   4.157  -2.803  -2.436
  108    HB2  GLU  16           1HB      GLU  16   5.311  -0.876  -4.460
  109    HB3  GLU  16           2HB      GLU  16   5.921  -2.487  -4.110
  110    HG2  GLU  16           1HG      GLU  16   3.435  -3.157  -4.725
  111    HG3  GLU  16           2HG      GLU  16   3.524  -1.651  -5.638
  112    H    ARG  17           H        ARG  17   3.941  -0.416  -0.690
  113    HA   ARG  17           HA       ARG  17   6.778   0.096  -0.127
  114    HB2  ARG  17           1HB      ARG  17   4.842   1.918  -0.377
  115    HB3  ARG  17           2HB      ARG  17   4.626   1.546   1.328
  116    HG2  ARG  17           1HG      ARG  17   7.379   2.109   0.381
  117    HG3  ARG  17           2HG      ARG  17   6.249   3.460   0.495
  118    HD2  ARG  17           1HD      ARG  17   5.777   2.326   2.862
  119    HD3  ARG  17           2HD      ARG  17   7.437   1.781   2.629
  120    HE   ARG  17           HE       ARG  17   7.611   4.414   2.104
  121   HH11  ARG  17          2HH1      ARG  17   6.204   2.630   4.742
  122   HH12  ARG  17          1HH1      ARG  17   6.493   3.876   5.910
  123   HH21  ARG  17          2HH2      ARG  17   7.997   6.062   3.633
  124   HH22  ARG  17          1HH2      ARG  17   7.512   5.828   5.278
  125    H    ALA  18           H        ALA  18   7.650  -0.277   1.903
  126    HA   ALA  18           HA       ALA  18   6.551  -2.459   3.355
  127    HB1  ALA  18           1HB      ALA  18   9.010  -0.882   3.400
  128    HB2  ALA  18           2HB      ALA  18   8.500  -1.455   4.989
  129    HB3  ALA  18           3HB      ALA  18   8.760  -2.606   3.678
  130    H    GLY  19           H        GLY  19   5.526  -2.535   5.312
  131    HA2  GLY  19           1HA      GLY  19   4.227  -1.810   7.059
  132    HA3  GLY  19           2HA      GLY  19   5.342  -0.457   7.177
  133    H    CYS  20           H        CYS  20   3.291  -1.231   4.415
  134    HA   CYS  20           HA       CYS  20   1.611   1.096   5.039
  135    HB2  CYS  20           1HB      CYS  20   3.502   1.561   3.341
  136    HB3  CYS  20           2HB      CYS  20   2.560   0.569   2.233
  137    H    ARG  21           H        ARG  21   2.024  -1.611   2.757
  138    HA   ARG  21           HA       ARG  21   0.390  -2.736   1.548
  139    HB2  ARG  21           1HB      ARG  21  -0.690  -4.321   2.954
  140    HB3  ARG  21           2HB      ARG  21   0.854  -3.952   3.710
  141    HG2  ARG  21           1HG      ARG  21  -0.541  -2.205   5.052
  142    HG3  ARG  21           2HG      ARG  21  -1.902  -3.223   4.576
  143    HD2  ARG  21           1HD      ARG  21   0.521  -4.513   5.730
  144    HD3  ARG  21           2HD      ARG  21  -0.580  -3.661   6.812
  145    HE   ARG  21           HE       ARG  21  -1.104  -6.122   5.364
  146   HH11  ARG  21          2HH1      ARG  21  -2.380  -3.490   7.252
  147   HH12  ARG  21          1HH1      ARG  21  -3.818  -4.342   7.709
  148   HH21  ARG  21          2HH2      ARG  21  -2.993  -7.255   5.959
  149   HH22  ARG  21          1HH2      ARG  21  -4.165  -6.484   6.973
  150    H    GLN  22           H        GLN  22  -0.310   0.007   1.716
  151    HA   GLN  22           HA       GLN  22  -2.933   0.451   2.620
  152    HB2  GLN  22           1HB      GLN  22  -1.019   1.836   0.846
  153    HB3  GLN  22           2HB      GLN  22  -2.714   2.222   0.581
  154    HG2  GLN  22           1HG      GLN  22  -1.056   2.649   3.035
  155    HG3  GLN  22           2HG      GLN  22  -1.971   3.827   2.095
  156   HE21  GLN  22          1HE2      GLN  22  -1.960   2.845   4.990
  157   HE22  GLN  22          2HE2      GLN  22  -3.633   2.586   5.335
  158    H    ARG  23           H        ARG  23  -4.782   1.018   1.130
  159    HA   ARG  23           HA       ARG  23  -4.904  -0.778  -1.193
  160    HB2  ARG  23           1HB      ARG  23  -7.042  -0.510   0.929
  161    HB3  ARG  23           2HB      ARG  23  -7.182  -1.452  -0.550
  162    HG2  ARG  23           1HG      ARG  23  -5.073  -2.677   0.325
  163    HG3  ARG  23           2HG      ARG  23  -5.536  -1.988   1.882
  164    HD2  ARG  23           1HD      ARG  23  -7.406  -3.588   0.147
  165    HD3  ARG  23           2HD      ARG  23  -6.412  -4.299   1.418
  166    HE   ARG  23           HE       ARG  23  -8.160  -2.104   2.188
  167   HH11  ARG  23          2HH1      ARG  23  -7.598  -5.538   2.062
  168   HH12  ARG  23          1HH1      ARG  23  -8.759  -5.905   3.294
  169   HH21  ARG  23          2HH2      ARG  23  -9.692  -2.575   3.812
  170   HH22  ARG  23          1HH2      ARG  23  -9.950  -4.219   4.288
  171    H    GLU  24           H        GLU  24  -4.602   1.145  -2.442
  172    HA   GLU  24           HA       GLU  24  -6.523   3.280  -2.281
  173    HB2  GLU  24           1HB      GLU  24  -4.135   2.665  -3.947
  174    HB3  GLU  24           2HB      GLU  24  -5.320   3.781  -4.609
  175    HG2  GLU  24           1HG      GLU  24  -4.285   4.189  -1.842
  176    HG3  GLU  24           2HG      GLU  24  -3.312   4.675  -3.229
  177    H    MET  25           H        MET  25  -8.011   3.874  -3.931
  178    HA   MET  25           HA       MET  25  -9.371   1.613  -5.075
  179    HB2  MET  25           1HB      MET  25  -9.917   4.581  -5.163
  180    HB3  MET  25           2HB      MET  25 -10.949   3.385  -5.936
  181    HG2  MET  25           1HG      MET  25 -10.332   3.532  -2.994
  182    HG3  MET  25           2HG      MET  25 -11.817   4.082  -3.766
  183    HE1  MET  25           1HE      MET  25 -10.765   1.567  -1.473
  184    HE2  MET  25           2HE      MET  25 -12.349   2.343  -1.453
  185    HE3  MET  25           3HE      MET  25 -12.226   0.590  -1.617
  186    H    MET  26           H        MET  26  -7.486   4.344  -6.280
  187    HA   MET  26           HA       MET  26  -7.713   3.279  -9.006
  188    HB2  MET  26           1HB      MET  26  -6.912   5.436  -9.770
  189    HB3  MET  26           2HB      MET  26  -8.268   5.666  -8.675
  190    HG2  MET  26           1HG      MET  26  -6.937   6.520  -6.991
  191    HG3  MET  26           2HG      MET  26  -5.472   5.785  -7.639
  192    HE1  MET  26           1HE      MET  26  -6.563   9.917  -7.754
  193    HE2  MET  26           2HE      MET  26  -7.972   9.126  -8.461
  194    HE3  MET  26           3HE      MET  26  -7.330   8.568  -6.916
  195    H    LYS  27           H        LYS  27  -5.865   2.897 -10.269
  196    HA   LYS  27           HA       LYS  27  -3.631   1.865  -8.811
  197    HB2  LYS  27           1HB      LYS  27  -4.363   0.727 -10.811
  198    HB3  LYS  27           2HB      LYS  27  -4.135   2.181 -11.774
  199    HG2  LYS  27           1HG      LYS  27  -1.756   2.058 -11.506
  200    HG3  LYS  27           2HG      LYS  27  -1.911   0.718 -10.368
  201    HD2  LYS  27           1HD      LYS  27  -1.319  -0.270 -12.423
  202    HD3  LYS  27           2HD      LYS  27  -3.054  -0.551 -12.252
  203    HE2  LYS  27           1HE      LYS  27  -2.696   0.142 -14.490
  204    HE3  LYS  27           2HE      LYS  27  -3.411   1.515 -13.646
  205    HZ1  LYS  27           1HZ      LYS  27  -0.827   1.267 -14.880
  206    HZ2  LYS  27           2HZ      LYS  27  -0.754   1.909 -13.317
  207    HZ3  LYS  27           3HZ      LYS  27  -1.712   2.657 -14.494
  208    H    LEU  28           H        LEU  28  -1.903   2.950  -8.160
  209    HA   LEU  28           HA       LEU  28  -1.114   5.369  -9.646
  210    HB2  LEU  28           1HB      LEU  28  -1.022   4.897  -6.671
  211    HB3  LEU  28           2HB      LEU  28  -0.312   6.288  -7.488
  212    HG   LEU  28           HG       LEU  28  -3.228   5.735  -7.815
  213   HD11  LEU  28          1HD1      LEU  28  -1.867   6.497  -5.317
  214   HD12  LEU  28          2HD1      LEU  28  -3.444   5.751  -5.573
  215   HD13  LEU  28          3HD1      LEU  28  -3.249   7.492  -5.777
  216   HD21  LEU  28          1HD2      LEU  28  -3.365   8.048  -8.223
  217   HD22  LEU  28          2HD2      LEU  28  -1.915   7.511  -9.071
  218   HD23  LEU  28          3HD2      LEU  28  -1.774   8.349  -7.525
  219    H    THR  29           H        THR  29   0.565   4.587 -10.811
  220    HA   THR  29           HA       THR  29   2.661   3.090  -9.397
  221    HB   THR  29           HB       THR  29   2.346   3.431 -12.383
  222    HG1  THR  29           1HG      THR  29   0.636   2.211 -11.160
  223   HG21  THR  29          1HG2      THR  29   3.706   1.086 -11.857
  224   HG22  THR  29          2HG2      THR  29   4.352   2.210 -10.660
  225   HG23  THR  29          3HG2      THR  29   4.429   2.608 -12.376
  226    H    CYS  30           H        CYS  30   4.752   3.803  -9.319
  227    HA   CYS  30           HA       CYS  30   5.253   6.550  -9.378
  228    HB2  CYS  30           1HB      CYS  30   6.545   4.643  -8.192
  229    HB3  CYS  30           2HB      CYS  30   7.438   4.510  -9.704
  230    H    GLU  31           H        GLU  31   7.105   7.538 -10.684
  231    HA   GLU  31           HA       GLU  31   6.674   6.875 -13.519
  232    HB2  GLU  31           1HB      GLU  31   7.268   9.200 -14.007
  233    HB3  GLU  31           2HB      GLU  31   5.915   9.112 -12.888
  234    HG2  GLU  31           1HG      GLU  31   7.237   9.768 -11.065
  235    HG3  GLU  31           2HG      GLU  31   8.737   9.473 -11.943
  236    H    ARG  32           H        ARG  32   8.963   6.846 -11.033
  237    HA   ARG  32           HA       ARG  32  11.224   6.921 -12.900
  238    HB2  ARG  32           1HB      ARG  32  11.154   6.960  -9.878
  239    HB3  ARG  32           2HB      ARG  32  12.622   6.983 -10.845
  240    HG2  ARG  32           1HG      ARG  32  12.097   9.125 -11.737
  241    HG3  ARG  32           2HG      ARG  32  10.476   9.078 -11.042
  242    HD2  ARG  32           1HD      ARG  32  11.341   9.244  -8.826
  243    HD3  ARG  32           2HD      ARG  32  12.993   9.005  -9.392
  244    HE   ARG  32           HE       ARG  32  11.452  11.453  -9.483
  245   HH11  ARG  32          2HH1      ARG  32  14.239   9.713 -10.635
  246   HH12  ARG  32          1HH1      ARG  32  15.101  11.141 -11.101
  247   HH21  ARG  32          2HH2      ARG  32  12.577  13.342 -10.093
  248   HH22  ARG  32          1HH2      ARG  32  14.155  13.205 -10.792
  249    H    CYS  33           H        CYS  33  10.037   4.949 -10.176
  250    HA   CYS  33           HA       CYS  33  11.659   2.704 -11.064
  251    HB2  CYS  33           1HB      CYS  33  10.772   1.592  -9.015
  252    HB3  CYS  33           2HB      CYS  33  11.601   3.110  -8.685
  253    H    SER  34           H        SER  34   8.402   3.825 -11.250
  254    HA   SER  34           HA       SER  34   6.574   3.029 -12.351
  255    HB2  SER  34           1HB      SER  34   8.333   2.401 -14.076
  256    HB3  SER  34           2HB      SER  34   8.309   0.781 -13.381
  257    HG   SER  34           HG       SER  34   6.530   0.408 -14.422
  258    H    ARG  35           H        ARG  35   6.742   2.396  -9.729
  259    HA   ARG  35           HA       ARG  35   5.720  -0.366  -9.631
  260    HB2  ARG  35           1HB      ARG  35   7.388   1.146  -7.628
  261    HB3  ARG  35           2HB      ARG  35   6.453  -0.275  -7.180
  262    HG2  ARG  35           1HG      ARG  35   7.690  -1.561  -8.908
  263    HG3  ARG  35           2HG      ARG  35   8.696  -0.138  -9.181
  264    HD2  ARG  35           1HD      ARG  35   9.243  -0.205  -6.718
  265    HD3  ARG  35           2HD      ARG  35   8.455  -1.781  -6.671
  266    HE   ARG  35           HE       ARG  35  10.230  -2.123  -8.640
  267   HH11  ARG  35          2HH1      ARG  35  10.558  -0.774  -5.448
  268   HH12  ARG  35          1HH1      ARG  35  12.212  -1.259  -5.271
  269   HH21  ARG  35          2HH2      ARG  35  12.408  -2.766  -8.420
  270   HH22  ARG  35          1HH2      ARG  35  13.264  -2.391  -6.963
  271    H    ASN  36           H        ASN  36   3.960  -0.773  -8.235
  272    HA   ASN  36           HA       ASN  36   2.066   1.349  -8.102
  273    HB2  ASN  36           1HB      ASN  36   1.471  -1.051  -8.457
  274    HB3  ASN  36           2HB      ASN  36   1.916  -1.369  -6.783
  275   HD21  ASN  36          1HD2      ASN  36  -0.596  -0.752  -8.796
  276   HD22  ASN  36          2HD2      ASN  36  -1.743  -0.146  -7.654
  277    H    PHE  37           H        PHE  37   1.279   2.471  -6.353
  278    HA   PHE  37           HA       PHE  37   2.191   1.920  -3.679
  279    HB2  PHE  37           1HB      PHE  37   3.064   4.479  -5.037
  280    HB3  PHE  37           2HB      PHE  37   3.299   4.086  -3.337
  281    HD1  PHE  37           2HD      PHE  37   4.532   1.754  -2.952
  282    HD2  PHE  37           1HD      PHE  37   4.832   4.155  -6.454
  283    HE1  PHE  37           2HE      PHE  37   6.682   0.688  -3.494
  284    HE2  PHE  37           1HE      PHE  37   6.982   3.092  -7.002
  285    HZ   PHE  37           HZ       PHE  37   7.910   1.357  -5.521
  286    H    CYS  38           H        CYS  38   1.419   3.764  -2.170
  287    HA   CYS  38           HA       CYS  38  -1.324   4.410  -2.973
  288    HB2  CYS  38           1HB      CYS  38  -1.786   4.674  -0.597
  289    HB3  CYS  38           2HB      CYS  38  -1.010   3.121  -0.889
  290    H    ILE  39           H        ILE  39  -2.216   6.489  -2.552
  291    HA   ILE  39           HA       ILE  39  -0.973   8.657  -3.513
  292    HB   ILE  39           HB       ILE  39  -3.020   8.482  -1.326
  293   HG12  ILE  39          1HG1      ILE  39  -3.134   9.580  -4.144
  294   HG13  ILE  39          2HG1      ILE  39  -3.625   7.954  -3.682
  295   HG21  ILE  39          1HG2      ILE  39  -1.712  10.477  -0.839
  296   HG22  ILE  39          2HG2      ILE  39  -1.905  11.025  -2.503
  297   HG23  ILE  39          3HG2      ILE  39  -3.310  10.911  -1.444
  298   HD11  ILE  39          1HD1      ILE  39  -5.514   9.508  -3.938
  299   HD12  ILE  39          2HD1      ILE  39  -5.395   8.834  -2.312
  300   HD13  ILE  39          3HD1      ILE  39  -4.859  10.485  -2.623
  301    H    LYS  40           H        LYS  40  -0.617   7.423  -0.242
  302    HA   LYS  40           HA       LYS  40   0.839   9.621   0.797
  303    HB2  LYS  40           1HB      LYS  40   0.430   6.773   1.628
  304    HB3  LYS  40           2HB      LYS  40   1.659   7.740   2.434
  305    HG2  LYS  40           1HG      LYS  40  -0.105   8.136   3.810
  306    HG3  LYS  40           2HG      LYS  40  -0.333   9.455   2.659
  307    HD2  LYS  40           1HD      LYS  40  -2.450   8.375   3.038
  308    HD3  LYS  40           2HD      LYS  40  -1.910   8.010   1.397
  309    HE2  LYS  40           1HE      LYS  40  -1.537   5.807   1.865
  310    HE3  LYS  40           2HE      LYS  40  -1.157   6.117   3.558
  311    HZ1  LYS  40           1HZ      LYS  40  -3.425   6.309   4.088
  312    HZ2  LYS  40           2HZ      LYS  40  -3.312   4.936   3.106
  313    HZ3  LYS  40           3HZ      LYS  40  -3.896   6.389   2.465
  314    H    HIS  41           H        HIS  41   1.820   6.563  -0.696
  315    HA   HIS  41           HA       HIS  41   4.598   7.532  -0.733
  316    HB2  HIS  41           1HB      HIS  41   3.536   4.717  -1.057
  317    HB3  HIS  41           2HB      HIS  41   5.235   5.175  -1.107
  318    HD2  HIS  41           2HD      HIS  41   4.911   7.184   1.634
  319    HE1  HIS  41           1HE      HIS  41   4.144   3.447   3.489
  320    HE2  HIS  41           2HE      HIS  41   4.691   5.878   3.856
  321    H    ARG  42           H        ARG  42   2.169   7.970  -2.608
  322    HA   ARG  42           HA       ARG  42   2.752   6.757  -5.080
  323    HB2  ARG  42           1HB      ARG  42   0.639   7.667  -5.060
  324    HB3  ARG  42           2HB      ARG  42   1.152   9.109  -4.194
  325    HG2  ARG  42           1HG      ARG  42   0.486   9.657  -6.457
  326    HG3  ARG  42           2HG      ARG  42   2.211   9.954  -6.229
  327    HD2  ARG  42           1HD      ARG  42   2.364   7.458  -7.120
  328    HD3  ARG  42           2HD      ARG  42   0.829   7.899  -7.867
  329    HE   ARG  42           HE       ARG  42   3.455   8.993  -8.485
  330   HH11  ARG  42          2HH1      ARG  42   0.006   9.128  -8.938
  331   HH12  ARG  42          1HH1      ARG  42   0.103  10.053 -10.400
  332   HH21  ARG  42          2HH2      ARG  42   3.596  10.210 -10.409
  333   HH22  ARG  42          1HH2      ARG  42   2.146  10.667 -11.236
  334    H    HIS  43           H        HIS  43   4.234   9.361  -3.394
  335    HA   HIS  43           HA       HIS  43   5.602  10.311  -5.801
  336    HB2  HIS  43           1HB      HIS  43   4.568  11.755  -3.803
  337    HB3  HIS  43           2HB      HIS  43   6.175  11.495  -3.132
  338    HD1  HIS  43           1HD      HIS  43   8.120  12.749  -4.204
  339    HD2  HIS  43           2HD      HIS  43   4.498  13.340  -6.151
  340    HE1  HIS  43           1HE      HIS  43   8.521  14.641  -5.810
  341    HA   PRO  44           HA       PRO  44   9.233   7.971  -4.945
  342    HB2  PRO  44           1HB      PRO  44  11.031   9.467  -6.323
  343    HB3  PRO  44           2HB      PRO  44   9.847   8.418  -7.113
  344    HG2  PRO  44           1HG      PRO  44   9.757  11.377  -6.667
  345    HG3  PRO  44           2HG      PRO  44   9.320  10.450  -8.114
  346    HD2  PRO  44           1HD      PRO  44   7.471  11.386  -6.371
  347    HD3  PRO  44           2HD      PRO  44   7.252   9.873  -7.275
  348    H    LEU  45           H        LEU  45   8.498  10.789  -3.485
  349    HA   LEU  45           HA       LEU  45  11.145  11.174  -2.277
  350    HB2  LEU  45           1HB      LEU  45   8.680  12.881  -2.403
  351    HB3  LEU  45           2HB      LEU  45   9.981  13.215  -1.262
  352    HG   LEU  45           HG       LEU  45  10.315  13.136  -4.259
  353   HD11  LEU  45          1HD1      LEU  45   8.854  14.996  -3.123
  354   HD12  LEU  45          2HD1      LEU  45  10.039  15.406  -4.363
  355   HD13  LEU  45          3HD1      LEU  45  10.427  15.644  -2.659
  356   HD21  LEU  45          1HD2      LEU  45  12.129  13.657  -1.950
  357   HD22  LEU  45          2HD2      LEU  45  12.394  14.517  -3.467
  358   HD23  LEU  45          3HD2      LEU  45  12.426  12.754  -3.435
  359    H    ASP  46           H        ASP  46   7.956  10.020  -1.642
  360    HA   ASP  46           HA       ASP  46   8.512   9.870   1.238
  361    HB2  ASP  46           1HB      ASP  46   5.996   9.858  -0.386
  362    HB3  ASP  46           2HB      ASP  46   6.000   9.090   1.200
  363    H    HIS  47           H        HIS  47   9.609   8.120  -0.947
  364    HA   HIS  47           HA       HIS  47   9.369   5.645   0.448
  365    HB2  HIS  47           1HB      HIS  47   8.148   4.340  -1.034
  366    HB3  HIS  47           2HB      HIS  47   7.263   5.862  -1.082
  367    HD1  HIS  47           1HD      HIS  47   6.769   6.681  -3.357
  368    HD2  HIS  47           2HD      HIS  47  10.116   4.221  -3.299
  369    HE1  HIS  47           1HE      HIS  47   7.481   6.458  -5.758
  370    H    ASP  48           H        ASP  48  11.237   4.596   0.242
  371    HA   ASP  48           HA       ASP  48  13.432   5.545  -1.094
  372    HB2  ASP  48           1HB      ASP  48  14.195   3.040  -1.003
  373    HB3  ASP  48           2HB      ASP  48  13.944   3.937   0.492
  374    H    CYS  49           H        CYS  49  13.013   6.172  -3.199
  375    HA   CYS  49           HA       CYS  49  12.044   4.224  -5.119
  376    HB2  CYS  49           1HB      CYS  49  11.377   6.657  -5.155
  377    HB3  CYS  49           2HB      CYS  49  13.023   7.032  -5.655
  378    H    SER  50           H        SER  50  13.286   2.989  -6.366
  379    HA   SER  50           HA       SER  50  16.182   3.437  -6.321
  380    HB2  SER  50           1HB      SER  50  14.970   1.179  -5.736
  381    HB3  SER  50           2HB      SER  50  14.917   0.983  -7.487
  382    HG   SER  50           HG       SER  50  16.890   0.334  -5.999
  383    H    GLY  51           H        GLY  51  13.604   2.582  -8.632
  384    HA2  GLY  51           1HA      GLY  51  13.413   3.836 -10.701
  385    HA3  GLY  51           2HA      GLY  51  15.165   3.978 -10.711
  386    H    GLU  52           H        GLU  52  12.924   2.710 -12.482
  387    HA   GLU  52           HA       GLU  52  13.828  -0.035 -12.656
  388    HB2  GLU  52           1HB      GLU  52  11.482   0.388 -13.030
  389    HB3  GLU  52           2HB      GLU  52  11.849   1.557 -14.290
  390    HG2  GLU  52           1HG      GLU  52  11.112  -0.485 -15.298
  391    HG3  GLU  52           2HG      GLU  52  12.825  -0.256 -15.645
  392    H    GLY  53           H        GLY  53  15.122  -0.910 -14.208
  393    HA2  GLY  53           1HA      GLY  53  16.234   0.954 -16.213
  394    HA3  GLY  53           2HA      GLY  53  17.260  -0.139 -15.296
  395    H    HIS  54           H        HIS  54  15.462   0.274 -18.113
  396    HA   HIS  54           HA       HIS  54  14.612  -2.292 -18.755
  397    HB2  HIS  54           1HB      HIS  54  15.569   0.003 -20.452
  398    HB3  HIS  54           2HB      HIS  54  15.050  -1.518 -21.173
  399    HD1  HIS  54           1HD      HIS  54  12.587  -1.847 -21.482
  400    HD2  HIS  54           2HD      HIS  54  13.462   1.359 -18.989
  401    HE1  HIS  54           1HE      HIS  54  10.390  -0.694 -21.072
  402    HA   PRO  55           HA       PRO  55  18.301  -4.641 -19.245
  403    HB2  PRO  55           1HB      PRO  55  17.368  -6.569 -20.912
  404    HB3  PRO  55           2HB      PRO  55  16.947  -6.496 -19.197
  405    HG2  PRO  55           1HG      PRO  55  15.377  -5.574 -21.573
  406    HG3  PRO  55           2HG      PRO  55  14.821  -6.455 -20.138
  407    HD2  PRO  55           1HD      PRO  55  14.474  -3.786 -20.435
  408    HD3  PRO  55           2HD      PRO  55  14.722  -4.546 -18.850
  409    H    THR  56           H        THR  56  19.931  -5.159 -20.759
  410    HA   THR  56           HA       THR  56  20.603  -3.352 -22.652
  411    HB   THR  56           HB       THR  56  21.941  -5.176 -23.786
  412    HG1  THR  56           1HG      THR  56  20.587  -6.719 -21.816
  413   HG21  THR  56          1HG2      THR  56  23.472  -4.588 -22.279
  414   HG22  THR  56          2HG2      THR  56  22.767  -5.713 -21.117
  415   HG23  THR  56          3HG2      THR  56  22.195  -4.046 -21.191
  416    H    SER  57           H        SER  57  19.661  -2.648 -24.441
  417    HA   SER  57           HA       SER  57  17.414  -3.689 -25.642
  418    HB2  SER  57           1HB      SER  57  18.091  -2.326 -27.656
  419    HB3  SER  57           2HB      SER  57  18.085  -1.439 -26.133
  420    HG   SER  57           HG       SER  57  20.363  -2.562 -27.404
  421    H    SER  58           H        SER  58  17.041  -5.484 -26.742
  422    HA   SER  58           HA       SER  58  18.925  -6.456 -28.706
  423    HB2  SER  58           1HB      SER  58  19.735  -7.483 -26.591
  424    HB3  SER  58           2HB      SER  58  18.154  -8.235 -26.380
  425    HG   SER  58           HG       SER  58  18.595  -9.140 -28.574
  426    H    GLY  59           H        GLY  59  17.794  -7.095 -30.414
  427    HA2  GLY  59           1HA      GLY  59  14.951  -7.313 -30.321
  428    HA3  GLY  59           2HA      GLY  59  15.971  -7.629 -31.717
  429    HA   PRO  60           HA       PRO  60  14.188 -11.593 -29.792
  430    HB2  PRO  60           1HB      PRO  60  12.340 -12.145 -31.702
  431    HB3  PRO  60           2HB      PRO  60  11.977 -11.184 -30.264
  432    HG2  PRO  60           1HG      PRO  60  12.604 -10.269 -33.044
  433    HG3  PRO  60           2HG      PRO  60  11.364  -9.676 -31.925
  434    HD2  PRO  60           1HD      PRO  60  13.716  -8.391 -32.306
  435    HD3  PRO  60           2HD      PRO  60  12.865  -8.382 -30.748
  436    H    SER  61           H        SER  61  15.933 -10.518 -32.350
  437    HA   SER  61           HA       SER  61  17.183 -11.474 -33.999
  438    HB2  SER  61           1HB      SER  61  18.266 -13.576 -33.423
  439    HB3  SER  61           2HB      SER  61  18.164 -12.556 -31.989
  440    HG   SER  61           HG       SER  61  17.220 -15.014 -32.326
  441    H    SER  62           H        SER  62  14.446 -11.504 -34.528
  442    HA   SER  62           HA       SER  62  14.145 -14.049 -35.986
  443    HB2  SER  62           1HB      SER  62  11.705 -13.764 -35.790
  444    HB3  SER  62           2HB      SER  62  12.470 -13.847 -34.204
  445    HG   SER  62           HG       SER  62  12.428 -11.306 -34.933
  446    H    GLY  63           H        GLY  63  13.449 -13.974 -38.109
  447    HA2  GLY  63           1HA      GLY  63  13.587 -11.301 -39.345
  448    HA3  GLY  63           2HA      GLY  63  13.987 -12.809 -40.155