*HEADER    METAL BINDING PROTEIN                   17-MAY-05   2CO8              
*TITLE     SOLUTION STRUCTURES OF THE LIM DOMAIN OF HUMAN NEDD9                  
*TITLE    2 INTERACTING PROTEIN WITH CALPONIN HOMOLOGY AND LIM DOMAINS           
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: NEDD9 INTERACTING PROTEIN WITH CALPONIN HOMOLOGY           
*COMPND   3 AND LIM DOMAINS;                                                     
*COMPND   4 CHAIN: A;                                                            
*COMPND   5 FRAGMENT: LIM DOMAIN;                                                
*COMPND   6 SYNONYM: MOLECULE INTERACTING WITH CASL PROTEIN 1;                   
*COMPND   7 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: NICAL;                                                         
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   7 EXPRESSION_SYSTEM_PLASMID: P040614-06;                               
*SOURCE   8 OTHER_DETAILS: CELL-FREE PROTEIN SYNTHESIS                           
*KEYWDS    LIM DOMAIN, ZINC FINGER PROTEIN, STRUCTURAL GENOMICS,                 
*KEYWDS   2 NPPSFA, NATIONAL PROJECT ON PROTEIN STRUCTURAL AND                   
*KEYWDS   3 FUNCTIONAL ANALYSES, RIKEN STRUCTURAL GENOMICS/PROTEOMICS            
*KEYWDS   4 INITIATIVE, RSGI, METAL BINDING PROTEIN                              
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    M.SATO, T.TOMIZAWA, K.SAITO, S.KOSHIBA, M.INOUE, T.KIGAWA,            
*AUTHOR   2 S.YOKOYAMA, RIKEN STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE          
*AUTHOR   3 (RSGI)                                                               
*REVDAT   1   12-MAY-09 2CO8    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.
**************************************************************

  18  CYSS CHI1 150.0 210.0
  21  CYSS CHI1 30.0 90.0
  39  HIST CHI1 -90.0 -30.0
  42  CYSS CHI1 -90.0 -30.0

  45  CYSS CHI1 150.0 210.0
  48  CYSS CHI1 30.0 90.0
  68  CYSS CHI1 30.0 90.0
  71  HIST CHI1 -90.0 -30.0

  31  LEU   PHI  -143.0  -83.0
  31  LEU   PSI   94.0  154.0
  32  CYS   PHI  -128.0  -68.0
  32  CYS   PSI   91.0  151.0
  33  VAL   PHI  -133.0  -73.0
  33  VAL   PSI   87.0  147.0

  36  HIS   PHI  -134.0  -74.0
  36  HIS   PSI  126.0  186.0
  37  PHE   PHI  -143.0  -83.0
  37  PHE   PSI  122.0  182.0
  38  PHE   PHI  -147.0  -87.0
  38  PHE   PSI  129.0  189.0

  57  TYR   PHI  -158.0  -98.0
  57  TYR   PSI  126.0  186.0
  58  GLU   PHI  -161.0  -101.0
  58  GLU   PSI  106.0  166.0
  59  GLN   PHI  -134.0  -74.0
  59  GLN   PSI   89.0  149.0

  66  PHE   PHI  -151.0  -91.0
  66  PHE   PSI  120.0  180.0
  67  TYR   PHI  -150.0  -90.0
  67  TYR   PSI  114.0  174.0
  68  CYSS  PHI  -126.0  -66.0
  68  CYSS  PSI  127.0  187.0

18 CYSS SG   201 ZN   ZN   2.33  5.00E+00
21 CYSS SG   201 ZN   ZN   2.33  5.00E+00
39 HIST ND1  201 ZN   ZN   2.33  5.00E+00
42 CYSS SG   201 ZN   ZN   2.33  5.00E+00

18 CYSS CB   201 ZN   ZN   3.25  5.00E+00
21 CYSS CB   201 ZN   ZN   3.25  5.00E+00
42 CYSS CB   201 ZN   ZN   3.25  5.00E+00

18 CYSS SG   21  CYSS SG   3.20  5.00E+00
18 CYSS SG   39  HIST ND1  3.20  5.00E+00
18 CYSS SG   42  CYSS SG   3.20  5.00E+00
21 CYSS SG   39  HIST ND1  3.20  5.00E+00
21 CYSS SG   42  CYSS SG   3.20  5.00E+00
39 HIST ND1  42  CYSS SG   3.20  5.00E+00

45 CYSS SG   401 ZN   ZN   2.33  5.00E+00
48 CYSS SG   401 ZN   ZN   2.33  5.00E+00
68 CYSS SG   401 ZN   ZN   2.33  5.00E+00
71 HIST ND1  401 ZN   ZN   2.33  5.00E+00

45 CYSS CB   401 ZN   ZN   3.25  5.00E+00
48 CYSS CB   401 ZN   ZN   3.25  5.00E+00
68 CYSS CB   401 ZN   ZN   3.25  5.00E+00

45 CYSS SG   48  CYSS SG   3.20  5.00E+00
45 CYSS SG   68  CYSS SG   3.20  5.00E+00
45 CYSS SG   71  HIST ND1  3.20  5.00E+00
48 CYSS SG   68  CYSS SG   3.20  5.00E+00
48 CYSS SG   71  HIST ND1  3.20  5.00E+00
68 CYSS SG   71  HIST ND1  3.20  5.00E+00
18 CYSS SG   201 ZN   ZN   2.37  5.00E+00
21 CYSS SG   201 ZN   ZN   2.37  5.00E+00
39 HIST ND1  201 ZN   ZN   2.37  5.00E+00
42 CYSS SG   201 ZN   ZN   2.37  5.00E+00

18 CYSS CB   201 ZN   ZN   3.51  5.00E+00
21 CYSS CB   201 ZN   ZN   3.51  5.00E+00
42 CYSS CB   201 ZN   ZN   3.51  5.00E+00

18 CYSS SG   21  CYSS SG   4.00  5.00E+00
18 CYSS SG   39  HIST ND1  4.00  5.00E+00
18 CYSS SG   42  CYSS SG   4.00  5.00E+00
21 CYSS SG   39  HIST ND1  4.00  5.00E+00
21 CYSS SG   42  CYSS SG   4.00  5.00E+00
39 HIST ND1  42  CYSS SG   4.00  5.00E+00

45 CYSS SG   401 ZN   ZN   2.37  5.00E+00
48 CYSS SG   401 ZN   ZN   2.37  5.00E+00
68 CYSS SG   401 ZN   ZN   2.37  5.00E+00
71 HIST ND1  401 ZN   ZN   2.37  5.00E+00

45 CYSS CB   401 ZN   ZN   3.51  5.00E+00
48 CYSS CB   401 ZN   ZN   3.51  5.00E+00
68 CYSS CB   401 ZN   ZN   3.51  5.00E+00

45 CYSS SG   48  CYSS SG   4.00  5.00E+00
45 CYSS SG   68  CYSS SG   4.00  5.00E+00
45 CYSS SG   71  HIST ND1  4.00  5.00E+00
48 CYSS SG   68  CYSS SG   4.00  5.00E+00
48 CYSS SG   71  HIST ND1  4.00  5.00E+00
68 CYSS SG   71  HIST ND1  4.00  5.00E+00
 19 ALA  HN     37 PHE  HN      5.12 #SUP  0.99  #QF  0.99
 19 ALA  HN     25 LEU  QD1     4.60 #SUP  0.90  #QF  0.90
 19 ALA  HN     38 PHE  HZ      5.50 #SUP  0.49  #QF  0.49
 19 ALA  HN     38 PHE  QE      4.82 #SUP  0.99  #QF  0.99
 19 ALA  HN     38 PHE  QD      4.44 #SUP  0.90  #QF  0.90
 19 ALA  HN     38 PHE  HA      3.71 #SUP  0.95  #QF  0.95
 18 CYSS HA     19 ALA  HN      2.87 #SUP  0.89  #QF  0.89
 18 CYSS HB3    19 ALA  HN      4.53 #SUP  0.97  #QF  0.97
 19 ALA  HN     38 PHE  HB3     5.00 #SUP  0.78  #QF  0.78
 18 CYSS HB2    19 ALA  HN      4.36 #SUP  0.94  #QF  0.94
 19 ALA  HN     19 ALA  QB      2.95 #SUP  0.95  #QF  0.95
 60 HIS  HN     67 TYR  HN      4.60 #SUP  0.99  #QF  0.99
 60 HIS  HN     64 GLY  HN      5.14 #SUP  0.98  #QF  0.98
 60 HIS  HN     67 TYR  QD      3.52 #SUP  0.97  #QF  0.97
 60 HIS  HN     60 HIS  HB3     3.41 #SUP  0.96  #QF  0.96
 60 HIS  HN     61 PRO  HD3     4.91 #SUP  0.98  #QF  0.98
 60 HIS  HN     61 PRO  HD2     4.94 #SUP  1.00
 60 HIS  HN     60 HIS  HB2     3.43 #SUP  0.97  #QF  0.97
 60 HIS  HN     65 HIS  HB2     5.34 #SUP  0.54  #QF  0.54
 59 GLN  HB2    60 HIS  HN      4.55 #SUP  0.86  #QF  0.86
 59 GLN  HB3    60 HIS  HN      4.55 #SUP  0.97  #QF  0.97
 60 HIS  HN     72 LEU  QD1     3.73 #SUP  0.92  #QF  0.92
 60 HIS  HN     73 PRO  HD2     5.07 #SUP  0.94  #QF  0.94
 72 LEU  QD2    74 GLN  HE21    5.22 #SUP  0.51  #QF  0.51
 72 LEU  QD2    74 GLN  HE22    5.22 #SUP  0.51  #QF  0.51
 19 ALA  HN     22 GLY  HN      5.19 #SUP  0.96  #QF  0.96
 22 GLY  HN     39 HIST HE1     4.97 #SUP  0.90  #QF  0.90
 17 LEU  HB2    22 GLY  HN      5.50 #SUP  0.55  #QF  0.55
 20 LEU  HN     22 GLY  HN      4.47 #SUP  1.00
 18 CYSS HB3    22 GLY  HN      3.64 #SUP  0.75  #QF  0.75
 21 CYSS HB3    22 GLY  HN      4.43 #SUP  0.95  #QF  0.95
 18 CYSS HB2    22 GLY  HN      4.30 #SUP  0.97  #QF  0.97
 20 LEU  HB3    22 GLY  HN      5.27 #SUP  0.95  #QF  0.95
 17 LEU  HB3    22 GLY  HN      5.11 #SUP  0.91  #QF  0.91
 20 LEU  HB2    22 GLY  HN      4.80 #SUP  0.88  #QF  0.88
 33 VAL  QG1    34 ASN  HD21    4.82 #SUP  0.63  #QF  0.63
 33 VAL  QG1    34 ASN  HD22    4.82 #SUP  0.85  #QF  0.85
 46 HIS  HN     67 TYR  HN      5.50 #SUP  0.95  #QF  0.95
 46 HIS  HN     68 CYSS HN      4.52 #SUP  1.00
 46 HIS  HN     47 THR  HN      3.80 #SUP  1.00
 46 HIS  HN     67 TYR  QD      4.33 #SUP  1.00
 46 HIS  HN     67 TYR  HA      3.69 #SUP  0.97  #QF  0.97
 45 CYSS HA     46 HIS  HN      3.22 #SUP  0.94  #QF  0.94
 46 HIS  HN     47 THR  HB      5.15 #SUP  0.96  #QF  0.84
 46 HIS  HN     49 GLU  HA      5.50 #SUP  0.96  #QF  0.84
 45 CYSS HB3    46 HIS  HN      4.74 #SUP  0.98  #QF  0.98
 46 HIS  HN     67 TYR  HB3     4.87 #SUP  0.92  #QF  0.92
 46 HIS  HN     46 HIS  HB2     3.32 #SUP  0.88  #QF  0.88
 46 HIS  HN     46 HIS  HB3     3.44 #SUP  0.96  #QF  0.96
 46 HIS  HN     52 LEU  QD2     4.73 #SUP  0.94  #QF  0.94
 46 HIS  HN     46 HIS  HD2     4.92 #SUP  0.95  #QF  0.95
 51 THR  HB     53 TRP  HE1     4.12 #SUP  0.90  #QF  0.90
 53 TRP  HB2    53 TRP  HE1     5.15 #SUP  0.84  #QF  0.84
 51 THR  QG2    53 TRP  HE1     4.79 #SUP  0.95  #QF  0.95
 59 GLN  HB2    59 GLN  HE21    5.00 #SUP  0.95  #QF  0.95
 59 GLN  HB3    59 GLN  HE21    5.00 #SUP  0.81  #QF  0.81
 59 GLN  HE21   64 GLY  HN      5.14 #SUP  0.95  #QF  0.95
 59 GLN  HE22   64 GLY  HA2     4.99 #SUP  0.96  #QF  0.96
 59 GLN  HB2    59 GLN  HE22    5.24 #SUP  0.87  #QF  0.87
 59 GLN  HB3    59 GLN  HE22    5.24 #SUP  0.99  #QF  0.99
 33 VAL  HN     36 HIS  HA      5.09 #SUP  0.96  #QF  0.96
 33 VAL  HN     38 PHE  HN      4.89 #SUP  0.96  #QF  0.96
 32 CYS  HN     33 VAL  HN      4.56 #SUP  0.95  #QF  0.95
 33 VAL  HN     36 HIS  HN      3.86 #SUP  1.00
 33 VAL  HN     38 PHE  QE      4.34 #SUP  0.96  #QF  0.24
 33 VAL  HN     38 PHE  QD      4.77 #SUP  0.96  #QF  0.96
 33 VAL  HN     37 PHE  HA      4.00 #SUP  0.95  #QF  0.95
 32 CYS  HA     33 VAL  HN      2.98 #SUP  0.90  #QF  0.90
 33 VAL  HN     36 HIS  HB2     4.58 #SUP  0.93  #QF  0.93
 32 CYS  HB2    33 VAL  HN      4.54 #SUP  0.86  #QF  0.86
 32 CYS  HB3    33 VAL  HN      4.54 #SUP  0.81  #QF  0.81
 33 VAL  HN     33 VAL  HB      3.58 #SUP  0.80  #QF  0.80
 33 VAL  HN     33 VAL  QG1     4.06 #SUP  0.96  #QF  0.96
 33 VAL  HN     33 VAL  QG2     3.78 #SUP  0.93  #QF  0.93
 62 GLY  HN     64 GLY  HN      5.38 #SUP  0.66  #QF  0.40
 60 HIS  HB3    64 GLY  HN      4.02 #SUP  0.87  #QF  0.87
 60 HIS  HB2    64 GLY  HN      5.21 #SUP  0.99  #QF  0.99
 63 ASP  HB3    64 GLY  HN      4.98 #SUP  0.98  #QF  0.98
 63 ASP  HB2    64 GLY  HN      4.98 #SUP  0.97  #QF  0.97
 59 GLN  HG2    64 GLY  HN      5.50 #SUP  0.96  #QF  0.96
 59 GLN  HG3    64 GLY  HN      5.50 #SUP  0.57  #QF  0.57
 12 ALA  QB     13 GLY  HN      4.92 #SUP  0.94  #QF  0.92
 56 GLY  HN     57 TYR  QE      4.62 #SUP  0.93  #QF  0.93
 56 GLY  HN     69 LEU  QD1     5.02 #SUP  0.98  #QF  0.98
 56 GLY  HN     57 TYR  QD      3.97 #SUP  0.92  #QF  0.92
 56 GLY  HN     69 LEU  QD2     5.02 #SUP  0.84  #QF  0.84
 39 HIST HB3    40 ARG  HN      4.41 #SUP  0.97  #QF  0.97
 29 GLU  HB3    40 ARG  HN      4.68 #SUP  0.40  #QF  0.40
 40 ARG  HN     40 ARG  HB2     3.96 #SUP  0.83  #QF  0.83
 40 ARG  HN     40 ARG  HB3     3.96 #SUP  0.89  #QF  0.89
 40 ARG  HN     40 ARG  QG      3.98 #SUP  0.94  #QF  0.94
 39 HIST HA     40 ARG  HN      3.49 #SUP  0.89  #QF  0.89
 39 HIST HB2    40 ARG  HN      4.66 #SUP  0.86  #QF  0.86
 15 GLY  HN     16 ASP  HN      4.78 #SUP  0.95  #QF  0.95
 14 ALA  QB     15 GLY  HN      4.87 #SUP  0.96  #QF  0.96
 25 LEU  HN     26 TYR  HN      4.79 #SUP  0.99  #QF  0.99
 18 CYSS HN     25 LEU  HN      4.82 #SUP  0.88  #QF  0.88
 17 LEU  HA     25 LEU  HN      3.84 #SUP  0.90  #QF  0.90
 16 ASP  QB     25 LEU  HN      4.86 #SUP  0.94  #QF  0.94
 25 LEU  HN     25 LEU  HB2     3.74 #SUP  0.89  #QF  0.89
 24 HIS  HN     25 LEU  HN      4.73 #SUP  0.99  #QF  0.99
 25 LEU  HN     26 TYR  HA      5.18 #SUP  0.58  #QF  0.58
 25 LEU  HN     25 LEU  QD2     4.31 #SUP  0.95  #QF  0.95
 12 ALA  HN     12 ALA  QB      3.87 #SUP  0.89  #QF  0.89
 24 HIS  HA     25 LEU  HN      3.10 #SUP  0.90  #QF  0.90
 24 HIS  HB3    25 LEU  HN      4.49 #SUP  0.87  #QF  0.87
 25 LEU  HN     25 LEU  HB3     3.80 #SUP  0.94  #QF  0.94
 17 LEU  QD2    25 LEU  HN      4.13 #SUP  0.92  #QF  0.92
 25 LEU  HN     25 LEU  QD1     4.30 #SUP  0.88  #QF  0.88
 24 HIS  HB2    25 LEU  HN      4.49 #SUP  0.84  #QF  0.84
 51 THR  HB     52 LEU  HN      4.57 #SUP  0.94  #QF  0.94
 51 THR  HA     52 LEU  HN      3.29 #SUP  0.90  #QF  0.90
 43 PHE  HB3    52 LEU  HN      4.78 #SUP  0.29  #QF  0.29
 52 LEU  HN     52 LEU  HG      3.48 #SUP  0.97  #QF  0.92
 52 LEU  HN     52 LEU  HB2     3.65 #SUP  1.00
 31 LEU  HN     38 PHE  HN      3.83 #SUP  1.00
 30 ARG  HN     31 LEU  HN      4.71 #SUP  1.00
 31 LEU  HN     37 PHE  QD      5.02 #SUP  0.91  #QF  0.91
 31 LEU  HN     37 PHE  HA      4.67 #SUP  0.89  #QF  0.89
 30 ARG  HA     31 LEU  HN      3.00 #SUP  0.74  #QF  0.74
 31 LEU  HN     38 PHE  HB3     5.40 #SUP  0.80  #QF  0.80
 30 ARG  QD     31 LEU  HN      5.25 #SUP  0.98  #QF  0.95
 31 LEU  HN     37 PHE  HB2     5.50 #SUP  0.98  #QF  0.95
 31 LEU  HN     38 PHE  HB2     4.57 #SUP  0.82  #QF  0.82
 30 ARG  HB2    31 LEU  HN      3.55 #SUP  0.98  #QF  0.98
 31 LEU  HN     31 LEU  HB2     3.70 #SUP  0.99  #QF  0.99
 31 LEU  HN     31 LEU  HB3     3.70 #SUP  0.90  #QF  0.90
 31 LEU  HN     31 LEU  QD1     4.80 #SUP  0.90  #QF  0.90
 25 LEU  QD1    31 LEU  HN      4.38 #SUP  0.94  #QF  0.94
 25 LEU  QD2    31 LEU  HN      4.33 #SUP  0.96  #QF  0.96
 45 CYSS HB3    50 ALA  HN      3.27 #SUP  0.92  #QF  0.92
 45 CYSS HB2    50 ALA  HN      3.54 #SUP  0.92  #QF  0.92
 49 GLU  HB2    50 ALA  HN      4.54 #SUP  0.95  #QF  0.95
 50 ALA  HN     50 ALA  QB      2.83 #SUP  0.88  #QF  0.88
 50 ALA  HN     52 LEU  QD2     4.40 #SUP  0.92  #QF  0.92
 48 CYSS HN     50 ALA  HN      4.08 #SUP  0.99  #QF  0.99
 49 GLU  HN     50 ALA  HN      3.51 #SUP  1.00
 45 CYSS HA     50 ALA  HN      4.73 #SUP  0.90  #QF  0.90
 31 LEU  HN     32 CYS  HN      4.55 #SUP  0.90  #QF  0.90
 31 LEU  HA     32 CYS  HN      3.10 #SUP  0.89  #QF  0.89
 32 CYS  HN     32 CYS  HB2     3.79 #SUP  0.93  #QF  0.93
 32 CYS  HN     32 CYS  HB3     3.79 #SUP  0.96  #QF  0.96
 32 CYS  HN     33 VAL  QG2     4.79 #SUP  0.45  #QF  0.45
 49 GLU  HB3    50 ALA  HN      4.54 #SUP  0.79  #QF  0.79
 49 GLU  QG     50 ALA  HN      4.77 #SUP  0.98  #QF  0.98
 67 TYR  HA     72 LEU  HN      5.50 #SUP  0.85  #QF  0.85
 68 CYSS HB3    72 LEU  HN      5.50 #SUP  0.83  #QF  0.83
 59 GLN  HN     66 PHE  QD      4.36 #SUP  0.99  #QF  0.99
 59 GLN  HN     66 PHE  HA      4.89 #SUP  0.78  #QF  0.78
 57 TYR  QE     59 GLN  HN      5.04 #SUP  0.93  #QF  0.93
 58 GLU  HA     59 GLN  HN      2.99 #SUP  0.93  #QF  0.93
 58 GLU  QG     59 GLN  HN      4.05 #SUP  0.95  #QF  0.95
 59 GLN  HN     59 GLN  HB2     3.51 #SUP  0.58  #QF  0.58
 59 GLN  HN     59 GLN  HB3     3.51 #SUP  0.92  #QF  0.92
 59 GLN  HN     72 LEU  QD1     4.23 #SUP  0.83  #QF  0.83
 68 CYSS HN     72 LEU  HN      4.88 #SUP  1.00
 70 GLN  HN     72 LEU  HN      4.05 #SUP  1.00
 71 HIST HN     72 LEU  HN      2.90 #SUP  0.91  #QF  0.91
 70 GLN  HA     72 LEU  HN      4.43 #SUP  0.95  #QF  0.95
 69 LEU  HA     72 LEU  HN      3.76 #SUP  0.93  #QF  0.93
 67 TYR  HB3    72 LEU  HN      3.77 #SUP  0.98  #QF  0.98
 71 HIST HB2    72 LEU  HN      3.95 #SUP  0.94  #QF  0.94
 67 TYR  HB2    72 LEU  HN      3.87 #SUP  0.91  #QF  0.91
 72 LEU  HN     73 PRO  HD2     4.87 #SUP  0.94  #QF  0.94
 72 LEU  HN     73 PRO  HD3     4.60 #SUP  0.94  #QF  0.94
 72 LEU  HN     72 LEU  HB3     2.82 #SUP  0.91  #QF  0.91
 72 LEU  HN     72 LEU  HB2     2.94 #SUP  0.91  #QF  0.91
 72 LEU  HN     72 LEU  QD1     4.07 #SUP  0.78  #QF  0.78
 59 GLN  HN     66 PHE  QE      4.58 #SUP  0.87  #QF  0.87
 59 GLN  HN     59 GLN  HG2     5.03 #SUP  0.90  #QF  0.90
 59 GLN  HN     72 LEU  QD2     4.68 #SUP  0.97  #QF  0.97
 14 ALA  HN     14 ALA  QB      3.71 #SUP  0.91  #QF  0.91
 25 LEU  HB3    26 TYR  HN      4.81 #SUP  0.99  #QF  0.99
 44 ARG  HN     51 THR  HA      5.43 #SUP  0.98  #QF  0.98
 43 PHE  HB3    44 ARG  HN      4.58 #SUP  1.00
 43 PHE  QD     44 ARG  HN      4.11 #SUP  0.95  #QF  0.95
 43 PHE  QE     44 ARG  HN      5.26 #SUP  0.68  #QF  0.68
 43 PHE  HA     44 ARG  HN      3.10 #SUP  0.87  #QF  0.87
 43 PHE  HB2    44 ARG  HN      4.64 #SUP  0.99  #QF  0.99
 26 TYR  HN     29 GLU  HN      5.50 #SUP  1.00
 26 TYR  HN     26 TYR  QD      4.67 #SUP  1.00
 26 TYR  HN     29 GLU  HB3     5.15 #SUP  0.35  #QF  0.35
 25 LEU  HB2    26 TYR  HN      4.78 #SUP  0.88  #QF  0.88
 25 LEU  QD1    26 TYR  HN      4.90 #SUP  0.93  #QF  0.93
 25 LEU  QD2    26 TYR  HN      5.01 #SUP  0.92  #QF  0.92
 42 CYSS HB3    44 ARG  HN      5.50 #SUP  0.94  #QF  0.94
 44 ARG  HN     52 LEU  HN      4.73 #SUP  0.92  #QF  0.92
 42 CYSS HA     44 ARG  HN      5.25 #SUP  0.95  #QF  0.95
 44 ARG  HN     52 LEU  HG      4.91 #SUP  0.75  #QF  0.75
 44 ARG  HN     52 LEU  HB2     5.50 #SUP  0.97  #QF  0.94
 44 ARG  HN     52 LEU  QD2     5.50 #SUP  0.97  #QF  0.94
 18 CYSS HN     19 ALA  HN      4.68 #SUP  1.00
 18 CYSS HN     39 HIST HN      5.50 #SUP  0.54  #QF  0.54
 18 CYSS HN     39 HIST HE1     4.64 #SUP  0.91  #QF  0.91
 17 LEU  HA     18 CYSS HN      2.95 #SUP  0.93  #QF  0.93
 18 CYSS HN     18 CYSS HB3     3.13 #SUP  0.96  #QF  0.96
 18 CYSS HN     37 PHE  HB2     5.50 #SUP  0.91  #QF  0.91
 18 CYSS HN     18 CYSS HB2     3.25 #SUP  0.97  #QF  0.97
 17 LEU  HB2    18 CYSS HN      4.01 #SUP  0.73  #QF  0.73
 18 CYSS HN     25 LEU  HB2     4.69 #SUP  0.79  #QF  0.79
 17 LEU  HB3    18 CYSS HN      3.40 #SUP  0.97  #QF  0.97
 18 CYSS HN     25 LEU  QD1     4.29 #SUP  0.89  #QF  0.89
 18 CYSS HN     25 LEU  QD2     3.97 #SUP  0.94  #QF  0.94
 38 PHE  HB3    43 PHE  HN      4.77 #SUP  0.92  #QF  0.92
 43 PHE  HN     43 PHE  QD      4.34 #SUP  0.93  #QF  0.93
 40 ARG  HA     43 PHE  HN      4.28 #SUP  0.76  #QF  0.76
 39 HIST HB2    43 PHE  HN      4.40 #SUP  0.90  #QF  0.90
 39 HIST HB3    43 PHE  HN      4.80 #SUP  0.99  #QF  0.99
 42 CYSS HB3    43 PHE  HN      4.26 #SUP  0.99  #QF  0.99
 42 CYSS HB2    43 PHE  HN      3.96 #SUP  0.95  #QF  0.95
 43 PHE  HN     43 PHE  HB3     3.37 #SUP  0.96  #QF  0.96
 43 PHE  HN     43 PHE  HB2     3.35 #SUP  0.97  #QF  0.97
 20 LEU  HB2    43 PHE  HN      5.36 #SUP  0.90  #QF  0.90
 20 LEU  QD2    43 PHE  HN      5.32 #SUP  0.97  #QF  0.97
 43 PHE  HN     51 THR  QG2     5.50 #SUP  0.86  #QF  0.86
 20 LEU  QD1    43 PHE  HN      5.32 #SUP  0.94  #QF  0.94
 31 LEU  QD1    43 PHE  HN      5.49 #SUP  0.61  #QF  0.61
 31 LEU  QD2    43 PHE  HN      5.49 #SUP  0.99  #QF  0.99
 10 GLN  QG     11 GLU  HN      5.18 #SUP  0.98  #QF  0.70
 11 GLU  HN     11 GLU  QG      5.44 #SUP  0.98  #QF  0.70
 45 CYSS HN     47 THR  HN      5.31 #SUP  0.96  #QF  0.96
 45 CYSS HN     46 HIS  HN      4.74 #SUP  1.00
 45 CYSS HN     49 GLU  HN      4.15 #SUP  0.99  #QF  0.99
 45 CYSS HN     52 LEU  HN      4.41 #SUP  1.00
 45 CYSS HN     50 ALA  HA      4.72 #SUP  0.89  #QF  0.89
 45 CYSS HN     45 CYSS HB3     3.32 #SUP  0.95  #QF  0.95
 44 ARG  HD3    45 CYSS HN      4.91 #SUP  0.89  #QF  0.89
 45 CYSS HN     50 ALA  QB      4.07 #SUP  0.92  #QF  0.92
 45 CYSS HN     52 LEU  HG      3.69 #SUP  0.80  #QF  0.80
 45 CYSS HN     52 LEU  QD2     3.51 #SUP  0.94  #QF  0.94
 45 CYSS HN     48 CYSS HN      4.97 #SUP  1.00
 44 ARG  HN     45 CYSS HN      4.75 #SUP  0.98  #QF  0.98
 45 CYSS HN     67 TYR  HA      5.50 #SUP  0.45  #QF  0.45
 45 CYSS HN     51 THR  HA      4.65 #SUP  0.87  #QF  0.87
 45 CYSS HN     45 CYSS HB2     3.28 #SUP  0.94  #QF  0.94
 35 GLY  HN     36 HIS  HN      4.26 #SUP  0.95  #QF  0.95
 34 ASN  HB3    35 GLY  HN      5.00 #SUP  0.90  #QF  0.90
 34 ASN  HB2    35 GLY  HN      5.26 #SUP  0.94  #QF  0.93
 64 GLY  HN     65 HIS  HN      3.46 #SUP  0.99  #QF  0.99
 59 GLN  HE21   65 HIS  HN      4.75 #SUP  0.92  #QF  0.25
 65 HIS  HN     67 TYR  QD      5.15 #SUP  0.92  #QF  0.25
 65 HIS  HN     65 HIS  HD2     4.30 #SUP  0.92  #QF  0.92
 60 HIS  HB3    65 HIS  HN      3.96 #SUP  0.92  #QF  0.92
 65 HIS  HN     65 HIS  HB3     3.90 #SUP  0.80  #QF  0.80
 65 HIS  HN     65 HIS  HB2     3.57 #SUP  0.89  #QF  0.89
 65 HIS  HN     72 LEU  QD1     5.50 #SUP  0.83  #QF  0.83
 26 TYR  HB2    27 VAL  HN      4.85 #SUP  0.97  #QF  0.97
 27 VAL  HN     27 VAL  QG1     4.60 #SUP  0.98  #QF  0.81
 27 VAL  HN     27 VAL  QG2     4.60 #SUP  0.98  #QF  0.81
 53 TRP  HN     54 PRO  HD2     5.21 #SUP  0.73  #QF  0.73
 53 TRP  HN     54 PRO  HD3     5.21 #SUP  0.92  #QF  0.92
 53 TRP  HN     56 GLY  HN      4.97 #SUP  0.94  #QF  0.94
 53 TRP  HN     53 TRP  HD1     4.10 #SUP  0.99  #QF  0.31
 53 TRP  HN     57 TYR  QD      4.68 #SUP  0.98  #QF  0.98
 52 LEU  HA     53 TRP  HN      3.24 #SUP  0.95  #QF  0.95
 53 TRP  HN     53 TRP  HB3     3.93 #SUP  0.90  #QF  0.90
 53 TRP  HN     53 TRP  HB2     3.68 #SUP  0.78  #QF  0.78
 52 LEU  QD2    53 TRP  HN      3.94 #SUP  0.92  #QF  0.92
 52 LEU  HB3    53 TRP  HN      4.25 #SUP  0.95  #QF  0.95
 67 TYR  HN     68 CYSS HN      4.82 #SUP  0.99  #QF  0.99
 45 CYSS HN     68 CYSS HN      5.50 #SUP  0.90  #QF  0.90
 68 CYSS HN     70 GLN  HN      5.50 #SUP  1.00  #QF  0.94
 68 CYSS HN     71 HIST HN      4.25 #SUP  0.96  #QF  0.96
 67 TYR  QD     68 CYSS HN      4.35 #SUP  0.92  #QF  0.92
 67 TYR  HA     68 CYSS HN      3.22 #SUP  0.94  #QF  0.94
 45 CYSS HA     68 CYSS HN      3.89 #SUP  0.94  #QF  0.94
 47 THR  HB     68 CYSS HN      5.01 #SUP  0.89  #QF  0.89
 68 CYSS HN     71 HIST HB3     4.64 #SUP  0.98  #QF  0.98
 67 TYR  HB3    68 CYSS HN      3.41 #SUP  0.98  #QF  0.98
 68 CYSS HN     71 HIST HB2     4.12 #SUP  0.94  #QF  0.94
 68 CYSS HN     68 CYSS HB3     3.43 #SUP  0.97  #QF  0.97
 67 TYR  HB2    68 CYSS HN      4.08 #SUP  0.96  #QF  0.96
 46 HIS  HB3    68 CYSS HN      5.50 #SUP  0.56  #QF  0.56
 50 ALA  QB     68 CYSS HN      5.44 #SUP  0.90  #QF  0.90
 68 CYSS HN     72 LEU  QD1     5.11 #SUP  0.92  #QF  0.92
 52 LEU  QD2    68 CYSS HN      3.74 #SUP  0.95  #QF  0.95
 53 TRP  HN     53 TRP  HE3     5.14 #SUP  0.96  #QF  0.96
 52 LEU  HN     53 TRP  HN      4.94 #SUP  0.99  #QF  0.99
 73 PRO  HA     74 GLN  HN      2.74 #SUP  0.86  #QF  0.86
 73 PRO  HD2    74 GLN  HN      5.50 #SUP  0.87  #QF  0.87
 74 GLN  HN     74 GLN  QG      3.97 #SUP  0.94  #QF  0.94
 74 GLN  HN     74 GLN  HB3     3.86 #SUP  1.00
 74 GLN  HN     74 GLN  HB2     3.20 #SUP  0.96  #QF  0.96
 73 PRO  HB2    74 GLN  HN      3.60 #SUP  0.94  #QF  0.94
 30 ARG  HN     30 ARG  QD      4.95 #SUP  0.98  #QF  0.98
 30 ARG  HN     30 ARG  HG3     4.83 #SUP  0.87  #QF  0.87
 29 GLU  HB3    30 ARG  HN      4.83 #SUP  1.00  #QF  0.98
 29 GLU  HB2    30 ARG  HN      4.98 #SUP  0.92  #QF  0.92
 39 HIST HN     43 PHE  HN      4.70 #SUP  0.95  #QF  0.95
 38 PHE  HA     39 HIST HN      3.16 #SUP  0.92  #QF  0.92
 39 HIST HN     39 HIST HB2     3.65 #SUP  0.90  #QF  0.90
 39 HIST HN     39 HIST HB3     3.76 #SUP  0.98  #QF  0.98
 38 PHE  HB3    39 HIST HN      3.64 #SUP  0.93  #QF  0.93
 39 HIST HN     42 CYSS HB2     3.72 #SUP  0.95  #QF  0.95
 25 LEU  QD1    39 HIST HN      5.10 #SUP  0.86  #QF  0.86
 25 LEU  QD2    39 HIST HN      3.96 #SUP  0.92  #QF  0.92
 19 ALA  HN     39 HIST HN      4.59 #SUP  0.93  #QF  0.93
 39 HIST HN     42 CYSS HN      4.39 #SUP  1.00
 38 PHE  QD     39 HIST HN      4.40 #SUP  0.80  #QF  0.80
 18 CYSS HA     39 HIST HN      4.15 #SUP  0.95  #QF  0.95
 18 CYSS HB3    39 HIST HN      4.89 #SUP  0.99  #QF  0.85
 39 HIST HN     43 PHE  HB2     4.36 #SUP  0.66  #QF  0.66
 20 LEU  HN     20 LEU  QD2     4.34 #SUP  0.99  #QF  0.99
 20 LEU  HN     20 LEU  QD1     4.34 #SUP  0.95  #QF  0.95
 20 LEU  HN     38 PHE  QE      4.66 #SUP  0.97  #QF  0.97
 20 LEU  HN     38 PHE  QD      4.05 #SUP  0.93  #QF  0.93
 18 CYSS HB3    20 LEU  HN      4.85 #SUP  0.96  #QF  0.82
 20 LEU  HN     42 CYSS HB3     5.22 #SUP  0.96  #QF  0.82
 20 LEU  HN     38 PHE  HB3     5.01 #SUP  0.89  #QF  0.89
 20 LEU  HN     42 CYSS HB2     5.01 #SUP  0.83  #QF  0.83
 18 CYSS HB2    20 LEU  HN      5.00 #SUP  0.98  #QF  0.98
 20 LEU  HN     20 LEU  HB3     3.65 #SUP  0.94  #QF  0.94
 20 LEU  HN     20 LEU  HB2     3.32 #SUP  0.95  #QF  0.95
 20 LEU  HN     20 LEU  HG      4.05 #SUP  1.00
 19 ALA  QB     20 LEU  HN      3.69 #SUP  0.96  #QF  0.96
 36 HIS  HN     37 PHE  HA      5.36 #SUP  0.96  #QF  0.96
 33 VAL  HB     36 HIS  HN      5.45 #SUP  0.89  #QF  0.89
 32 CYS  HA     36 HIS  HN      5.28 #SUP  0.93  #QF  0.93
 33 VAL  QG1    36 HIS  HN      5.19 #SUP  0.96  #QF  0.96
 33 VAL  QG2    36 HIS  HN      5.50 #SUP  0.83  #QF  0.83
 33 VAL  HN     37 PHE  HN      5.05 #SUP  0.99  #QF  0.99
 37 PHE  HN     37 PHE  QD      3.71 #SUP  0.95  #QF  0.95
 32 CYS  HA     37 PHE  HN      5.22 #SUP  0.95  #QF  0.95
 36 HIS  HA     37 PHE  HN      2.97 #SUP  0.92  #QF  0.92
 36 HIS  HB2    37 PHE  HN      4.07 #SUP  0.87  #QF  0.87
 37 PHE  HN     37 PHE  HB2     3.36 #SUP  0.94  #QF  0.94
 36 HIS  HB3    37 PHE  HN      3.47 #SUP  0.97  #QF  0.97
 19 ALA  QB     37 PHE  HN      4.24 #SUP  0.95  #QF  0.95
 25 LEU  QD1    37 PHE  HN      4.90 #SUP  0.93  #QF  0.93
 25 LEU  QD2    37 PHE  HN      5.50 #SUP  0.94  #QF  0.94
 48 CYSS HN     68 CYSS HN      5.32 #SUP  1.00
 46 HIS  HN     48 CYSS HN      5.01 #SUP  1.00
 47 THR  HN     48 CYSS HN      3.12 #SUP  1.00
 48 CYSS HN     67 TYR  QD      5.32 #SUP  1.00
 47 THR  HB     48 CYSS HN      2.97 #SUP  0.80  #QF  0.80
 45 CYSS HB3    48 CYSS HN      3.52 #SUP  0.53  #QF  0.53
 48 CYSS HN     71 HIST HB2     5.09 #SUP  0.90  #QF  0.90
 45 CYSS HB2    48 CYSS HN      3.82 #SUP  0.93  #QF  0.93
 48 CYSS HN     48 CYSS HB3     3.57 #SUP  0.94  #QF  0.94
 48 CYSS HN     49 GLU  QG      4.36 #SUP  0.81  #QF  0.81
 48 CYSS HN     50 ALA  QB      4.70 #SUP  0.92  #QF  0.92
 47 THR  QG2    48 CYSS HN      3.39 #SUP  0.96  #QF  0.96
 48 CYSS HN     71 HIST HB3     5.43 #SUP  0.95  #QF  0.95
 48 CYSS HN     52 LEU  QD2     5.50 #SUP  0.89  #QF  0.89
 17 LEU  HN     25 LEU  QD1     4.74 #SUP  0.95  #QF  0.95
 16 ASP  HA     17 LEU  HN      3.11 #SUP  0.87  #QF  0.87
 15 GLY  QA     17 LEU  HN      5.01 #SUP  0.75  #QF  0.75
 16 ASP  QB     17 LEU  HN      4.04 #SUP  0.94  #QF  0.94
 17 LEU  HN     17 LEU  HG      3.24 #SUP  0.95  #QF  0.95
 17 LEU  HN     17 LEU  HB3     4.03 #SUP  0.96  #QF  0.96
 17 LEU  HN     17 LEU  QD1     4.10 #SUP  0.93  #QF  0.93
 17 LEU  HN     17 LEU  QD2     4.30 #SUP  0.94  #QF  0.94
 17 LEU  HN     25 LEU  QD2     5.50 #SUP  0.92  #QF  0.92
 36 HIS  HN     37 PHE  HN      4.62 #SUP  1.00
 36 HIS  HN     36 HIS  HD2     4.43 #SUP  0.98  #QF  0.98
 36 HIS  HN     38 PHE  QE      4.61 #SUP  0.95  #QF  0.95
 33 VAL  HA     36 HIS  HN      5.12 #SUP  0.93  #QF  0.93
 34 ASN  HB3    36 HIS  HN      4.73 #SUP  0.55  #QF  0.55
 36 HIS  HN     36 HIS  HB2     3.29 #SUP  0.91  #QF  0.91
 36 HIS  HN     36 HIS  HB3     4.02 #SUP  0.93  #QF  0.93
 27 VAL  HN     28 LEU  HN      4.56 #SUP  0.97  #QF  0.97
 28 LEU  HN     29 GLU  HN      4.24 #SUP  0.97  #QF  0.97
 27 VAL  HB     28 LEU  HN      4.48 #SUP  0.95  #QF  0.92
 28 LEU  HN     29 GLU  HB2     5.04 #SUP  0.95  #QF  0.92
 28 LEU  HN     28 LEU  HB2     3.90 #SUP  0.97  #QF  0.97
 28 LEU  HN     28 LEU  HB3     3.90 #SUP  0.93  #QF  0.75
 28 LEU  HN     28 LEU  HG      4.10 #SUP  0.93  #QF  0.75
 17 LEU  HA     23 GLU  HN      5.25 #SUP  0.90  #QF  0.90
 23 GLU  HN     39 HIST HE1     3.86 #SUP  0.94  #QF  0.94
 21 CYSS HA     23 GLU  HN      5.50 #SUP  0.90  #QF  0.90
 18 CYSS HB3    23 GLU  HN      3.71 #SUP  0.83  #QF  0.83
 23 GLU  HN     23 GLU  HB3     3.97 #SUP  0.94  #QF  0.94
 17 LEU  HB3    23 GLU  HN      4.98 #SUP  0.98  #QF  0.98
 18 CYSS HA     23 GLU  HN      5.26 #SUP  0.37  #QF  0.37
 17 LEU  QD2    23 GLU  HN      5.38 #SUP  0.78  #QF  0.78
 17 LEU  HA     24 HIS  HN      5.41 #SUP  0.98  #QF  0.98
 18 CYSS HN     24 HIS  HN      5.24 #SUP  0.99  #QF  0.99
 24 HIS  HN     39 HIST HE1     4.85 #SUP  0.96  #QF  0.96
 24 HIS  HN     24 HIS  HB2     3.32 #SUP  0.92  #QF  0.92
 24 HIS  HN     24 HIS  HB3     3.32 #SUP  0.96  #QF  0.96
 23 GLU  HB2    24 HIS  HN      3.51 #SUP  0.82  #QF  0.82
 23 GLU  HB3    24 HIS  HN      3.51 #SUP  0.92  #QF  0.92
 17 LEU  QD2    24 HIS  HN      4.17 #SUP  0.95  #QF  0.95
 66 PHE  HN     66 PHE  QD      3.58 #SUP  0.97  #QF  0.97
 65 HIS  HA     66 PHE  HN      3.17 #SUP  0.81  #QF  0.81
 65 HIS  HB3    66 PHE  HN      3.54 #SUP  0.73  #QF  0.73
 66 PHE  HN     66 PHE  HB2     3.52 #SUP  0.93  #QF  0.93
 65 HIS  HB2    66 PHE  HN      3.82 #SUP  0.96  #QF  0.63
 66 PHE  HN     66 PHE  HB3     4.15 #SUP  0.96  #QF  0.63
 57 TYR  QE     58 GLU  HN      5.17 #SUP  0.98  #QF  0.98
 58 GLU  HN     72 LEU  QD2     4.58 #SUP  1.00
 40 ARG  HN     42 CYSS HN      5.24 #SUP  0.99  #QF  0.99
 41 SER  HN     42 CYSS HN      4.85 #SUP  0.97  #QF  0.97
 42 CYSS HN     43 PHE  HN      3.12 #SUP  0.95  #QF  0.95
 39 HIST HA     42 CYSS HN      4.72 #SUP  0.93  #QF  0.93
 41 SER  HB2    42 CYSS HN      4.64 #SUP  0.99  #QF  0.99
 41 SER  HB3    42 CYSS HN      4.64 #SUP  0.98  #QF  0.98
 39 HIST HB2    42 CYSS HN      3.39 #SUP  0.92  #QF  0.92
 39 HIST HB3    42 CYSS HN      3.44 #SUP  0.98  #QF  0.98
 42 CYSS HN     42 CYSS HB3     3.80 #SUP  0.96  #QF  0.96
 38 PHE  HB3    42 CYSS HN      5.50 #SUP  0.68  #QF  0.68
 42 CYSS HN     42 CYSS HB2     3.36 #SUP  0.96  #QF  0.96
 42 CYSS HN     43 PHE  HB3     5.40 #SUP  0.99  #QF  0.99
 42 CYSS HN     43 PHE  HB2     5.18 #SUP  0.98  #QF  0.98
 58 GLU  HN     66 PHE  QD      4.80 #SUP  0.78  #QF  0.78
 58 GLU  HN     66 PHE  HA      4.92 #SUP  0.70  #QF  0.70
 57 TYR  HB2    58 GLU  HN      3.40 #SUP  0.97  #QF  0.97
 57 TYR  HB3    58 GLU  HN      4.15 #SUP  0.89  #QF  0.89
 58 GLU  HN     58 GLU  QG      4.06 #SUP  0.92  #QF  0.92
 58 GLU  HN     58 GLU  HB2     4.11 #SUP  0.97  #QF  0.97
 58 GLU  HN     58 GLU  HB3     4.11 #SUP  0.98  #QF  0.98
 58 GLU  HN     69 LEU  HG      5.50 #SUP  0.97  #QF  0.97
 58 GLU  HN     72 LEU  QD1     4.44 #SUP  1.00
 57 TYR  HN     58 GLU  HN      4.41 #SUP  1.00
 57 TYR  QD     58 GLU  HN      3.69 #SUP  0.97  #QF  0.97
 57 TYR  HA     58 GLU  HN      3.22 #SUP  0.97  #QF  0.97
 58 GLU  HN     68 CYSS HA      4.38 #SUP  0.96  #QF  0.96
 58 GLU  HN     69 LEU  HA      5.34 #SUP  0.99  #QF  0.99
 52 LEU  QD2    58 GLU  HN      4.33 #SUP  0.96  #QF  0.96
 57 TYR  QD     67 TYR  HN      4.84 #SUP  0.92  #QF  0.92
 57 TYR  HB2    67 TYR  HN      5.50 #SUP  0.99  #QF  0.97
 60 HIS  HB2    67 TYR  HN      5.50 #SUP  0.99  #QF  0.97
 67 TYR  HN     72 LEU  HB2     4.69 #SUP  0.98  #QF  0.98
 59 GLN  HN     67 TYR  HN      5.08 #SUP  0.49  #QF  0.49
 58 GLU  HN     67 TYR  HN      3.92 #SUP  0.99  #QF  0.99
 66 PHE  HN     67 TYR  HN      4.47 #SUP  1.00
 67 TYR  HN     67 TYR  QD      3.51 #SUP  0.88  #QF  0.88
 66 PHE  HA     67 TYR  HN      3.09 #SUP  0.87  #QF  0.87
 45 CYSS HA     67 TYR  HN      5.31 #SUP  0.87  #QF  0.87
 67 TYR  HN     72 LEU  HA      5.05 #SUP  0.94  #QF  0.94
 67 TYR  HN     67 TYR  HB3     3.87 #SUP  0.96  #QF  0.96
 67 TYR  HN     67 TYR  HB2     3.54 #SUP  0.82  #QF  0.82
 66 PHE  HB3    67 TYR  HN      3.76 #SUP  0.93  #QF  0.93
 67 TYR  HN     72 LEU  QD1     4.17 #SUP  0.98  #QF  0.98
 52 LEU  QD2    67 TYR  HN      4.98 #SUP  0.93  #QF  0.93
 68 CYSS HB2    69 LEU  HN      3.45 #SUP  0.90  #QF  0.90
 68 CYSS HB3    69 LEU  HN      3.85 #SUP  0.96  #QF  0.96
 57 TYR  HB3    69 LEU  HN      5.50 #SUP  0.92  #QF  0.92
 69 LEU  HN     69 LEU  QD2     3.75 #SUP  0.95  #QF  0.95
 57 TYR  HA     69 LEU  HN      4.03 #SUP  0.98  #QF  0.98
 68 CYSS HA     69 LEU  HN      3.29 #SUP  0.95  #QF  0.95
 69 LEU  HN     69 LEU  HB2     3.36 #SUP  0.94  #QF  0.94
 69 LEU  HN     69 LEU  QD1     3.75 #SUP  0.96  #QF  0.96
 52 LEU  QD2    69 LEU  HN      4.42 #SUP  0.95  #QF  0.95
 28 LEU  HB3    29 GLU  HN      4.59 #SUP  0.98  #QF  0.98
 58 GLU  HN     69 LEU  HN      4.99 #SUP  0.87  #QF  0.87
 51 THR  HN     52 LEU  HN      4.59 #SUP  0.99  #QF  0.99
 50 ALA  HA     51 THR  HN      2.69 #SUP  0.73  #QF  0.73
 51 THR  HN     51 THR  HB      3.11 #SUP  0.90  #QF  0.90
 50 ALA  QB     51 THR  HN      3.05 #SUP  0.70  #QF  0.70
 51 THR  HN     51 THR  QG2     3.91 #SUP  0.93  #QF  0.93
 28 LEU  HB2    29 GLU  HN      4.59 #SUP  0.98  #QF  0.98
 29 GLU  HN     30 ARG  HN      3.97 #SUP  0.49  #QF  0.49
 29 GLU  HN     29 GLU  QG      3.77 #SUP  1.00  #QF  0.97
 29 GLU  HN     29 GLU  HB2     4.03 #SUP  0.96  #QF  0.96
 30 ARG  HB2    38 PHE  HN      4.90 #SUP  0.95  #QF  0.95
 21 CYSS HN     38 PHE  QD      5.50 #SUP  0.61  #QF  0.61
 71 HIST HN     71 HIST HB3     3.89 #SUP  0.98  #QF  0.98
 71 HIST HN     71 HIST HB2     3.27 #SUP  0.94  #QF  0.94
 67 TYR  HB2    71 HIST HN      5.05 #SUP  0.92  #QF  0.92
 71 HIST HN     72 LEU  HB2     4.19 #SUP  0.84  #QF  0.84
 37 PHE  QD     38 PHE  HN      4.22 #SUP  0.94  #QF  0.94
 38 PHE  HN     38 PHE  QD      4.19 #SUP  0.97  #QF  0.97
 37 PHE  HA     38 PHE  HN      3.13 #SUP  0.93  #QF  0.93
 32 CYS  HA     38 PHE  HN      4.81 #SUP  0.88  #QF  0.88
 30 ARG  HA     38 PHE  HN      4.65 #SUP  0.87  #QF  0.57
 31 LEU  HA     38 PHE  HN      5.18 #SUP  0.87  #QF  0.57
 38 PHE  HN     38 PHE  HB3     4.09 #SUP  0.96  #QF  0.96
 37 PHE  HB2    38 PHE  HN      4.35 #SUP  0.94  #QF  0.94
 37 PHE  HB3    38 PHE  HN      3.90 #SUP  0.96  #QF  0.96
 38 PHE  HN     38 PHE  HB2     3.75 #SUP  0.93  #QF  0.93
 33 VAL  HB     38 PHE  HN      5.50 #SUP  0.92  #QF  0.82
 31 LEU  HB2    38 PHE  HN      4.78 #SUP  0.89  #QF  0.89
 31 LEU  HB3    38 PHE  HN      4.78 #SUP  0.79  #QF  0.79
 25 LEU  QD1    38 PHE  HN      4.82 #SUP  0.93  #QF  0.93
 25 LEU  QD2    38 PHE  HN      4.33 #SUP  0.97  #QF  0.97
 19 ALA  HN     21 CYSS HN      4.86 #SUP  0.99  #QF  0.99
 20 LEU  HN     21 CYSS HN      3.18 #SUP  1.00
 19 ALA  HA     21 CYSS HN      5.30 #SUP  1.00  #QF  0.73
 21 CYSS HN     21 CYSS HB2     3.69 #SUP  0.80  #QF  0.80
 21 CYSS HN     21 CYSS HB3     3.57 #SUP  0.98  #QF  0.98
 18 CYSS HB2    21 CYSS HN      4.75 #SUP  0.90  #QF  0.90
 20 LEU  HB3    21 CYSS HN      3.38 #SUP  0.94  #QF  0.94
 20 LEU  HB2    21 CYSS HN      3.56 #SUP  0.96  #QF  0.96
 20 LEU  HG     21 CYSS HN      5.06 #SUP  1.00
 19 ALA  QB     21 CYSS HN      5.28 #SUP  0.97  #QF  0.97
 20 LEU  QD2    21 CYSS HN      4.68 #SUP  0.98  #QF  0.98
 20 LEU  QD1    21 CYSS HN      4.68 #SUP  0.98  #QF  0.98
 47 THR  HN     49 GLU  HN      3.86 #SUP  0.97  #QF  0.97
 47 THR  HA     49 GLU  HN      4.55 #SUP  0.89  #QF  0.89
 49 GLU  HN     50 ALA  HA      5.40 #SUP  0.98  #QF  0.98
 49 GLU  HN     49 GLU  HA      2.93 #SUP  0.95  #QF  0.95
 45 CYSS HB3    49 GLU  HN      3.59 #SUP  0.84  #QF  0.84
 45 CYSS HB2    49 GLU  HN      3.84 #SUP  0.97  #QF  0.97
 49 GLU  HN     49 GLU  QG      3.40 #SUP  0.88  #QF  0.88
 49 GLU  HN     50 ALA  QB      4.47 #SUP  0.98  #QF  0.98
 47 THR  QG2    49 GLU  HN      5.04 #SUP  0.95  #QF  0.95
 49 GLU  HN     52 LEU  QD2     5.50 #SUP  0.97  #QF  0.97
 56 GLY  HN     57 TYR  HN      3.18 #SUP  0.99  #QF  0.99
 57 TYR  HN     57 TYR  QD      3.37 #SUP  0.94  #QF  0.94
 57 TYR  HN     57 TYR  QE      4.99 #SUP  0.96  #QF  0.96
 57 TYR  HN     68 CYSS HA      5.50 #SUP  0.90  #QF  0.90
 57 TYR  HN     57 TYR  HB2     4.06 #SUP  1.00
 57 TYR  HN     57 TYR  HB3     4.06 #SUP  0.92  #QF  0.92
 57 TYR  HN     58 GLU  QG      4.86 #SUP  0.89  #QF  0.89
 57 TYR  HN     69 LEU  HG      4.50 #SUP  0.96  #QF  0.96
 57 TYR  HN     69 LEU  QD1     4.01 #SUP  0.97  #QF  0.97
 57 TYR  HN     69 LEU  QD2     4.01 #SUP  0.94  #QF  0.94
 52 LEU  QD2    57 TYR  HN      5.37 #SUP  0.96  #QF  0.96
 57 TYR  HN     69 LEU  HN      5.50 #SUP  0.97  #QF  0.97
 47 THR  HN     67 TYR  QD      3.56 #SUP  0.98  #QF  0.98
 47 THR  HN     67 TYR  HA      4.50 #SUP  0.94  #QF  0.94
 47 THR  HN     47 THR  HB      2.99 #SUP  0.90  #QF  0.90
 45 CYSS HB3    47 THR  HN      4.34 #SUP  0.90  #QF  0.90
 45 CYSS HB2    47 THR  HN      4.20 #SUP  0.72  #QF  0.72
 46 HIS  HB3    47 THR  HN      3.84 #SUP  0.94  #QF  0.94
 47 THR  HN     50 ALA  HN      5.17 #SUP  1.00
 47 THR  HN     68 CYSS HN      5.08 #SUP  0.99  #QF  0.99
 46 HIS  HD2    47 THR  HN      5.07 #SUP  0.79  #QF  0.79
 47 THR  HN     71 HIST HB3     5.08 #SUP  0.96  #QF  0.96
 47 THR  HN     71 HIST HB2     5.01 #SUP  0.98  #QF  0.98
 47 THR  HN     48 CYSS HB3     4.98 #SUP  0.95  #QF  0.95
 68 CYSS HB3    70 GLN  HN      4.18 #SUP  0.98  #QF  0.98
 52 LEU  QD2    70 GLN  HN      5.50 #SUP  0.85  #QF  0.85
 70 GLN  HN     71 HIST HN      3.07 #SUP  1.00  #QF  0.87
 68 CYSS HA     70 GLN  HN      4.39 #SUP  0.98  #QF  0.98
 70 GLN  HN     71 HIST HA      5.21 #SUP  0.99  #QF  0.99
 70 GLN  HN     70 GLN  HG3     4.77 #SUP  0.91  #QF  0.91
 69 LEU  HB2    70 GLN  HN      3.83 #SUP  0.94  #QF  0.94
 70 GLN  HN     70 GLN  HB2     3.27 #SUP  0.97  #QF  0.97
 70 GLN  HN     70 GLN  HB3     3.27 #SUP  0.64  #QF  0.64
 69 LEU  QD1    70 GLN  HN      5.40 #SUP  0.94  #QF  0.94
 69 LEU  QD2    70 GLN  HN      5.40 #SUP  0.95  #QF  0.95
 68 CYSS HB2    70 GLN  HN      3.98 #SUP  0.94  #QF  0.94
 70 GLN  HN     71 HIST HB2     4.63 #SUP  0.87  #QF  0.87
 70 GLN  HN     70 GLN  HG2     4.77 #SUP  0.96  #QF  0.96
 19 ALA  HN     20 LEU  HN      3.60 #SUP  1.00
 44 ARG  HN     52 LEU  QD1     4.62 #SUP  0.80  #QF  0.80
 45 CYSS HN     52 LEU  QD1     4.05 #SUP  0.95  #QF  0.95
 46 HIS  HN     52 LEU  QD1     4.57 #SUP  0.93  #QF  0.93
 48 CYSS HN     71 HIST HE1     4.20 #SUP  0.93  #QF  0.93
 52 LEU  HN     52 LEU  QD1     4.18 #SUP  0.90  #QF  0.90
 52 LEU  QD1    58 GLU  HN      4.44 #SUP  0.89  #QF  0.89
 58 GLU  HN     59 GLN  HN      4.53 #SUP  1.00
 59 GLN  HN     60 HIS  HN      4.53 #SUP  0.98  #QF  0.98
 60 HIS  HN     65 HIS  HN      4.45 #SUP  0.99  #QF  0.99
 65 HIS  HN     66 PHE  HN      4.57 #SUP  1.00
 52 LEU  QD1    66 PHE  HN      5.07 #SUP  0.85  #QF  0.85
 52 LEU  QD1    67 TYR  HN      4.36 #SUP  0.92  #QF  0.92
 52 LEU  QD1    68 CYSS HN      4.78 #SUP  0.90  #QF  0.90
 52 LEU  QD1    53 TRP  HN      5.50 #SUP  0.97  #QF  0.97
 18 CYSS HA     20 LEU  HN      4.35 #SUP  1.00
 22 GLY  HN     23 GLU  HN      3.34 #SUP  1.00  #QF  0.68
 21 CYSS HN     22 GLY  HN      3.01 #SUP  0.88  #QF  0.88
 60 HIS  HE1    63 ASP  HN      4.90 #SUP  0.63  #QF  0.63
 60 HIS  HE1    75 THR  HA      5.11 #SUP  0.21  #QF  0.21
 60 HIS  HE1    62 GLY  HN      4.40 #SUP  0.96  #QF  0.96
 60 HIS  HE1    62 GLY  HA1     4.09 #SUP  0.99  #QF  0.99
 60 HIS  HE1    62 GLY  HA2     4.09 #SUP  0.98  #QF  0.98
 60 HIS  HE1    61 PRO  HD2     4.94 #SUP  0.98  #QF  0.98
 60 HIS  HE1    61 PRO  HG2     4.86 #SUP  0.71  #QF  0.71
 60 HIS  HE1    73 PRO  HB2     4.73 #SUP  0.65  #QF  0.49
 60 HIS  HE1    75 THR  QG2     5.01 #SUP  0.65  #QF  0.49
 48 CYSS HB2    71 HIST HE1     3.86 #SUP  1.00
 48 CYSS HB3    71 HIST HE1     3.29 #SUP  0.97  #QF  0.97
 47 THR  QG2    71 HIST HE1     4.46 #SUP  1.00
 18 CYSS HB3    39 HIST HE1     3.90 #SUP  0.99  #QF  0.99
 23 GLU  HB2    39 HIST HE1     3.66 #SUP  0.98  #QF  0.98
 23 GLU  HB3    39 HIST HE1     3.66 #SUP  0.95  #QF  0.95
 25 LEU  QD2    39 HIST HE1     4.84 #SUP  0.97  #QF  0.97
 17 LEU  HB2    22 GLY  HA1     4.95 #SUP  0.93  #QF  0.93
 17 LEU  HB3    22 GLY  HA1     4.92 #SUP  1.00
 17 LEU  QD1    22 GLY  HA1     4.86 #SUP  1.00
 61 PRO  HG2    62 GLY  HA1     5.50 #SUP  1.00
 17 LEU  HB2    22 GLY  HA2     4.95 #SUP  0.94  #QF  0.94
 17 LEU  HB3    22 GLY  HA2     4.92 #SUP  1.00
 61 PRO  HB2    62 GLY  HA2     5.46 #SUP  0.99  #QF  0.23
 61 PRO  HG2    62 GLY  HA2     5.50 #SUP  0.99  #QF  0.23
 16 ASP  QB     24 HIS  HE1     5.50 #SUP  0.71  #QF  0.71
 17 LEU  QD2    24 HIS  HE1     5.50 #SUP  0.98  #QF  0.98
 59 GLN  HE22   64 GLY  HA1     4.99 #SUP  0.99  #QF  0.99
 12 ALA  QB     13 GLY  HA1     5.31 #SUP  0.99  #QF  0.96
 13 GLY  HA1    14 ALA  QB      5.50 #SUP  0.99  #QF  0.96
 56 GLY  HA2    69 LEU  HG      5.06 #SUP  0.94  #QF  0.94
 31 LEU  HB2    33 VAL  QG2     4.71 #SUP  0.99  #QF  0.99
 31 LEU  HB3    38 PHE  HB2     4.76 #SUP  0.99  #QF  0.99
 31 LEU  HB3    31 LEU  QD1     4.08 #SUP  0.99  #QF  0.99
 31 LEU  HB3    31 LEU  QD2     4.08 #SUP  0.99  #QF  0.99
 31 LEU  HB3    33 VAL  QG2     4.71 #SUP  0.99  #QF  0.99
 78 GLY  QA     79 PRO  QD      3.30 #SUP  0.72  #QF  0.72
 17 LEU  HN     17 LEU  HB2     3.94 #SUP  0.97  #QF  0.97
 17 LEU  HB2    17 LEU  QD2     3.88 #SUP  0.99  #QF  0.99
 17 LEU  HB3    17 LEU  QD1     3.50 #SUP  0.98  #QF  0.98
 17 LEU  HB3    17 LEU  QD2     3.71 #SUP  0.99  #QF  0.99
 38 PHE  HB3    43 PHE  HB3     4.97 #SUP  0.98  #QF  0.98
 57 TYR  HB2    68 CYSS HA      4.72 #SUP  1.00
 57 TYR  HB2    58 GLU  HA      5.08 #SUP  0.94  #QF  0.94
 52 LEU  QD2    57 TYR  HB2     3.91 #SUP  0.99  #QF  0.99
 52 LEU  HB3    57 TYR  HB2     4.79 #SUP  0.99  #QF  0.99
 52 LEU  HB3    57 TYR  HB3     4.63 #SUP  1.00
 38 PHE  HB2    43 PHE  HB3     4.97 #SUP  0.96  #QF  0.96
 38 PHE  HB2    39 HIST HN      4.52 #SUP  0.95  #QF  0.95
 31 LEU  HB2    38 PHE  HB2     4.76 #SUP  0.90  #QF  0.90
 52 LEU  HG     57 TYR  HB3     5.38 #SUP  0.75  #QF  0.66
 25 LEU  QD1    30 ARG  QD      4.43 #SUP  0.99  #QF  0.99
 30 ARG  QD     37 PHE  HZ      4.90 #SUP  0.88  #QF  0.88
 27 VAL  HA     30 ARG  QD      4.36 #SUP  0.98  #QF  0.98
 30 ARG  HB2    30 ARG  QD      3.66 #SUP  0.89  #QF  0.89
 25 LEU  QD2    30 ARG  QD      4.74 #SUP  0.99  #QF  0.99
 67 TYR  HB3    72 LEU  HA      4.00 #SUP  0.99  #QF  0.99
 67 TYR  HB3    73 PRO  HD3     5.06 #SUP  0.99  #QF  0.99
 67 TYR  HB3    72 LEU  HG      5.50 #SUP  1.00
 67 TYR  HB3    71 HIST HN      5.10 #SUP  0.98  #QF  0.98
 45 CYSS HB2    67 TYR  HB3     5.50 #SUP  0.35  #QF  0.35
 67 TYR  HB3    72 LEU  HB2     4.68 #SUP  1.00
 42 CYSS HA     44 ARG  HD3     5.50 #SUP  0.36  #QF  0.36
 44 ARG  HD3    49 GLU  HB2     4.59 #SUP  1.00
 44 ARG  HD3    49 GLU  HB3     4.59 #SUP  1.00
 44 ARG  HD3    49 GLU  QG      4.99 #SUP  1.00
 44 ARG  HN     44 ARG  HD3     5.50 #SUP  0.70  #QF  0.70
 44 ARG  HD3    49 GLU  HA      4.42 #SUP  0.92  #QF  0.92
 44 ARG  HN     44 ARG  HD2     4.79 #SUP  0.64  #QF  0.64
 44 ARG  HD2    49 GLU  QG      5.04 #SUP  1.00
 66 PHE  HA     67 TYR  HB2     4.94 #SUP  0.90  #QF  0.90
 67 TYR  HB2    72 LEU  HA      3.99 #SUP  0.99  #QF  0.99
 60 HIS  HB2    67 TYR  HB2     4.93 #SUP  0.97  #QF  0.97
 67 TYR  HB2    72 LEU  HG      5.07 #SUP  1.00
 67 TYR  HB2    72 LEU  HB2     4.54 #SUP  1.00
 20 LEU  HB3    42 CYSS HB3     3.90 #SUP  1.00
 20 LEU  HB3    21 CYSS HB3     4.45 #SUP  0.90  #QF  0.75
 20 LEU  HB2    42 CYSS HB2     4.32 #SUP  1.00  #QF  0.21
 20 LEU  HB2    42 CYSS HB3     3.98 #SUP  1.00
 24 HIS  HA     25 LEU  HB2     4.90 #SUP  0.96  #QF  0.96
 25 LEU  HB3    25 LEU  QD1     4.13 #SUP  1.00
 25 LEU  HB3    25 LEU  QD2     4.12 #SUP  1.00
 67 TYR  HB3    71 HIST HB2     4.34 #SUP  0.73  #QF  0.73
 40 ARG  HA     40 ARG  HD2     4.93 #SUP  0.98  #QF  0.98
 46 HIS  HD2    67 TYR  QD      4.86 #SUP  0.88  #QF  0.88
 67 TYR  QD     72 LEU  HB2     4.81 #SUP  0.79  #QF  0.79
 60 HIS  HA     67 TYR  QD      4.79 #SUP  0.65  #QF  0.65
 67 TYR  QD     71 HIST HB3     3.83 #SUP  0.47  #QF  0.47
 67 TYR  QD     71 HIST HB2     4.32 #SUP  1.00
 46 HIS  HB3    67 TYR  QD      4.30 #SUP  0.79  #QF  0.54
 67 TYR  QD     72 LEU  HG      4.85 #SUP  0.99  #QF  0.99
 67 TYR  QD     73 PRO  HG3     5.11 #SUP  1.00
 69 LEU  HA     72 LEU  HB3     4.39 #SUP  0.98  #QF  0.98
 67 TYR  HB2    72 LEU  HB3     4.75 #SUP  1.00
 72 LEU  HB3    73 PRO  HD2     4.86 #SUP  1.00
 67 TYR  HB3    72 LEU  HB3     5.38 #SUP  1.00
 72 LEU  HB3    73 PRO  HD3     5.50 #SUP  1.00  #QF  0.99
 72 LEU  HB3    74 GLN  QG      5.50 #SUP  1.00  #QF  0.99
 69 LEU  HA     72 LEU  HB2     4.36 #SUP  0.98  #QF  0.98
 69 LEU  HN     72 LEU  HB2     5.50 #SUP  0.99  #QF  0.53
 72 LEU  HB2    73 PRO  HD2     4.86 #SUP  0.99  #QF  0.99
 72 LEU  HB2    73 PRO  HD3     5.14 #SUP  0.97  #QF  0.97
 53 TRP  HA     57 TYR  QD      5.50 #SUP  0.99  #QF  0.82
 57 TYR  QD     68 CYSS HA      5.50 #SUP  0.99  #QF  0.82
 57 TYR  QD     59 GLN  HN      4.78 #SUP  0.99  #QF  0.99
 57 TYR  QD     66 PHE  QD      3.70 #SUP  1.00
 57 TYR  HA     57 TYR  QD      4.03 #SUP  1.00
 43 PHE  QE     57 TYR  QD      4.39 #SUP  0.99  #QF  0.99
 43 PHE  HZ     57 TYR  QD      4.41 #SUP  0.98  #QF  0.98
 54 PRO  HA     57 TYR  QD      3.78 #SUP  0.97  #QF  0.63
 57 TYR  QD     58 GLU  HA      4.12 #SUP  0.97  #QF  0.63
 57 TYR  QD     66 PHE  HB2     4.81 #SUP  0.99  #QF  0.99
 57 TYR  QD     66 PHE  HB3     4.38 #SUP  0.98  #QF  0.98
 52 LEU  HG     57 TYR  QD      5.50 #SUP  0.93  #QF  0.80
 57 TYR  QD     69 LEU  QD1     5.50 #SUP  0.93  #QF  0.80
 57 TYR  QD     69 LEU  QD2     5.50 #SUP  0.57  #QF  0.57
 52 LEU  QD2    57 TYR  QD      4.10 #SUP  1.00
 52 LEU  HB3    57 TYR  QD      4.17 #SUP  0.98  #QF  0.98
 28 LEU  HB3    28 LEU  QD1     3.70 #SUP  0.55  #QF  0.55
 43 PHE  QD     52 LEU  HB3     5.05 #SUP  0.90  #QF  0.90
 37 PHE  HN     37 PHE  HB3     4.20 #SUP  0.97  #QF  0.97
 16 ASP  HN     16 ASP  QB      3.68 #SUP  0.98  #QF  0.98
 16 ASP  QB     24 HIS  HA      5.43 #SUP  0.68  #QF  0.68
 16 ASP  QB     25 LEU  HB2     5.08 #SUP  0.98  #QF  0.98
 16 ASP  QB     25 LEU  HB3     5.04 #SUP  0.95  #QF  0.95
 16 ASP  QB     25 LEU  QD1     4.10 #SUP  0.99  #QF  0.99
 26 TYR  QD     27 VAL  HN      4.69 #SUP  0.98  #QF  0.98
 26 TYR  HA     26 TYR  QD      3.39 #SUP  0.95  #QF  0.95
 26 TYR  QD     29 GLU  QG      4.08 #SUP  0.97  #QF  0.97
 26 TYR  QD     29 GLU  HB2     5.19 #SUP  0.93  #QF  0.30
 69 LEU  HB2    69 LEU  QD1     3.46 #SUP  1.00
 69 LEU  HB3    70 GLN  HN      4.64 #SUP  0.96  #QF  0.96
 69 LEU  HN     69 LEU  HB3     3.85 #SUP  0.99  #QF  0.99
 38 PHE  QD     43 PHE  QD      4.99 #SUP  0.87  #QF  0.87
 37 PHE  HA     38 PHE  QD      5.03 #SUP  1.00  #QF  0.92
 38 PHE  QD     42 CYSS HB3     5.50 #SUP  0.98  #QF  0.98
 36 HIS  HB2    38 PHE  QD      5.11 #SUP  0.80  #QF  0.80
 20 LEU  HB3    38 PHE  QD      5.38 #SUP  0.99  #QF  0.99
 20 LEU  HB2    38 PHE  QD      4.64 #SUP  0.99  #QF  0.99
 20 LEU  HG     38 PHE  QD      4.79 #SUP  0.99  #QF  0.98
 30 ARG  HB2    37 PHE  QE      5.27 #SUP  0.99  #QF  0.98
 33 VAL  QG1    38 PHE  QD      4.95 #SUP  0.80  #QF  0.80
 66 PHE  HN     66 PHE  QE      5.39 #SUP  1.00
 43 PHE  QE     66 PHE  QE      4.86 #SUP  0.98  #QF  0.98
 66 PHE  HA     66 PHE  QE      4.85 #SUP  1.00
 34 ASN  HB2    66 PHE  QE      4.88 #SUP  0.80  #QF  0.80
 33 VAL  HB     66 PHE  QE      5.13 #SUP  0.98  #QF  0.86
 57 TYR  QD     66 PHE  QE      4.43 #SUP  0.93  #QF  0.93
 57 TYR  QE     66 PHE  QE      4.31 #SUP  0.97  #QF  0.97
 43 PHE  HZ     66 PHE  QE      4.93 #SUP  0.99  #QF  0.99
 59 GLN  HB2    66 PHE  QE      4.56 #SUP  0.98  #QF  0.98
 59 GLN  HB3    66 PHE  QE      4.56 #SUP  0.99  #QF  0.99
 57 TYR  QE     66 PHE  QD      4.20 #SUP  0.99  #QF  0.99
 43 PHE  HZ     66 PHE  QD      4.76 #SUP  1.00
 66 PHE  HA     66 PHE  QD      4.18 #SUP  0.99  #QF  0.99
 59 GLN  HG2    66 PHE  QD      5.09 #SUP  0.98  #QF  0.98
 59 GLN  HB3    66 PHE  QD      4.48 #SUP  0.99  #QF  0.99
 59 GLN  HG3    66 PHE  QD      5.09 #SUP  0.96  #QF  0.96
 43 PHE  QE     66 PHE  QD      4.63 #SUP  1.00
 65 HIS  HA     66 PHE  QD      4.79 #SUP  0.91  #QF  0.91
 33 VAL  QG1    66 PHE  QD      4.54 #SUP  0.99  #QF  0.99
 30 ARG  HB2    37 PHE  QD      4.40 #SUP  0.77  #QF  0.77
 30 ARG  HG2    37 PHE  QD      4.63 #SUP  0.87  #QF  0.50
 38 PHE  HN     38 PHE  QE      5.50 #SUP  1.00  #QF  0.99
 32 CYS  HA     37 PHE  QD      4.44 #SUP  0.95  #QF  0.95
 36 HIS  HA     37 PHE  QD      4.80 #SUP  0.99  #QF  0.94
 30 ARG  QD     37 PHE  QD      3.86 #SUP  0.99  #QF  0.73
 30 ARG  HG3    37 PHE  QD      4.63 #SUP  1.00
 25 LEU  QD2    37 PHE  QD      4.79 #SUP  0.99  #QF  0.99
 45 CYSS HB2    47 THR  HB      5.50 #SUP  0.93  #QF  0.93
 43 PHE  QD     52 LEU  HB2     4.57 #SUP  0.99  #QF  0.83
 75 THR  HA     75 THR  HB      2.90 #SUP  0.99  #QF  0.99
 47 THR  HB     48 CYSS HB3     5.08 #SUP  1.00
 47 THR  HB     67 TYR  QD      4.13 #SUP  0.99  #QF  0.99
 47 THR  HB     71 HIST HA      5.38 #SUP  1.00
 47 THR  HB     71 HIST HB3     3.81 #SUP  0.99  #QF  0.99
 47 THR  HB     71 HIST HB2     4.00 #SUP  1.00
 43 PHE  QE     52 LEU  HB2     4.65 #SUP  1.00  #QF  0.50
 51 THR  HB     53 TRP  HH2     5.05 #SUP  0.62  #QF  0.62
 50 ALA  HA     51 THR  HB      4.90 #SUP  1.00
 50 ALA  QB     51 THR  HB      4.44 #SUP  0.99  #QF  0.99
 26 TYR  HB2    29 GLU  QG      4.57 #SUP  1.00  #QF  0.98
 26 TYR  HB3    27 VAL  HN      4.85 #SUP  0.98  #QF  0.98
 26 TYR  HB3    29 GLU  QG      4.57 #SUP  1.00  #QF  0.82
 36 HIS  HB3    38 PHE  HZ      4.51 #SUP  0.96  #QF  0.96
 36 HIS  HB2    38 PHE  HZ      4.37 #SUP  0.85  #QF  0.44
 38 PHE  QD     38 PHE  HZ      4.18 #SUP  0.99  #QF  0.99
 43 PHE  HZ     52 LEU  HB2     5.50 #SUP  0.97  #QF  0.72
 38 PHE  HB3    43 PHE  HB2     4.86 #SUP  0.98  #QF  0.98
 34 ASN  HB2    66 PHE  HZ      4.84 #SUP  0.97  #QF  0.91
 53 TRP  HA     53 TRP  HD1     4.76 #SUP  1.00
 52 LEU  HA     53 TRP  HD1     4.48 #SUP  0.98  #QF  0.98
 51 THR  QG2    53 TRP  HD1     5.06 #SUP  0.98  #QF  0.98
 49 GLU  HA     49 GLU  QG      3.42 #SUP  1.00
 51 THR  HB     53 TRP  HD1     5.50 #SUP  0.94  #QF  0.94
 28 LEU  HA     29 GLU  QG      5.12 #SUP  0.97  #QF  0.97
 29 GLU  QG     30 ARG  HN      4.73 #SUP  0.95  #QF  0.95
 26 TYR  HA     29 GLU  QG      4.77 #SUP  0.87  #QF  0.87
 29 GLU  HA     29 GLU  QG      3.50 #SUP  0.99  #QF  0.99
 29 GLU  HB2    29 GLU  QG      2.96 #SUP  1.00
 28 LEU  HB2    29 GLU  QG      4.45 #SUP  0.90  #QF  0.90
 28 LEU  HB3    29 GLU  QG      4.45 #SUP  0.97  #QF  0.97
 58 GLU  HA     58 GLU  QG      3.67 #SUP  1.00
 58 GLU  QG     72 LEU  HB2     5.50 #SUP  0.95  #QF  0.94
 23 GLU  HG2    24 HIS  HN      5.09 #SUP  0.99  #QF  0.99
 23 GLU  HG2    39 HIST HE1     4.85 #SUP  0.99  #QF  0.99
 23 GLU  HG3    24 HIS  HN      5.09 #SUP  0.95  #QF  0.95
 11 GLU  QG     12 ALA  HN      4.00 #SUP  0.78  #QF  0.53
 23 GLU  HG3    39 HIST HE1     4.85 #SUP  0.91  #QF  0.52
 47 THR  HA     47 THR  QG2     3.07 #SUP  0.99  #QF  0.99
 44 ARG  HB2    49 GLU  HA      4.08 #SUP  0.96  #QF  0.96
 47 THR  HA     67 TYR  QD      5.22 #SUP  0.85  #QF  0.85
 47 THR  HA     71 HIST HB3     5.50 #SUP  0.29  #QF  0.29
 33 VAL  HB     38 PHE  HZ      5.05 #SUP  0.96  #QF  0.66
 33 VAL  HB     66 PHE  HZ      5.35 #SUP  0.96  #QF  0.66
 33 VAL  HB     38 PHE  QE      4.32 #SUP  0.94  #QF  0.94
 33 VAL  HB     38 PHE  QD      4.60 #SUP  0.87  #QF  0.84
 32 CYS  HA     33 VAL  HB      5.12 #SUP  0.84  #QF  0.84
 27 VAL  HA     28 LEU  HG      5.50 #SUP  0.93  #QF  0.37
 33 VAL  HB     34 ASN  HB2     5.50 #SUP  0.92  #QF  0.73
 33 VAL  HB     36 HIS  HB2     5.50 #SUP  0.92  #QF  0.73
 43 PHE  HB3    51 THR  HA      5.50 #SUP  0.92  #QF  0.86
 44 ARG  HD2    51 THR  HA      5.50 #SUP  0.92  #QF  0.86
 44 ARG  HG2    51 THR  HA      4.42 #SUP  0.77  #QF  0.77
 51 THR  HA     51 THR  QG2     3.39 #SUP  0.91  #QF  0.91
 51 THR  HA     52 LEU  HB2     5.28 #SUP  1.00  #QF  0.97
 74 GLN  QG     75 THR  HN      4.61 #SUP  0.99  #QF  0.99
 74 GLN  HA     74 GLN  QG      3.74 #SUP  1.00
 73 PRO  HA     74 GLN  QG      4.66 #SUP  0.97  #QF  0.97
 61 PRO  HA     64 GLY  HN      4.78 #SUP  0.78  #QF  0.78
 27 VAL  HA     30 ARG  HB2     5.50 #SUP  0.98  #QF  0.98
 67 TYR  HB3    71 HIST HB3     4.44 #SUP  0.98  #QF  0.98
 70 GLN  HN     71 HIST HB3     5.50 #SUP  1.00
 48 CYSS HB2    50 ALA  HN      4.84 #SUP  0.89  #QF  0.89
 48 CYSS HN     48 CYSS HB2     4.11 #SUP  0.97  #QF  0.97
 47 THR  QG2    48 CYSS HB2     4.65 #SUP  1.00
 48 CYSS HB3    50 ALA  HN      5.12 #SUP  0.98  #QF  0.98
 25 LEU  QD1    30 ARG  HB3     4.60 #SUP  1.00
 30 ARG  HB3    31 LEU  HN      4.40 #SUP  0.95  #QF  0.95
 30 ARG  HB3    30 ARG  QD      4.02 #SUP  1.00
 25 LEU  QD2    30 ARG  HB3     4.47 #SUP  1.00
 27 VAL  HA     30 ARG  HB3     4.99 #SUP  0.88  #QF  0.88
 25 LEU  HG     30 ARG  HB3     5.15 #SUP  0.69  #QF  0.69
 68 CYSS HB3    71 HIST HB2     4.82 #SUP  0.34  #QF  0.34
 59 GLN  HN     59 GLN  HG3     5.03 #SUP  0.98  #QF  0.98
 36 HIS  HB2    38 PHE  QE      4.28 #SUP  0.97  #QF  0.95
 19 ALA  QB     36 HIS  HB2     4.34 #SUP  1.00
 60 HIS  HB2    67 TYR  QD      3.61 #SUP  0.97  #QF  0.97
 36 HIS  HB3    38 PHE  QE      4.37 #SUP  0.99  #QF  0.99
 73 PRO  HA     74 GLN  HB2     4.28 #SUP  0.84  #QF  0.84
 60 HIS  HB3    67 TYR  QD      3.72 #SUP  0.87  #QF  0.87
 60 HIS  HB2    65 HIS  HB2     5.50 #SUP  0.60  #QF  0.60
 73 PRO  HB3    74 GLN  HN      4.13 #SUP  0.98  #QF  0.98
 45 CYSS HB3    68 CYSS HN      4.53 #SUP  0.93  #QF  0.93
 45 CYSS HB3    49 GLU  HA      4.35 #SUP  1.00
 45 CYSS HB3    49 GLU  QG      5.15 #SUP  0.77  #QF  0.77
 17 LEU  HB3    18 CYSS HB3     4.83 #SUP  0.83  #QF  0.83
 18 CYSS HB3    25 LEU  QD2     4.15 #SUP  1.00
 18 CYSS HB3    25 LEU  QD1     4.84 #SUP  1.00
 45 CYSS HB2    68 CYSS HN      4.19 #SUP  0.92  #QF  0.92
 45 CYSS HB2    46 HIS  HN      5.02 #SUP  0.98  #QF  0.98
 45 CYSS HB2    68 CYSS HA      5.09 #SUP  1.00
 45 CYSS HB2    49 GLU  HA      4.69 #SUP  1.00
 45 CYSS HB2    52 LEU  QD2     3.74 #SUP  1.00
 18 CYSS HB2    39 HIST HN      4.47 #SUP  0.65  #QF  0.65
 18 CYSS HB2    23 GLU  HN      4.50 #SUP  0.93  #QF  0.93
 27 VAL  HN     27 VAL  HB      4.05 #SUP  0.94  #QF  0.92
 18 CYSS HB2    39 HIST HE1     4.13 #SUP  0.97  #QF  0.97
 18 CYSS HB2    38 PHE  HA      4.99 #SUP  0.99  #QF  0.99
 21 CYSS HB2    23 GLU  HG2     4.54 #SUP  1.00
 21 CYSS HB2    23 GLU  HG3     4.54 #SUP  0.98  #QF  0.98
 20 LEU  HB3    21 CYSS HB2     5.50 #SUP  0.89  #QF  0.89
 21 CYSS HB3    23 GLU  HN      5.09 #SUP  0.86  #QF  0.86
 27 VAL  HB     28 LEU  HG      5.10 #SUP  0.95  #QF  0.95
 61 PRO  HB2    62 GLY  HA1     5.46 #SUP  0.98  #QF  0.98
 23 GLU  HN     23 GLU  HB2     3.97 #SUP  0.93  #QF  0.93
 75 THR  HA     75 THR  QG2     3.56 #SUP  1.00
 39 HIST HB2    42 CYSS HB2     4.01 #SUP  1.00
 39 HIST HB3    42 CYSS HA      5.50 #SUP  0.98  #QF  0.98
 39 HIST HB3    42 CYSS HB2     3.97 #SUP  0.99  #QF  0.99
 39 HIST HN     42 CYSS HB3     4.32 #SUP  0.65  #QF  0.65
 39 HIST HB2    42 CYSS HB3     4.19 #SUP  0.99  #QF  0.99
 39 HIST HB3    42 CYSS HB3     5.27 #SUP  1.00
 42 CYSS HB2    43 PHE  HB2     5.50 #SUP  0.85  #QF  0.30
 20 LEU  HB3    42 CYSS HB2     4.54 #SUP  1.00
 39 HIST HB2    42 CYSS HA      4.92 #SUP  1.00
 20 LEU  QD1    42 CYSS HA      5.27 #SUP  1.00
 33 VAL  HA     33 VAL  QG1     3.43 #SUP  0.99  #QF  0.99
 33 VAL  HA     33 VAL  QG2     3.60 #SUP  0.99  #QF  0.99
 42 CYSS HB3    43 PHE  HB2     5.49 #SUP  0.86  #QF  0.86
 38 PHE  HB2    42 CYSS HB2     5.31 #SUP  0.85  #QF  0.85
 29 GLU  HB3    40 ARG  QG      4.85 #SUP  0.53  #QF  0.53
 29 GLU  HB2    40 ARG  QG      5.50 #SUP  0.79  #QF  0.30
 53 TRP  HB2    53 TRP  HD1     3.85 #SUP  0.97  #QF  0.93
 65 HIS  HB3    67 TYR  QE      4.41 #SUP  0.97  #QF  0.93
 65 HIS  HB2    67 TYR  QE      4.17 #SUP  0.75  #QF  0.37
 53 TRP  HB3    54 PRO  HD2     4.14 #SUP  1.00
 53 TRP  HB3    54 PRO  HD3     4.14 #SUP  1.00
 53 TRP  HB2    54 PRO  HD3     4.75 #SUP  0.98  #QF  0.98
 17 LEU  QD2    24 HIS  HB2     4.86 #SUP  1.00
 40 ARG  HA     43 PHE  HB2     4.57 #SUP  0.99  #QF  0.99
 40 ARG  HA     40 ARG  QG      3.58 #SUP  1.00
 31 LEU  QD1    40 ARG  HA      3.94 #SUP  0.98  #QF  0.98
 31 LEU  QD2    40 ARG  HA      3.94 #SUP  0.99  #QF  0.99
 74 GLN  HB3    75 THR  HN      4.08 #SUP  1.00  #QF  0.99
 73 PRO  HA     74 GLN  HB3     5.50 #SUP  0.75  #QF  0.75
 36 HIS  HB2    36 HIS  HD2     3.88 #SUP  0.98  #QF  0.51
 40 ARG  HA     40 ARG  HD3     4.93 #SUP  0.79  #QF  0.79
 40 ARG  HA     43 PHE  HB3     4.52 #SUP  0.98  #QF  0.98
 46 HIS  HB2    47 THR  HN      4.34 #SUP  0.98  #QF  0.98
 46 HIS  HB3    67 TYR  QE      5.11 #SUP  0.78  #QF  0.69
 59 GLN  HB2    66 PHE  QD      4.48 #SUP  0.93  #QF  0.42
 36 HIS  HA     36 HIS  HD2     4.91 #SUP  0.97  #QF  0.97
 34 ASN  HB3    36 HIS  HD2     4.48 #SUP  0.70  #QF  0.70
 41 SER  HA     43 PHE  HN      4.98 #SUP  0.97  #QF  0.97
 41 SER  HA     51 THR  QG2     4.38 #SUP  0.86  #QF  0.86
 57 TYR  HA     68 CYSS HB2     5.03 #SUP  0.99  #QF  0.99
 50 ALA  QB     68 CYSS HB2     4.83 #SUP  0.98  #QF  0.95
 68 CYSS HB2    69 LEU  HG      5.36 #SUP  0.98  #QF  0.95
 52 LEU  QD2    68 CYSS HB2     3.83 #SUP  1.00
 67 TYR  HA     68 CYSS HB3     5.50 #SUP  0.97  #QF  0.64
 50 ALA  QB     68 CYSS HB3     4.46 #SUP  0.89  #QF  0.89
 45 CYSS HA     47 THR  HN      4.79 #SUP  0.98  #QF  0.98
 45 CYSS HA     67 TYR  QD      4.97 #SUP  1.00
 45 CYSS HA     67 TYR  HA      3.68 #SUP  1.00
 45 CYSS HA     67 TYR  HB3     5.37 #SUP  1.00
 45 CYSS HA     46 HIS  HB3     4.72 #SUP  0.98  #QF  0.98
 45 CYSS HA     52 LEU  QD2     3.85 #SUP  1.00
 53 TRP  HA     53 TRP  HE3     4.21 #SUP  1.00
 53 TRP  HE3    54 PRO  HD2     4.34 #SUP  1.00
 53 TRP  HE3    54 PRO  HD3     4.34 #SUP  0.99  #QF  0.99
 53 TRP  HB3    53 TRP  HE3     3.87 #SUP  1.00
 53 TRP  HB2    53 TRP  HE3     4.19 #SUP  1.00
 17 LEU  QD2    24 HIS  HD2     4.51 #SUP  0.99  #QF  0.99
 24 HIS  HN     24 HIS  HD2     5.50 #SUP  0.94  #QF  0.94
 24 HIS  HD2    25 LEU  HN      5.13 #SUP  0.84  #QF  0.84
 46 HIS  HD2    67 TYR  QE      3.91 #SUP  0.65  #QF  0.28
 46 HIS  HA     46 HIS  HD2     4.65 #SUP  0.91  #QF  0.91
 32 CYS  HB3    37 PHE  QD      5.07 #SUP  0.99  #QF  0.99
  9 HIS  HA      9 HIS  HD2     5.01 #SUP  0.96  #QF  0.96
 44 ARG  HD2    49 GLU  HA      4.62 #SUP  0.61  #QF  0.23
 44 ARG  HB3    49 GLU  HA      4.08 #SUP  0.72  #QF  0.72
 32 CYS  HB2    37 PHE  QD      5.07 #SUP  0.95  #QF  0.95
 20 LEU  HG     42 CYSS HB3     4.95 #SUP  0.95  #QF  0.95
 19 ALA  QB     20 LEU  HG      5.50 #SUP  0.95  #QF  0.95
 31 LEU  HA     40 ARG  QG      5.50 #SUP  0.78  #QF  0.48
 39 HIST HA     40 ARG  QG      5.50 #SUP  0.78  #QF  0.48
 29 GLU  QG     40 ARG  QG      5.50 #SUP  0.82  #QF  0.72
 39 HIST HA     39 HIST HD2     4.13 #SUP  0.84  #QF  0.84
 29 GLU  HB3    39 HIST HD2     4.11 #SUP  0.74  #QF  0.74
 29 GLU  HB2    39 HIST HD2     4.55 #SUP  0.95  #QF  0.95
 25 LEU  HB3    39 HIST HD2     4.69 #SUP  0.90  #QF  0.90
 25 LEU  QD1    39 HIST HD2     5.12 #SUP  0.99  #QF  0.99
 25 LEU  QD2    39 HIST HD2     4.40 #SUP  0.94  #QF  0.94
 57 TYR  HB3    68 CYSS HA      4.78 #SUP  0.98  #QF  0.98
 50 ALA  QB     68 CYSS HA      5.50 #SUP  1.00  #QF  0.98
 18 CYSS HA     19 ALA  QB      4.02 #SUP  0.94  #QF  0.94
 17 LEU  HB3    18 CYSS HA      5.50 #SUP  0.96  #QF  0.84
 18 CYSS HA     25 LEU  HB3     5.50 #SUP  0.96  #QF  0.84
 18 CYSS HA     25 LEU  QD1     4.32 #SUP  1.00
 67 TYR  QD     73 PRO  HG2     5.11 #SUP  0.99  #QF  0.99
 72 LEU  HA     73 PRO  HG2     4.55 #SUP  0.99  #QF  0.99
 63 ASP  HA     65 HIS  HD2     5.50 #SUP  0.89  #QF  0.57
 65 HIS  HA     65 HIS  HD2     5.50 #SUP  0.89  #QF  0.57
 63 ASP  HB2    65 HIS  HD2     4.20 #SUP  0.94  #QF  0.94
 63 ASP  HB3    65 HIS  HD2     4.20 #SUP  0.98  #QF  0.98
 18 CYSS HN     24 HIS  HA      4.41 #SUP  0.94  #QF  0.94
 24 HIS  HA     24 HIS  HD2     4.81 #SUP  1.00
 17 LEU  HG     24 HIS  HA      4.81 #SUP  0.83  #QF  0.83
 17 LEU  HB3    24 HIS  HA      4.10 #SUP  0.81  #QF  0.81
 17 LEU  QD2    24 HIS  HA      3.46 #SUP  1.00
 24 HIS  HA     25 LEU  QD1     5.03 #SUP  0.99  #QF  0.99
 24 HIS  HA     25 LEU  QD2     5.50 #SUP  0.99  #QF  0.99
 58 GLU  QG     69 LEU  HA      5.03 #SUP  0.99  #QF  0.99
 60 HIS  HN     67 TYR  QE      5.02 #SUP  0.98  #QF  0.98
 65 HIS  HN     67 TYR  QE      5.05 #SUP  0.93  #QF  0.93
 60 HIS  HA     67 TYR  QE      5.50 #SUP  0.95  #QF  0.95
 60 HIS  HB3    67 TYR  QE      4.18 #SUP  0.91  #QF  0.91
 46 HIS  HB2    67 TYR  QE      4.10 #SUP  0.87  #QF  0.47
 60 HIS  HB2    67 TYR  QE      4.40 #SUP  0.87  #QF  0.47
 47 THR  HN     67 TYR  QE      5.50 #SUP  0.88  #QF  0.77
 66 PHE  HN     67 TYR  QE      5.50 #SUP  0.88  #QF  0.77
 67 TYR  QE     72 LEU  QD1     4.98 #SUP  0.92  #QF  0.92
 65 HIS  HD2    67 TYR  QE      4.95 #SUP  0.71  #QF  0.71
 69 LEU  HA     69 LEU  QD1     3.90 #SUP  0.96  #QF  0.96
 69 LEU  HA     72 LEU  QD2     4.15 #SUP  0.97  #QF  0.97
 44 ARG  HD2    49 GLU  HB2     5.02 #SUP  1.00
 44 ARG  HD2    49 GLU  HB3     5.02 #SUP  1.00
 60 HIS  HA     61 PRO  HG3     4.59 #SUP  1.00
 61 PRO  HG2    62 GLY  HN      5.04 #SUP  1.00
 60 HIS  HA     61 PRO  HG2     4.37 #SUP  0.99  #QF  0.99
 69 LEU  HG     70 GLN  HN      5.50 #SUP  0.61  #QF  0.61
 56 GLY  HA1    69 LEU  HG      5.06 #SUP  0.99  #QF  0.99
 69 LEU  HN     69 LEU  HG      3.83 #SUP  0.99  #QF  0.99
 68 CYSS HA     69 LEU  HG      5.50 #SUP  0.99  #QF  0.99
 69 LEU  HA     69 LEU  HG      3.93 #SUP  1.00
 31 LEU  HN     31 LEU  HG      4.67 #SUP  0.98  #QF  0.98
 31 LEU  HG     38 PHE  HB2     5.50 #SUP  0.97  #QF  0.97
 31 LEU  HG     40 ARG  QG      4.87 #SUP  0.91  #QF  0.91
 31 LEU  HG     40 ARG  HA      4.90 #SUP  0.88  #QF  0.88
 69 LEU  HB2    70 GLN  HA      4.83 #SUP  0.98  #QF  0.98
 70 GLN  HA     70 GLN  HG2     3.96 #SUP  1.00
 70 GLN  HA     70 GLN  HG3     3.96 #SUP  0.99  #QF  0.99
 31 LEU  HG     32 CYS  HN      4.62 #SUP  0.55  #QF  0.55
 44 ARG  HG3    51 THR  HA      4.42 #SUP  0.45  #QF  0.45
 26 TYR  HA     26 TYR  QE      4.56 #SUP  0.97  #QF  0.97
 26 TYR  QE     29 GLU  QG      4.64 #SUP  0.87  #QF  0.87
 26 TYR  QE     28 LEU  HB2     5.07 #SUP  0.92  #QF  0.92
 26 TYR  QE     28 LEU  HB3     5.07 #SUP  0.92  #QF  0.59
 26 TYR  QE     28 LEU  HG      5.28 #SUP  0.92  #QF  0.59
 70 GLN  HG2    71 HIST HD2     5.02 #SUP  0.98  #QF  0.98
 70 GLN  HG3    71 HIST HD2     5.02 #SUP  0.98  #QF  0.98
 71 HIST HN     71 HIST HD2     4.63 #SUP  0.96  #QF  0.96
 71 HIST HA     71 HIST HD2     3.15 #SUP  0.84  #QF  0.84
 47 THR  QG2    71 HIST HD2     4.58 #SUP  0.92  #QF  0.92
 60 HIS  HA     60 HIS  HD2     4.79 #SUP  0.97  #QF  0.97
 60 HIS  HD2    73 PRO  HD2     4.53 #SUP  1.00
 60 HIS  HD2    73 PRO  HD3     4.90 #SUP  0.30  #QF  0.30
 60 HIS  HD2    72 LEU  HG      4.60 #SUP  0.91  #QF  0.91
 60 HIS  HD2    73 PRO  HB2     4.41 #SUP  0.93  #QF  0.93
 60 HIS  HD2    72 LEU  QD1     4.09 #SUP  0.99  #QF  0.99
 17 LEU  HG     18 CYSS HN      5.41 #SUP  0.97  #QF  0.97
 16 ASP  HA     17 LEU  HG      5.02 #SUP  0.99  #QF  0.99
 16 ASP  QB     17 LEU  HG      4.88 #SUP  0.94  #QF  0.94
 18 CYSS HN     25 LEU  HG      4.95 #SUP  0.98  #QF  0.98
 25 LEU  HN     25 LEU  HG      4.29 #SUP  0.97  #QF  0.97
 25 LEU  HG     37 PHE  HB2     5.02 #SUP  0.97  #QF  0.97
 25 LEU  HG     30 ARG  HB2     5.26 #SUP  0.87  #QF  0.87
 54 PRO  HB3    57 TYR  QE      5.18 #SUP  0.94  #QF  0.94
 52 LEU  HB2    57 TYR  QE      5.50 #SUP  0.98  #QF  0.27
 43 PHE  QE     57 TYR  QE      4.34 #SUP  1.00
 43 PHE  HZ     57 TYR  QE      4.34 #SUP  0.99  #QF  0.99
 54 PRO  HA     57 TYR  QE      3.55 #SUP  0.85  #QF  0.85
 54 PRO  HB2    57 TYR  QE      5.18 #SUP  0.98  #QF  0.98
 33 VAL  QG1    57 TYR  QE      3.90 #SUP  0.98  #QF  0.98
 33 VAL  QG2    57 TYR  QE      5.00 #SUP  0.98  #QF  0.98
 42 CYSS HN     43 PHE  HA      5.50 #SUP  1.00  #QF  0.98
 43 PHE  HA     52 LEU  HN      5.50 #SUP  1.00  #QF  0.98
 43 PHE  HA     43 PHE  QD      3.53 #SUP  0.98  #QF  0.98
 43 PHE  HA     43 PHE  QE      4.94 #SUP  0.96  #QF  0.96
 20 LEU  QD2    43 PHE  HA      4.77 #SUP  0.82  #QF  0.77
 43 PHE  HA     52 LEU  HB2     5.50 #SUP  0.91  #QF  0.74
 72 LEU  HN     72 LEU  HG      4.49 #SUP  0.89  #QF  0.89
 72 LEU  HG     74 GLN  QG      5.50 #SUP  0.99  #QF  0.99
 67 TYR  HA     67 TYR  QD      3.87 #SUP  1.00
 67 TYR  HA     72 LEU  HA      5.19 #SUP  0.64  #QF  0.64
 67 TYR  HA     71 HIST HB2     5.04 #SUP  1.00
 45 CYSS HB2    67 TYR  HA      4.57 #SUP  0.91  #QF  0.88
 46 HIS  HB2    67 TYR  HA      5.04 #SUP  0.91  #QF  0.88
 46 HIS  HB3    67 TYR  HA      4.99 #SUP  0.98  #QF  0.83
 66 PHE  HB3    67 TYR  HA      5.50 #SUP  0.98  #QF  0.83
 67 TYR  HA     72 LEU  QD1     4.87 #SUP  1.00
 52 LEU  QD2    67 TYR  HA      4.52 #SUP  1.00
 45 CYSS HB2    52 LEU  HG      5.04 #SUP  0.67  #QF  0.67
 51 THR  HA     52 LEU  HG      4.86 #SUP  0.94  #QF  0.94
 60 HIS  HB3    72 LEU  QD2     5.50 #SUP  0.91  #QF  0.91
 72 LEU  HN     72 LEU  QD2     4.42 #SUP  0.67  #QF  0.67
 60 HIS  HA     72 LEU  QD2     4.93 #SUP  0.94  #QF  0.94
 58 GLU  HA     72 LEU  QD2     4.96 #SUP  1.00
 72 LEU  HA     72 LEU  QD2     3.98 #SUP  1.00
 61 PRO  HD2    72 LEU  QD2     4.86 #SUP  0.55  #QF  0.55
 60 HIS  HB2    72 LEU  QD2     4.70 #SUP  0.99  #QF  0.99
 67 TYR  HB2    72 LEU  QD2     4.60 #SUP  0.98  #QF  0.98
 72 LEU  QD2    73 PRO  HD2     4.55 #SUP  0.90  #QF  0.90
 58 GLU  QG     72 LEU  QD2     3.53 #SUP  1.00
 58 GLU  HB2    72 LEU  QD2     3.62 #SUP  0.99  #QF  0.99
 11 GLU  HA     11 GLU  QG      3.85 #SUP  0.98  #QF  0.98
 11 GLU  HA     12 ALA  QB      4.77 #SUP  0.97  #QF  0.97
 30 ARG  HN     30 ARG  HG2     4.83 #SUP  1.00
 25 LEU  QD2    30 ARG  HG2     5.22 #SUP  1.00
 30 ARG  HG2    31 LEU  HN      4.97 #SUP  0.98  #QF  0.98
 25 LEU  QD1    30 ARG  HG2     5.43 #SUP  1.00
 30 ARG  HG3    31 LEU  HN      4.97 #SUP  0.98  #QF  0.98
 25 LEU  QD1    30 ARG  HG3     5.43 #SUP  1.00
 25 LEU  QD2    30 ARG  HG3     5.22 #SUP  1.00
 37 PHE  HA     37 PHE  QD      3.99 #SUP  0.99  #QF  0.99
 32 CYS  HA     37 PHE  HA      3.98 #SUP  0.95  #QF  0.95
 25 LEU  QD2    37 PHE  HA      4.94 #SUP  1.00
 28 LEU  HA     28 LEU  HG      3.76 #SUP  1.00
 25 LEU  QD1    30 ARG  HA      3.93 #SUP  0.90  #QF  0.90
 25 LEU  QD1    37 PHE  HB2     3.84 #SUP  0.99  #QF  0.70
 25 LEU  QD1    37 PHE  HB3     4.03 #SUP  1.00
 25 LEU  HB2    25 LEU  QD1     3.83 #SUP  0.97  #QF  0.97
 58 GLU  QG     69 LEU  QD1     4.70 #SUP  0.96  #QF  0.96
 31 LEU  HN     31 LEU  QD2     4.80 #SUP  0.82  #QF  0.82
 31 LEU  QD2    43 PHE  QD      4.82 #SUP  0.99  #QF  0.99
 31 LEU  HA     31 LEU  QD2     4.06 #SUP  0.99  #QF  0.99
 31 LEU  QD2    43 PHE  HB3     4.58 #SUP  1.00
 31 LEU  QD2    43 PHE  HB2     4.41 #SUP  0.96  #QF  0.96
 31 LEU  QD2    40 ARG  QG      4.16 #SUP  0.99  #QF  0.99
 31 LEU  HB2    31 LEU  QD2     4.08 #SUP  1.00
 25 LEU  QD1    37 PHE  QD      4.86 #SUP  1.00
 17 LEU  HA     25 LEU  QD1     4.99 #SUP  0.96  #QF  0.96
 18 CYSS HB2    25 LEU  QD1     4.30 #SUP  0.92  #QF  0.92
 25 LEU  QD1    30 ARG  HB2     4.31 #SUP  0.84  #QF  0.84
 17 LEU  HB2    25 LEU  QD1     4.72 #SUP  0.81  #QF  0.81
 16 ASP  HA     25 LEU  QD1     4.61 #SUP  0.95  #QF  0.95
 10 GLN  HA     10 GLN  QG      3.66 #SUP  0.97  #QF  0.97
 28 LEU  HA     28 LEU  QD1     3.98 #SUP  0.98  #QF  0.98
 20 LEU  QD1    43 PHE  HA      4.77 #SUP  0.99  #QF  0.99
 20 LEU  QD1    42 CYSS HB3     4.09 #SUP  1.00
 20 LEU  QD1    42 CYSS HB2     4.49 #SUP  1.00
 20 LEU  HB3    20 LEU  QD1     3.91 #SUP  1.00
 20 LEU  HB2    20 LEU  QD1     3.79 #SUP  1.00
 17 LEU  QD1    18 CYSS HN      5.11 #SUP  0.91  #QF  0.91
 17 LEU  HA     17 LEU  QD1     4.21 #SUP  1.00
 17 LEU  QD1    24 HIS  HA      4.69 #SUP  0.84  #QF  0.84
 17 LEU  QD1    22 GLY  HA2     4.86 #SUP  0.99  #QF  0.99
 17 LEU  HB2    17 LEU  QD1     3.23 #SUP  0.94  #QF  0.62
 57 TYR  HA     67 TYR  HN      5.50 #SUP  0.88  #QF  0.88
 57 TYR  HA     68 CYSS HA      3.79 #SUP  1.00
 57 TYR  HA     69 LEU  QD1     4.99 #SUP  0.99  #QF  0.99
 52 LEU  QD2    57 TYR  HA      4.05 #SUP  1.00
 57 TYR  HA     69 LEU  HG      4.39 #SUP  1.00
 73 PRO  HB2    74 GLN  HA      5.32 #SUP  1.00
 74 GLN  HA     75 THR  QG2     5.50 #SUP  1.00
 31 LEU  QD1    43 PHE  QD      4.82 #SUP  0.97  #QF  0.97
 31 LEU  HA     31 LEU  QD1     4.06 #SUP  0.98  #QF  0.98
 31 LEU  QD1    43 PHE  HB3     4.58 #SUP  0.98  #QF  0.98
 31 LEU  QD1    43 PHE  HB2     4.41 #SUP  0.80  #QF  0.80
 31 LEU  QD1    40 ARG  QG      4.16 #SUP  0.99  #QF  0.99
 31 LEU  HB2    31 LEU  QD1     4.08 #SUP  1.00
 31 LEU  QD1    33 VAL  QG2     4.82 #SUP  0.99  #QF  0.99
 19 ALA  HN     25 LEU  QD2     4.58 #SUP  0.98  #QF  0.98
 25 LEU  QD2    30 ARG  HA      4.05 #SUP  0.97  #QF  0.89
 18 CYSS HA     25 LEU  QD2     3.70 #SUP  0.71  #QF  0.71
 25 LEU  QD2    37 PHE  HB2     4.08 #SUP  0.98  #QF  0.98
 25 LEU  QD2    37 PHE  HB3     3.98 #SUP  1.00
 16 ASP  QB     25 LEU  QD2     5.50 #SUP  0.99  #QF  0.99
 18 CYSS HB2    25 LEU  QD2     3.88 #SUP  1.00
 25 LEU  QD2    30 ARG  HB2     4.16 #SUP  0.85  #QF  0.85
 25 LEU  HB2    25 LEU  QD2     3.61 #SUP  0.98  #QF  0.98
 17 LEU  HA     25 LEU  QD2     4.99 #SUP  0.98  #QF  0.98
 38 PHE  HA     38 PHE  QD      4.12 #SUP  0.99  #QF  0.99
 18 CYSS HA     38 PHE  HA      3.87 #SUP  1.00
 38 PHE  HA     39 HIST HB2     4.99 #SUP  0.96  #QF  0.96
 25 LEU  QD2    38 PHE  HA      4.08 #SUP  1.00
 25 LEU  QD1    38 PHE  HA      4.73 #SUP  0.99  #QF  0.99
 67 TYR  QD     72 LEU  QD1     3.53 #SUP  1.00
 60 HIS  HA     72 LEU  QD1     3.92 #SUP  0.98  #QF  0.98
 60 HIS  HB3    72 LEU  QD1     4.15 #SUP  0.99  #QF  0.99
 72 LEU  HA     72 LEU  QD1     3.46 #SUP  1.00
 67 TYR  HB3    72 LEU  QD1     3.94 #SUP  0.99  #QF  0.99
 60 HIS  HB2    72 LEU  QD1     3.82 #SUP  1.00
 67 TYR  HB2    72 LEU  QD1     3.78 #SUP  1.00
 72 LEU  QD1    73 PRO  HD2     3.74 #SUP  1.00
 58 GLU  QG     72 LEU  QD1     4.10 #SUP  0.98  #QF  0.98
 58 GLU  HB2    72 LEU  QD1     3.75 #SUP  0.97  #QF  0.97
 58 GLU  HB3    72 LEU  QD1     3.75 #SUP  0.96  #QF  0.96
 72 LEU  HB2    72 LEU  QD1     3.50 #SUP  1.00
 69 LEU  HA     72 LEU  QD1     4.54 #SUP  0.93  #QF  0.93
 52 LEU  QD1    66 PHE  QD      4.39 #SUP  0.90  #QF  0.90
 43 PHE  QD     52 LEU  QD1     4.67 #SUP  0.89  #QF  0.89
 52 LEU  QD1    57 TYR  HA      4.71 #SUP  1.00
 43 PHE  QE     52 LEU  QD1     4.52 #SUP  0.99  #QF  0.99
 52 LEU  HA     52 LEU  QD1     4.66 #SUP  0.98  #QF  0.98
 52 LEU  QD1    57 TYR  HB2     3.91 #SUP  0.95  #QF  0.95
 52 LEU  QD1    57 TYR  HB3     4.09 #SUP  0.97  #QF  0.97
 52 LEU  QD1    66 PHE  HB3     3.79 #SUP  1.00
 52 LEU  HB2    52 LEU  QD1     3.53 #SUP  1.00  #QF  0.95
 52 LEU  HB3    52 LEU  QD1     3.93 #SUP  0.99  #QF  0.99
 19 ALA  QB     38 PHE  HA      4.76 #SUP  0.98  #QF  0.98
 18 CYSS HB3    38 PHE  HA      4.79 #SUP  0.99  #QF  0.99
 38 PHE  HA     42 CYSS HB2     5.08 #SUP  0.97  #QF  0.97
 36 HIS  HA     37 PHE  HB2     4.93 #SUP  0.95  #QF  0.95
 20 LEU  QD2    42 CYSS HA      5.27 #SUP  1.00
 20 LEU  QD2    42 CYSS HB3     4.09 #SUP  0.99  #QF  0.99
 20 LEU  QD2    42 CYSS HB2     4.49 #SUP  0.99  #QF  0.99
 20 LEU  HB3    20 LEU  QD2     3.91 #SUP  1.00
 20 LEU  HB2    20 LEU  QD2     3.79 #SUP  1.00
 16 ASP  HA     25 LEU  HB3     5.50 #SUP  0.85  #QF  0.85
 19 ALA  QB     36 HIS  HA      5.09 #SUP  1.00
 18 CYSS HN     25 LEU  HA      4.98 #SUP  0.78  #QF  0.35
 19 ALA  HA     22 GLY  HN      5.46 #SUP  0.78  #QF  0.35
 25 LEU  HA     39 HIST HD2     4.60 #SUP  0.48  #QF  0.48
 25 LEU  HA     25 LEU  QD1     3.90 #SUP  0.99  #QF  0.99
 25 LEU  HA     25 LEU  QD2     3.76 #SUP  0.99  #QF  0.99
 51 THR  HB     53 TRP  HZ2     4.90 #SUP  0.98  #QF  0.98
 51 THR  QG2    53 TRP  HZ2     4.35 #SUP  0.96  #QF  0.96
 28 LEU  HA     28 LEU  QD2     3.98 #SUP  1.00
 28 LEU  HB2    28 LEU  QD2     3.70 #SUP  0.99  #QF  0.99
 28 LEU  HB3    28 LEU  QD2     3.70 #SUP  0.99  #QF  0.68
 17 LEU  HA     25 LEU  HB2     4.90 #SUP  0.73  #QF  0.73
 60 HIS  HB2    72 LEU  HA      4.99 #SUP  1.00
 72 LEU  HA     73 PRO  HD2     3.36 #SUP  1.00
 72 LEU  HA     73 PRO  HD3     3.57 #SUP  1.00
 72 LEU  HA     72 LEU  HG      4.22 #SUP  1.00
 72 LEU  HA     73 PRO  HG3     4.55 #SUP  1.00
 17 LEU  HA     18 CYSS HB2     4.92 #SUP  0.98  #QF  0.98
 17 LEU  HA     18 CYSS HB3     4.78 #SUP  0.99  #QF  0.99
 45 CYSS HB3    50 ALA  HA      5.04 #SUP  0.75  #QF  0.75
 52 LEU  HN     52 LEU  QD2     4.14 #SUP  0.96  #QF  0.96
 52 LEU  QD2    66 PHE  QD      5.50 #SUP  0.99  #QF  0.99
 52 LEU  QD2    68 CYSS HA      3.55 #SUP  1.00
 52 LEU  HA     52 LEU  QD2     3.32 #SUP  0.98  #QF  0.98
 45 CYSS HB3    52 LEU  QD2     3.86 #SUP  0.99  #QF  0.99
 52 LEU  QD2    68 CYSS HB3     3.17 #SUP  0.94  #QF  0.94
 52 LEU  QD2    57 TYR  HB3     3.76 #SUP  1.00
 52 LEU  QD2    66 PHE  HB3     4.81 #SUP  0.98  #QF  0.98
 50 ALA  QB     52 LEU  QD2     4.09 #SUP  1.00
 51 THR  HA     52 LEU  QD2     4.79 #SUP  0.89  #QF  0.89
 17 LEU  QD2    18 CYSS HN      4.17 #SUP  0.94  #QF  0.94
 16 ASP  QB     17 LEU  QD2     4.95 #SUP  0.98  #QF  0.98
 50 ALA  HA     51 THR  QG2     5.50 #SUP  0.95  #QF  0.95
 51 THR  QG2    52 LEU  HN      4.08 #SUP  0.93  #QF  0.93
 43 PHE  HB3    51 THR  QG2     5.03 #SUP  0.74  #QF  0.74
 51 THR  QG2    52 LEU  HB2     4.87 #SUP  0.66  #QF  0.66
 16 ASP  HN     17 LEU  QD2     4.88 #SUP  1.00  #QF  0.32
 17 LEU  HA     17 LEU  QD2     3.52 #SUP  1.00
 17 LEU  QD2    25 LEU  HA      5.50 #SUP  0.94  #QF  0.24
 17 LEU  QD2    25 LEU  QD1     4.20 #SUP  0.97  #QF  0.97
 17 LEU  QD2    24 HIS  HB3     4.86 #SUP  0.99  #QF  0.99
 51 THR  QG2    53 TRP  HH2     4.93 #SUP  0.96  #QF  0.89
 61 PRO  HD2    75 THR  QG2     5.00 #SUP  0.93  #QF  0.93
 61 PRO  HG2    75 THR  QG2     4.81 #SUP  0.99  #QF  0.34
 61 PRO  HG3    75 THR  QG2     4.82 #SUP  0.99  #QF  0.99
 69 LEU  HA     69 LEU  QD2     3.90 #SUP  1.00
 57 TYR  HA     69 LEU  QD2     4.99 #SUP  1.00
 58 GLU  QG     69 LEU  QD2     4.70 #SUP  0.99  #QF  0.99
 69 LEU  HB2    69 LEU  QD2     3.46 #SUP  0.98  #QF  0.98
 47 THR  HN     47 THR  QG2     3.87 #SUP  0.95  #QF  0.95
 47 THR  QG2    71 HIST HA      4.65 #SUP  0.99  #QF  0.99
 47 THR  QG2    71 HIST HB3     3.92 #SUP  1.00
 47 THR  QG2    71 HIST HB2     4.26 #SUP  1.00
 47 THR  QG2    48 CYSS HB3     3.98 #SUP  1.00
 33 VAL  QG1    66 PHE  QE      4.00 #SUP  0.99  #QF  0.99
 33 VAL  QG1    66 PHE  HZ      3.91 #SUP  0.99  #QF  0.30
 33 VAL  QG1    38 PHE  QE      4.40 #SUP  0.95  #QF  0.95
 33 VAL  QG1    43 PHE  QE      4.12 #SUP  0.99  #QF  0.99
 33 VAL  QG1    43 PHE  HZ      3.97 #SUP  0.99  #QF  0.99
 33 VAL  QG1    34 ASN  HB3     4.66 #SUP  0.97  #QF  0.97
 33 VAL  QG1    34 ASN  HB2     4.13 #SUP  0.87  #QF  0.87
 53 TRP  HB2    54 PRO  HD2     4.75 #SUP  0.98  #QF  0.98
 53 TRP  HA     54 PRO  HD2     3.98 #SUP  1.00
 53 TRP  HA     54 PRO  HD3     3.98 #SUP  1.00
 61 PRO  HD3    62 GLY  HN      4.76 #SUP  0.91  #QF  0.91
 60 HIS  HB2    61 PRO  HD2     4.82 #SUP  1.00
 49 GLU  HA     50 ALA  QB      4.89 #SUP  0.87  #QF  0.68
 50 ALA  QB     51 THR  HA      5.23 #SUP  0.87  #QF  0.68
 45 CYSS HB3    50 ALA  QB      4.03 #SUP  0.99  #QF  0.99
 45 CYSS HB2    50 ALA  QB      4.08 #SUP  0.96  #QF  0.94
 50 ALA  QB     52 LEU  HG      4.76 #SUP  0.66  #QF  0.66
 61 PRO  HD3    72 LEU  QD1     4.86 #SUP  0.97  #QF  0.97
 60 HIS  HA     61 PRO  HD3     3.24 #SUP  0.99  #QF  0.99
 60 HIS  HA     61 PRO  HD2     3.30 #SUP  0.99  #QF  0.99
 61 PRO  HD2    62 GLY  HN      4.70 #SUP  0.98  #QF  0.98
 60 HIS  HB3    61 PRO  HD2     4.60 #SUP  1.00
 61 PRO  HD2    72 LEU  QD1     4.97 #SUP  0.99  #QF  0.99
 67 TYR  QD     73 PRO  HD2     4.07 #SUP  0.99  #QF  0.99
 60 HIS  HB2    73 PRO  HD2     4.75 #SUP  1.00
 72 LEU  HG     73 PRO  HD2     4.32 #SUP  1.00  #QF  0.35
 67 TYR  HB3    73 PRO  HD2     4.86 #SUP  0.99  #QF  0.99
 67 TYR  QD     73 PRO  HD3     4.28 #SUP  1.00
 60 HIS  HB3    73 PRO  HD3     5.34 #SUP  1.00
 60 HIS  HB2    73 PRO  HD3     4.58 #SUP  0.99  #QF  0.99
 72 LEU  HG     73 PRO  HD3     4.30 #SUP  1.00
 72 LEU  QD1    73 PRO  HD3     4.26 #SUP  1.00
 33 VAL  QG2    38 PHE  HZ      5.50 #SUP  0.89  #QF  0.38
 33 VAL  QG2    66 PHE  HZ      5.50 #SUP  0.89  #QF  0.38
 33 VAL  QG2    38 PHE  QE      4.48 #SUP  0.99  #QF  0.99
 33 VAL  QG2    38 PHE  QD      4.15 #SUP  1.00  #QF  0.98
 33 VAL  QG2    43 PHE  QD      4.90 #SUP  0.99  #QF  0.99
 33 VAL  QG2    43 PHE  QE      4.27 #SUP  0.99  #QF  0.99
 33 VAL  QG2    43 PHE  HZ      4.28 #SUP  0.99  #QF  0.99
 32 CYS  HA     33 VAL  QG2     4.87 #SUP  0.92  #QF  0.92
 33 VAL  QG2    34 ASN  HB2     5.50 #SUP  0.94  #QF  0.71
 33 VAL  QG2    36 HIS  HB2     5.50 #SUP  0.94  #QF  0.71
 33 VAL  QG2    43 PHE  HB2     5.14 #SUP  0.82  #QF  0.82
 31 LEU  HG     33 VAL  QG2     4.33 #SUP  0.90  #QF  0.90
 31 LEU  QD2    33 VAL  QG2     4.82 #SUP  0.96  #QF  0.96
 14 ALA  QB     15 GLY  QA      5.04 #SUP  0.98  #QF  0.98
 14 ALA  QB     16 ASP  HN      5.02 #SUP  0.87  #QF  0.87
 11 GLU  QG     12 ALA  QB      4.65 #SUP  0.90  #QF  0.90
 14 ALA  QB     16 ASP  QB      4.35 #SUP  0.49  #QF  0.49
 19 ALA  QB     38 PHE  HZ      4.16 #SUP  0.99  #QF  0.99
 19 ALA  QB     38 PHE  QE      3.76 #SUP  0.99  #QF  0.99
 19 ALA  QB     38 PHE  QD      4.13 #SUP  0.98  #QF  0.98
 19 ALA  QB     36 HIS  HB3     3.80 #SUP  0.99  #QF  0.99
 19 ALA  QB     20 LEU  HB2     4.89 #SUP  0.98  #QF  0.98
 45 CYSS HA     52 LEU  QD1     3.91 #SUP  1.00
 45 CYSS HB2    52 LEU  QD1     4.83 #SUP  1.00
 45 CYSS HB3    52 LEU  QD1     5.16 #SUP  0.99  #QF  0.99
 52 LEU  HA     53 TRP  HB2     5.17 #SUP  0.84  #QF  0.84
 59 GLN  HE21   64 GLY  HA2     4.22 #SUP  0.96  #QF  0.96
 59 GLN  HE21   64 GLY  HA1     4.22 #SUP  0.97  #QF  0.97
 66 PHE  HA     67 TYR  QD      4.62 #SUP  0.46  #QF  0.46
 52 LEU  QD1    66 PHE  HB2     3.97 #SUP  1.00
 52 LEU  QD1    67 TYR  HA      4.74 #SUP  0.99  #QF  0.99
 52 LEU  QD1    68 CYSS HA      4.95 #SUP  1.00
 28 LEU  HB2    28 LEU  QD1     3.70 #SUP  0.98  #QF  0.26
 69 LEU  HB3    69 LEU  QD1     3.37 #SUP  0.99  #QF  0.55
 69 LEU  HB3    69 LEU  QD2     3.37 #SUP  1.00  #QF  0.90
 72 LEU  HB2    72 LEU  QD2     3.39 #SUP  0.98  #QF  0.98
 72 LEU  HB3    72 LEU  QD2     2.90 #SUP  1.00  #QF  0.94
 58 GLU  HB3    72 LEU  QD2     3.62 #SUP  0.99  #QF  0.99
 52 LEU  QD1    57 TYR  QD      4.11 #SUP  1.00
 70 GLN  HB2    71 HIST HD2     5.50 #SUP  0.99  #QF  0.99
 70 GLN  HB3    71 HIST HD2     5.50 #SUP  0.97  #QF  0.97
 19 ALA  QB     36 HIS  HD2     5.50 #SUP  0.97  #QF  0.97
 52 LEU  QD2    53 TRP  HD1     5.07 #SUP  0.92  #QF  0.92
 43 PHE  QE     52 LEU  HB3     5.15 #SUP  0.98  #QF  0.98
 52 LEU  QD1    57 TYR  QE      5.12 #SUP  1.00
 12 ALA  QB     13 GLY  HA2     5.31 #SUP  1.00  #QF  0.96
 13 GLY  HA2    14 ALA  QB      5.50 #SUP  1.00  #QF  0.96
 52 LEU  QD1    66 PHE  QE      5.36 #SUP  0.98  #QF  0.98
 59 GLN  HB3    66 PHE  HZ      5.30 #SUP  0.87  #QF  0.87
 59 GLN  HB2    66 PHE  HZ      5.30 #SUP  0.99  #QF  0.99
 34 ASN  HB3    66 PHE  HZ      5.34 #SUP  0.76  #QF  0.76
 15 GLY  QA     17 LEU  HG      5.50 #SUP  0.96  #QF  0.95
 57 TYR  HA     69 LEU  HA      5.12 #SUP  0.99  #QF  0.99
  9 HIS  HA     10 GLN  QB      5.34 
 11 GLU  QB     12 ALA  QB      4.73 
 12 ALA  QB     13 GLY  QA      4.62 
 17 LEU  HB2    22 GLY  QA      4.32 
 17 LEU  HB3    22 GLY  QA      4.10 
 17 LEU  QD1    22 GLY  QA      4.04 
 17 LEU  QD2    22 GLY  QA      5.34 
 18 CYSS HN     22 GLY  QA      4.68 
 19 ALA  HN     20 LEU  QQD     5.13 
 19 ALA  HA     20 LEU  QQD     5.28 
 20 LEU  QQD    21 CYSS HN      4.01 
 20 LEU  QQD    38 PHE  HB3     4.71 
 20 LEU  QQD    38 PHE  QD      4.63 
 20 LEU  QQD    42 CYSS HN      5.42 
 20 LEU  QQD    42 CYSS HA      4.52 
 20 LEU  QQD    42 CYSS HB2     3.75 
 20 LEU  QQD    42 CYSS HB3     3.58 
 20 LEU  QQD    43 PHE  HN      4.31 
 20 LEU  QQD    43 PHE  HA      4.04 
 20 LEU  QQD    43 PHE  QD      4.87 
 20 LEU  QQD    44 ARG  HN      4.72 
 21 CYSS HN     22 GLY  QA      4.46 
 21 CYSS HB3    23 GLU  QG      4.50 
 23 GLU  HN     23 GLU  QB      3.14 
 23 GLU  HN     23 GLU  QG      3.52 
 23 GLU  QB     24 HIS  HN      3.06 
 23 GLU  QB     24 HIS  QB      4.27 
 23 GLU  QB     39 HIST HE1     3.11 
 23 GLU  QG     24 HIS  HN      4.33 
 23 GLU  QG     39 HIST HE1     4.14 
 24 HIS  HN     24 HIS  QB      2.91 
 24 HIS  QB     25 LEU  HN      3.78 
 25 LEU  QD1    30 ARG  QG      4.60 
 25 LEU  QD2    30 ARG  QG      4.56 
 25 LEU  QD2    31 LEU  QB      5.34 
 26 TYR  HA     27 VAL  QQG     4.77 
 26 TYR  QB     27 VAL  HN      4.03 
 26 TYR  QB     27 VAL  QQG     4.21 
 26 TYR  QB     29 GLU  HN      5.25 
 26 TYR  QB     29 GLU  HB2     4.88 
 26 TYR  QD     27 VAL  QQG     4.73 
 26 TYR  QD     28 LEU  QQD     4.21 
 26 TYR  QE     28 LEU  QB      4.34 
 26 TYR  QE     28 LEU  QQD     4.15 
 27 VAL  HN     27 VAL  QQG     3.77 
 27 VAL  HA     30 ARG  QG      4.55 
 27 VAL  HB     28 LEU  QQD     5.44 
 27 VAL  QQG    28 LEU  HN      3.83 
 27 VAL  QQG    28 LEU  HA      4.38 
 27 VAL  QQG    28 LEU  HG      3.84 
 27 VAL  QQG    29 GLU  HN      4.71 
 27 VAL  QQG    29 GLU  QG      5.02 
 27 VAL  QQG    30 ARG  QG      4.85 
 27 VAL  QQG    30 ARG  QD      4.44 
 28 LEU  HN     28 LEU  QB      3.42 
 28 LEU  HN     28 LEU  QQD     4.61 
 28 LEU  HA     28 LEU  QQD     2.98 
 28 LEU  QB     28 LEU  QQD     2.72 
 28 LEU  QB     29 GLU  HN      3.91 
 28 LEU  QB     29 GLU  HA      4.74 
 28 LEU  QB     29 GLU  HB2     5.34 
 28 LEU  QB     29 GLU  QG      3.86 
 28 LEU  QQD    29 GLU  HN      4.89 
 29 GLU  HB3    40 ARG  QB      5.34 
 29 GLU  QG     40 ARG  QB      5.34 
 30 ARG  HN     30 ARG  QG      4.24 
 30 ARG  QG     31 LEU  QB      5.18 
 30 ARG  QG     32 CYS  HN      5.05 
 30 ARG  QG     37 PHE  HB3     5.32 
 30 ARG  QG     38 PHE  HN      5.34 
 31 LEU  HN     31 LEU  QB      3.18 
 31 LEU  HN     31 LEU  QQD     4.16 
 31 LEU  HA     31 LEU  QQD     3.45 
 31 LEU  HA     32 CYS  QB      4.85 
 31 LEU  QB     32 CYS  HN      4.02 
 31 LEU  QB     33 VAL  HB      5.34 
 31 LEU  QB     33 VAL  QG2     4.14 
 31 LEU  QB     37 PHE  HB3     5.34 
 31 LEU  QB     38 PHE  HN      4.12 
 31 LEU  QB     40 ARG  HA      4.46 
 31 LEU  QB     40 ARG  QG      4.58 
 31 LEU  QQD    32 CYS  HN      4.71 
 31 LEU  QQD    33 VAL  QG2     3.72 
 31 LEU  QQD    38 PHE  HB2     4.75 
 31 LEU  QQD    38 PHE  HB3     4.90 
 31 LEU  QQD    38 PHE  QD      5.01 
 31 LEU  QQD    40 ARG  HA      3.45 
 31 LEU  QQD    40 ARG  QB      4.57 
 31 LEU  QQD    40 ARG  QD      4.38 
 31 LEU  QQD    43 PHE  HN      4.52 
 31 LEU  QQD    43 PHE  HA      5.38 
 31 LEU  QQD    43 PHE  HB2     3.73 
 31 LEU  QQD    43 PHE  HB3     3.86 
 31 LEU  QQD    43 PHE  QD      3.88 
 31 LEU  QQD    43 PHE  QE      4.82 
 31 LEU  QQD    43 PHE  HZ      5.44 
 31 LEU  QQD    57 TYR  QE      5.44 
 32 CYS  HN     32 CYS  QB      3.33 
 32 CYS  QB     33 VAL  HN      3.77 
 32 CYS  QB     37 PHE  QD      4.26 
 32 CYS  QB     37 PHE  HZ      4.08 
 33 VAL  QG1    34 ASN  QD2     4.24 
 34 ASN  HA     34 ASN  QD2     4.93 
 34 ASN  HB2    34 ASN  QD2     3.47 
 34 ASN  QD2    59 GLN  QB      4.29 
 39 HIST HA     40 ARG  QB      5.34 
 40 ARG  HN     40 ARG  QD      4.87 
 40 ARG  HA     40 ARG  QD      4.22 
 40 ARG  QB     42 CYSS HN      5.34 
 41 SER  QB     42 CYSS HN      4.07 
 43 PHE  HN     44 ARG  QG      4.67 
 43 PHE  HA     44 ARG  QG      4.54 
 44 ARG  HN     44 ARG  QG      3.51 
 44 ARG  QB     45 CYSS HN      3.34 
 44 ARG  QB     45 CYSS HB3     4.77 
 44 ARG  QB     49 GLU  HN      4.52 
 44 ARG  QB     49 GLU  HA      3.38 
 44 ARG  QB     49 GLU  QB      4.45 
 44 ARG  QB     49 GLU  QG      4.70 
 44 ARG  QB     50 ALA  HN      4.37 
 44 ARG  QB     51 THR  HN      5.34 
 44 ARG  QB     52 LEU  HN      5.05 
 44 ARG  QG     49 GLU  QB      4.82 
 44 ARG  QG     51 THR  HA      3.60 
 44 ARG  QG     52 LEU  HN      5.34 
 44 ARG  HD2    49 GLU  QB      4.34 
 45 CYSS HN     49 GLU  QB      5.34 
 48 CYSS HN     49 GLU  QB      5.12 
 49 GLU  HN     49 GLU  QB      3.56 
 52 LEU  QD2    69 LEU  QQD     4.82 
 53 TRP  HN     54 PRO  QD      4.49 
 53 TRP  HA     54 PRO  QG      4.86 
 53 TRP  HB2    54 PRO  QD      3.97 
 53 TRP  HB3    54 PRO  QD      3.57 
 53 TRP  HE3    54 PRO  QD      3.76 
 54 PRO  QB     57 TYR  QE      4.38 
 55 GLY  QA     57 TYR  HN      4.37 
 56 GLY  HN     69 LEU  QQD     4.27 
 56 GLY  QA     57 TYR  HA      5.11 
 56 GLY  QA     57 TYR  QD      4.90 
 56 GLY  QA     69 LEU  HN      5.17 
 56 GLY  QA     69 LEU  HG      4.24 
 56 GLY  QA     69 LEU  QQD     3.32 
 57 TYR  HN     69 LEU  QQD     3.39 
 57 TYR  HA     58 GLU  QB      4.88 
 57 TYR  HA     69 LEU  QQD     3.77 
 57 TYR  HB2    69 LEU  QQD     4.66 
 57 TYR  HB3    69 LEU  QQD     5.44 
 57 TYR  QD     58 GLU  QB      5.34 
 57 TYR  QD     69 LEU  QQD     4.34 
 58 GLU  HN     58 GLU  QB      3.54 
 58 GLU  HN     69 LEU  QQD     4.10 
 58 GLU  HA     59 GLN  QB      4.74 
 58 GLU  HA     69 LEU  QQD     4.95 
 58 GLU  QB     59 GLN  HN      3.31 
 58 GLU  QB     69 LEU  QQD     3.85 
 58 GLU  QG     69 LEU  QQD     3.33 
 59 GLN  HN     59 GLN  QB      3.02 
 59 GLN  HN     59 GLN  QG      4.19 
 59 GLN  QB     59 GLN  HE21    4.40 
 59 GLN  QB     59 GLN  HE22    4.60 
 59 GLN  QB     66 PHE  QE      3.94 
 59 GLN  QB     66 PHE  HZ      4.62 
 59 GLN  QG     60 HIS  HN      3.67 
 59 GLN  QG     64 GLY  HN      4.74 
 59 GLN  QG     64 GLY  QA      4.02 
 59 GLN  QG     65 HIS  HN      5.04 
 59 GLN  QG     66 PHE  HA      4.82 
 59 GLN  QG     66 PHE  QD      4.45 
 59 GLN  QG     66 PHE  QE      4.57 
 59 GLN  HE22   64 GLY  QA      4.18 
 60 HIS  HE1    62 GLY  QA      3.51 
 61 PRO  HA     64 GLY  QA      4.67 
 61 PRO  HB2    62 GLY  QA      4.59 
 63 ASP  QB     64 GLY  HN      4.28 
 63 ASP  QB     65 HIS  HN      4.72 
 63 ASP  QB     65 HIS  HD2     3.63 
 67 TYR  QD     73 PRO  QG      4.45 
 67 TYR  QE     73 PRO  QG      4.99 
 68 CYSS HA     69 LEU  QQD     4.74 
 68 CYSS HB2    69 LEU  QQD     4.95 
 69 LEU  HN     69 LEU  QQD     3.28 
 69 LEU  HA     69 LEU  QQD     2.92 
 69 LEU  QQD    70 GLN  HN      4.26 
 69 LEU  QQD    72 LEU  HN      5.03 
 70 GLN  HN     70 GLN  QG      4.06 
 70 GLN  QB     71 HIST HN      3.39 
 70 GLN  QB     71 HIST HD2     4.73 
 70 GLN  QG     71 HIST HN      4.23 
 72 LEU  HB3    74 GLN  QE2     5.34 
 72 LEU  HG     74 GLN  QE2     5.34 
 72 LEU  QD1    73 PRO  QG      4.84 
 72 LEU  QD2    74 GLN  QE2     4.59 
 73 PRO  QG     74 GLN  HN      4.32 


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           H        GLY   1 -16.959  10.253 -26.238
    2    HA2  GLY   1           1HA      GLY   1 -19.063  11.562 -27.840
    3    HA3  GLY   1           2HA      GLY   1 -18.288  12.406 -26.508
    4    H    SER   2           H        SER   2 -18.204  13.626 -28.877
    5    HA   SER   2           HA       SER   2 -15.398  13.290 -29.693
    6    HB2  SER   2           1HB      SER   2 -17.840  13.421 -31.416
    7    HB3  SER   2           2HB      SER   2 -16.346  14.147 -32.009
    8    HG   SER   2           HG       SER   2 -16.340  12.038 -32.671
    9    H    SER   3           H        SER   3 -14.338  15.058 -29.117
   10    HA   SER   3           HA       SER   3 -15.253  17.661 -29.922
   11    HB2  SER   3           1HB      SER   3 -16.464  17.262 -27.752
   12    HB3  SER   3           2HB      SER   3 -14.892  17.169 -26.958
   13    HG   SER   3           HG       SER   3 -14.521  19.290 -27.449
   14    H    GLY   4           H        GLY   4 -13.645  19.347 -29.482
   15    HA2  GLY   4           1HA      GLY   4 -10.945  18.176 -29.428
   16    HA3  GLY   4           2HA      GLY   4 -11.375  19.707 -30.175
   17    H    SER   5           H        SER   5 -10.834  18.062 -27.116
   18    HA   SER   5           HA       SER   5 -10.143  20.656 -25.929
   19    HB2  SER   5           1HB      SER   5 -12.426  20.043 -25.177
   20    HB3  SER   5           2HB      SER   5 -11.788  18.533 -24.529
   21    HG   SER   5           HG       SER   5 -12.014  20.587 -23.142
   22    H    SER   6           H        SER   6  -8.013  20.450 -25.649
   23    HA   SER   6           HA       SER   6  -7.035  18.372 -23.884
   24    HB2  SER   6           1HB      SER   6  -5.863  18.687 -26.658
   25    HB3  SER   6           2HB      SER   6  -5.279  17.601 -25.397
   26    HG   SER   6           HG       SER   6  -7.870  17.499 -26.554
   27    H    GLY   7           H        GLY   7  -6.081  19.605 -22.396
   28    HA2  GLY   7           1HA      GLY   7  -3.683  20.897 -22.721
   29    HA3  GLY   7           2HA      GLY   7  -4.893  22.138 -23.010
   30    H    GLN   8           H        GLN   8  -4.046  19.613 -20.648
   31    HA   GLN   8           HA       GLN   8  -5.124  21.348 -18.533
   32    HB2  GLN   8           1HB      GLN   8  -6.132  19.107 -18.680
   33    HB3  GLN   8           2HB      GLN   8  -4.544  18.382 -18.466
   34    HG2  GLN   8           1HG      GLN   8  -4.412  19.014 -16.239
   35    HG3  GLN   8           2HG      GLN   8  -5.645  20.261 -16.420
   36   HE21  GLN   8          1HE2      GLN   8  -6.572  19.267 -14.513
   37   HE22  GLN   8          2HE2      GLN   8  -7.592  17.884 -14.691
   38    H    HIS   9           H        HIS   9  -3.937  21.576 -16.564
   39    HA   HIS   9           HA       HIS   9  -1.045  21.092 -16.861
   40    HB2  HIS   9           1HB      HIS   9  -2.467  23.509 -15.743
   41    HB3  HIS   9           2HB      HIS   9  -0.753  23.198 -15.481
   42    HD1  HIS   9           1HD      HIS   9  -3.099  23.486 -18.471
   43    HD2  HIS   9           2HD      HIS   9   0.796  24.389 -17.341
   44    HE1  HIS   9           1HE      HIS   9  -2.089  24.682 -20.439
   45    H    GLN  10           H        GLN  10  -0.665  19.414 -15.539
   46    HA   GLN  10           HA       GLN  10  -1.207  19.774 -12.703
   47    HB2  GLN  10           1HB      GLN  10  -2.288  17.680 -12.387
   48    HB3  GLN  10           2HB      GLN  10  -3.134  18.488 -13.700
   49    HG2  GLN  10           1HG      GLN  10  -1.497  17.124 -15.206
   50    HG3  GLN  10           2HG      GLN  10  -1.352  16.104 -13.776
   51   HE21  GLN  10          1HE2      GLN  10  -3.060  14.843 -13.149
   52   HE22  GLN  10          2HE2      GLN  10  -4.475  14.619 -14.113
   53    H    GLU  11           H        GLU  11  -0.156  17.924 -11.425
   54    HA   GLU  11           HA       GLU  11   2.080  16.638 -12.732
   55    HB2  GLU  11           1HB      GLU  11   3.783  17.656 -11.284
   56    HB3  GLU  11           2HB      GLU  11   3.006  18.853 -12.310
   57    HG2  GLU  11           1HG      GLU  11   2.012  18.391  -9.534
   58    HG3  GLU  11           2HG      GLU  11   3.443  19.381  -9.814
   59    H    ALA  12           H        ALA  12   3.420  15.407 -11.057
   60    HA   ALA  12           HA       ALA  12   1.683  14.487  -8.862
   61    HB1  ALA  12           1HB      ALA  12   2.072  12.257  -9.332
   62    HB2  ALA  12           2HB      ALA  12   1.924  12.960 -10.944
   63    HB3  ALA  12           3HB      ALA  12   3.518  12.601 -10.281
   64    H    GLY  13           H        GLY  13   5.038  14.341 -10.078
   65    HA2  GLY  13           1HA      GLY  13   6.830  15.302  -8.757
   66    HA3  GLY  13           2HA      GLY  13   5.938  14.844  -7.313
   67    H    ALA  14           H        ALA  14   8.344  14.068  -7.063
   68    HA   ALA  14           HA       ALA  14   9.261  11.776  -8.363
   69    HB1  ALA  14           1HB      ALA  14  10.682  13.160  -6.942
   70    HB2  ALA  14           2HB      ALA  14   9.783  12.632  -5.519
   71    HB3  ALA  14           3HB      ALA  14  10.735  11.469  -6.441
   72    H    GLY  15           H        GLY  15   9.428   9.574  -7.520
   73    HA2  GLY  15           1HA      GLY  15   6.844   8.655  -6.588
   74    HA3  GLY  15           2HA      GLY  15   8.185   7.648  -7.111
   75    H    ASP  16           H        ASP  16   7.806  10.082  -4.536
   76    HA   ASP  16           HA       ASP  16   8.602   8.011  -2.600
   77    HB2  ASP  16           1HB      ASP  16   9.472  10.909  -2.549
   78    HB3  ASP  16           2HB      ASP  16   9.924   9.663  -1.388
   79    H    LEU  17           H        LEU  17   5.987   8.385  -2.999
   80    HA   LEU  17           HA       LEU  17   5.156   9.844  -0.588
   81    HB2  LEU  17           1HB      LEU  17   3.414   9.765  -3.019
   82    HB3  LEU  17           2HB      LEU  17   3.335  10.850  -1.632
   83    HG   LEU  17           HG       LEU  17   5.710  10.994  -3.428
   84   HD11  LEU  17          1HD1      LEU  17   4.088  12.874  -4.507
   85   HD12  LEU  17          2HD1      LEU  17   2.939  11.569  -4.213
   86   HD13  LEU  17          3HD1      LEU  17   4.368  11.278  -5.205
   87   HD21  LEU  17          1HD2      LEU  17   4.491  12.532  -1.310
   88   HD22  LEU  17          2HD2      LEU  17   4.744  13.515  -2.753
   89   HD23  LEU  17          3HD2      LEU  17   6.102  12.665  -2.014
   90    H    CYS  18           H        CYS  18   3.751   8.785   0.701
   91    HA   CYS  18           HA       CYS  18   3.439   6.103   0.735
   92    HB2  CYS  18           1HB      CYS  18   2.726   7.473   2.597
   93    HB3  CYS  18           2HB      CYS  18   1.425   8.169   1.637
   94    H    ALA  19           H        ALA  19   1.525   4.719   0.356
   95    HA   ALA  19           HA       ALA  19   0.381   5.310  -2.280
   96    HB1  ALA  19           1HB      ALA  19   0.041   2.627  -1.088
   97    HB2  ALA  19           2HB      ALA  19   0.431   3.095  -2.743
   98    HB3  ALA  19           3HB      ALA  19   1.686   3.106  -1.504
   99    H    LEU  20           H        LEU  20  -0.498   4.431   1.014
  100    HA   LEU  20           HA       LEU  20  -3.210   3.925   0.668
  101    HB2  LEU  20           1HB      LEU  20  -1.495   4.816   2.909
  102    HB3  LEU  20           2HB      LEU  20  -3.230   5.069   3.089
  103    HG   LEU  20           HG       LEU  20  -3.281   2.501   2.390
  104   HD11  LEU  20          1HD1      LEU  20  -1.224   1.678   3.951
  105   HD12  LEU  20          2HD1      LEU  20  -0.493   3.050   3.120
  106   HD13  LEU  20          3HD1      LEU  20  -1.187   1.724   2.189
  107   HD21  LEU  20          1HD2      LEU  20  -3.417   3.996   4.813
  108   HD22  LEU  20          2HD2      LEU  20  -2.619   2.457   5.136
  109   HD23  LEU  20          3HD2      LEU  20  -4.221   2.481   4.398
  110    H    CYS  21           H        CYS  21  -1.743   7.004   1.723
  111    HA   CYS  21           HA       CYS  21  -4.182   8.393   0.882
  112    HB2  CYS  21           1HB      CYS  21  -3.128  10.345   2.104
  113    HB3  CYS  21           2HB      CYS  21  -3.554   8.961   3.106
  114    H    GLY  22           H        GLY  22  -0.643   8.743   0.603
  115    HA2  GLY  22           1HA      GLY  22   0.345   9.072  -1.589
  116    HA3  GLY  22           2HA      GLY  22  -1.091   9.980  -2.038
  117    H    GLU  23           H        GLU  23   0.717  10.296   0.974
  118    HA   GLU  23           HA       GLU  23   1.238  13.098   0.264
  119    HB2  GLU  23           1HB      GLU  23   1.274  11.779   2.984
  120    HB3  GLU  23           2HB      GLU  23   1.481  13.496   2.665
  121    HG2  GLU  23           1HG      GLU  23  -0.793  13.605   1.778
  122    HG3  GLU  23           2HG      GLU  23  -1.000  11.886   2.107
  123    H    HIS  24           H        HIS  24   3.267  13.929   1.593
  124    HA   HIS  24           HA       HIS  24   5.528  12.752   0.388
  125    HB2  HIS  24           1HB      HIS  24   5.092  15.183   1.343
  126    HB3  HIS  24           2HB      HIS  24   5.834  14.504   2.788
  127    HD1  HIS  24           1HD      HIS  24   8.272  13.286   2.230
  128    HD2  HIS  24           2HD      HIS  24   6.896  16.207  -0.385
  129    HE1  HIS  24           1HE      HIS  24  10.297  14.051   0.951
  130    H    LEU  25           H        LEU  25   7.227  11.560   1.250
  131    HA   LEU  25           HA       LEU  25   6.637  10.225   3.810
  132    HB2  LEU  25           1HB      LEU  25   7.971   9.177   1.324
  133    HB3  LEU  25           2HB      LEU  25   8.007   8.333   2.871
  134    HG   LEU  25           HG       LEU  25   5.396   9.053   1.590
  135   HD11  LEU  25          1HD1      LEU  25   5.586   6.551   0.798
  136   HD12  LEU  25          2HD1      LEU  25   7.309   6.924   0.780
  137   HD13  LEU  25          3HD1      LEU  25   6.191   7.874  -0.199
  138   HD21  LEU  25          1HD2      LEU  25   6.204   7.753   3.958
  139   HD22  LEU  25          2HD2      LEU  25   5.517   6.519   2.902
  140   HD23  LEU  25          3HD2      LEU  25   4.569   7.945   3.324
  141    H    TYR  26           H        TYR  26   8.322   9.849   5.248
  142    HA   TYR  26           HA       TYR  26  10.660  11.566   4.839
  143    HB2  TYR  26           1HB      TYR  26   9.120  11.675   6.917
  144    HB3  TYR  26           2HB      TYR  26   9.947  10.207   7.426
  145    HD1  TYR  26           1HD      TYR  26  11.161  13.353   5.811
  146    HD2  TYR  26           2HD      TYR  26  11.408  10.715   9.140
  147    HE1  TYR  26           1HE      TYR  26  12.986  14.712   6.745
  148    HE2  TYR  26           2HE      TYR  26  13.233  12.067  10.083
  149    HH   TYR  26           HH       TYR  26  13.894  15.074   9.290
  150    H    VAL  27           H        VAL  27  12.701  10.704   5.993
  151    HA   VAL  27           HA       VAL  27  13.407   8.235   4.709
  152    HB   VAL  27           HB       VAL  27  15.639   8.605   5.776
  153   HG11  VAL  27          1HG1      VAL  27  14.775   9.615   3.554
  154   HG12  VAL  27          2HG1      VAL  27  14.783  11.142   4.438
  155   HG13  VAL  27          3HG1      VAL  27  16.278  10.225   4.246
  156   HG21  VAL  27          1HG2      VAL  27  15.686   9.855   7.621
  157   HG22  VAL  27          2HG2      VAL  27  15.503  11.258   6.568
  158   HG23  VAL  27          3HG2      VAL  27  14.082  10.515   7.302
  159    H    LEU  28           H        LEU  28  12.277   9.148   7.817
  160    HA   LEU  28           HA       LEU  28  12.943   6.473   8.858
  161    HB2  LEU  28           1HB      LEU  28  12.448   8.973  10.464
  162    HB3  LEU  28           2HB      LEU  28  12.937   7.399  11.086
  163    HG   LEU  28           HG       LEU  28  14.676   8.948   9.190
  164   HD11  LEU  28          1HD1      LEU  28  14.455  10.513  10.900
  165   HD12  LEU  28          2HD1      LEU  28  15.899   9.604  11.348
  166   HD13  LEU  28          3HD1      LEU  28  14.364   9.274  12.153
  167   HD21  LEU  28          1HD2      LEU  28  16.433   7.594  10.134
  168   HD22  LEU  28          2HD2      LEU  28  15.127   6.546   9.578
  169   HD23  LEU  28          3HD2      LEU  28  15.313   6.888  11.299
  170    H    GLU  29           H        GLU  29  10.539   7.828   7.397
  171    HA   GLU  29           HA       GLU  29   8.497   6.739   9.220
  172    HB2  GLU  29           1HB      GLU  29   8.257   9.129   7.384
  173    HB3  GLU  29           2HB      GLU  29   6.914   8.404   8.257
  174    HG2  GLU  29           1HG      GLU  29   9.343   9.400   9.694
  175    HG3  GLU  29           2HG      GLU  29   8.030  10.485   9.243
  176    H    ARG  30           H        ARG  30   9.826   6.880   6.047
  177    HA   ARG  30           HA       ARG  30   7.599   5.719   4.678
  178    HB2  ARG  30           1HB      ARG  30   9.012   5.621   2.773
  179    HB3  ARG  30           2HB      ARG  30   9.433   7.103   3.620
  180    HG2  ARG  30           1HG      ARG  30  11.371   5.965   4.613
  181    HG3  ARG  30           2HG      ARG  30  10.958   4.509   3.706
  182    HD2  ARG  30           1HD      ARG  30  11.026   6.167   1.663
  183    HD3  ARG  30           2HD      ARG  30  12.053   7.107   2.745
  184    HE   ARG  30           HE       ARG  30  12.793   4.778   1.324
  185   HH11  ARG  30          2HH1      ARG  30  13.218   6.355   4.398
  186   HH12  ARG  30          1HH1      ARG  30  14.767   5.641   4.698
  187   HH21  ARG  30          2HH2      ARG  30  14.832   3.831   1.707
  188   HH22  ARG  30          1HH2      ARG  30  15.685   4.206   3.166
  189    H    LEU  31           H        LEU  31   7.279   3.605   4.043
  190    HA   LEU  31           HA       LEU  31   8.981   1.604   5.380
  191    HB2  LEU  31           1HB      LEU  31   6.047   1.883   5.140
  192    HB3  LEU  31           2HB      LEU  31   6.697   0.251   4.995
  193    HG   LEU  31           HG       LEU  31   7.929   0.947   7.242
  194   HD11  LEU  31          1HD1      LEU  31   6.430   2.293   8.646
  195   HD12  LEU  31          2HD1      LEU  31   5.426   2.627   7.236
  196   HD13  LEU  31          3HD1      LEU  31   7.086   3.217   7.295
  197   HD21  LEU  31          1HD2      LEU  31   5.042   0.257   7.517
  198   HD22  LEU  31          2HD2      LEU  31   6.449  -0.429   8.329
  199   HD23  LEU  31          3HD2      LEU  31   6.110  -0.847   6.649
  200    H    CYS  32           H        CYS  32  10.291   0.827   3.839
  201    HA   CYS  32           HA       CYS  32   9.582   0.619   1.098
  202    HB2  CYS  32           1HB      CYS  32  11.704  -0.699   0.915
  203    HB3  CYS  32           2HB      CYS  32  11.899   0.871   1.684
  204    HG   CYS  32           HG       CYS  32  13.048  -0.018   3.791
  205    H    VAL  33           H        VAL  33   7.798  -0.628   0.744
  206    HA   VAL  33           HA       VAL  33   8.035  -3.477   1.469
  207    HB   VAL  33           HB       VAL  33   5.509  -1.828   1.305
  208   HG11  VAL  33          1HG1      VAL  33   4.434  -3.961   2.114
  209   HG12  VAL  33          2HG1      VAL  33   4.985  -3.971   0.438
  210   HG13  VAL  33          3HG1      VAL  33   5.933  -4.783   1.684
  211   HG21  VAL  33          1HG2      VAL  33   6.590  -1.390   3.367
  212   HG22  VAL  33          2HG2      VAL  33   5.315  -2.557   3.715
  213   HG23  VAL  33          3HG2      VAL  33   6.992  -3.091   3.600
  214    H    ASN  34           H        ASN  34   8.749  -4.340  -0.409
  215    HA   ASN  34           HA       ASN  34   8.710  -5.114  -2.547
  216    HB2  ASN  34           1HB      ASN  34   5.833  -4.176  -2.574
  217    HB3  ASN  34           2HB      ASN  34   6.564  -5.360  -3.654
  218   HD21  ASN  34          1HD2      ASN  34   6.384  -7.418  -3.126
  219   HD22  ASN  34          2HD2      ASN  34   5.950  -8.028  -1.569
  220    H    GLY  35           H        GLY  35   9.450  -2.345  -1.972
  221    HA2  GLY  35           1HA      GLY  35  10.399  -0.820  -3.513
  222    HA3  GLY  35           2HA      GLY  35   9.222  -1.337  -4.712
  223    H    HIS  36           H        HIS  36   6.973  -1.089  -2.843
  224    HA   HIS  36           HA       HIS  36   6.503   1.738  -3.230
  225    HB2  HIS  36           1HB      HIS  36   4.675  -0.327  -1.992
  226    HB3  HIS  36           2HB      HIS  36   4.216   1.263  -2.593
  227    HD1  HIS  36           1HD      HIS  36   5.115   1.452  -5.337
  228    HD2  HIS  36           2HD      HIS  36   3.906  -2.199  -3.764
  229    HE1  HIS  36           1HE      HIS  36   4.511   0.031  -7.323
  230    H    PHE  37           H        PHE  37   6.018   3.237  -1.617
  231    HA   PHE  37           HA       PHE  37   7.027   2.509   1.047
  232    HB2  PHE  37           1HB      PHE  37   6.891   5.170  -0.376
  233    HB3  PHE  37           2HB      PHE  37   7.313   5.005   1.325
  234    HD1  PHE  37           2HD      PHE  37   9.267   3.331   1.828
  235    HD2  PHE  37           1HD      PHE  37   8.570   5.175  -1.944
  236    HE1  PHE  37           2HE      PHE  37  11.617   2.944   1.208
  237    HE2  PHE  37           1HE      PHE  37  10.919   4.791  -2.570
  238    HZ   PHE  37           HZ       PHE  37  12.446   3.675  -0.993
  239    H    PHE  38           H        PHE  38   5.881   3.033   2.893
  240    HA   PHE  38           HA       PHE  38   3.231   4.233   2.564
  241    HB2  PHE  38           1HB      PHE  38   3.694   1.646   4.061
  242    HB3  PHE  38           2HB      PHE  38   2.156   2.478   3.855
  243    HD1  PHE  38           1HD      PHE  38   4.810   0.623   2.085
  244    HD2  PHE  38           2HD      PHE  38   0.848   2.169   1.918
  245    HE1  PHE  38           1HE      PHE  38   4.400  -0.661   0.026
  246    HE2  PHE  38           2HE      PHE  38   0.431   0.887  -0.140
  247    HZ   PHE  38           HZ       PHE  38   2.207  -0.531  -1.088
  248    H    HIS  39           H        HIS  39   2.322   5.070   4.516
  249    HA   HIS  39           HA       HIS  39   4.301   6.159   6.280
  250    HB2  HIS  39           1HB      HIS  39   1.287   6.360   6.231
  251    HB3  HIS  39           2HB      HIS  39   2.295   7.196   7.409
  252    HD2  HIS  39           2HD      HIS  39   4.402   8.792   5.830
  253    HE1  HIS  39           1HE      HIS  39   1.390   9.813   3.022
  254    HE2  HIS  39           2HE      HIS  39   3.717  10.308   3.849
  255    H    ARG  40           H        ARG  40   4.691   5.695   8.405
  256    HA   ARG  40           HA       ARG  40   4.444   3.118   9.338
  257    HB2  ARG  40           1HB      ARG  40   4.933   5.746  10.675
  258    HB3  ARG  40           2HB      ARG  40   4.669   4.322  11.674
  259    HG2  ARG  40           1HG      ARG  40   6.657   4.138   9.476
  260    HG3  ARG  40           2HG      ARG  40   7.081   5.065  10.917
  261    HD2  ARG  40           1HD      ARG  40   6.538   3.109  12.308
  262    HD3  ARG  40           2HD      ARG  40   6.172   2.189  10.849
  263    HE   ARG  40           HE       ARG  40   8.429   1.974  10.442
  264   HH11  ARG  40          2HH1      ARG  40   7.897   4.273  13.002
  265   HH12  ARG  40          1HH1      ARG  40   9.568   4.355  13.452
  266   HH21  ARG  40          2HH2      ARG  40  10.632   2.074  11.025
  267   HH22  ARG  40          1HH2      ARG  40  11.123   3.104  12.327
  268    H    SER  41           H        SER  41   2.143   5.722   9.497
  269    HA   SER  41           HA       SER  41   0.450   4.372  11.420
  270    HB2  SER  41           1HB      SER  41   0.160   6.934   9.848
  271    HB3  SER  41           2HB      SER  41  -1.124   6.303  10.879
  272    HG   SER  41           HG       SER  41   1.379   6.444  12.045
  273    H    CYS  42           H        CYS  42   0.166   5.359   8.007
  274    HA   CYS  42           HA       CYS  42  -2.282   4.242   7.419
  275    HB2  CYS  42           1HB      CYS  42   0.175   4.790   5.810
  276    HB3  CYS  42           2HB      CYS  42  -1.121   3.853   5.071
  277    H    PHE  43           H        PHE  43   0.890   2.681   6.937
  278    HA   PHE  43           HA       PHE  43   0.056   0.210   6.087
  279    HB2  PHE  43           1HB      PHE  43   2.453   1.165   6.485
  280    HB3  PHE  43           2HB      PHE  43   2.301   0.407   8.067
  281    HD1  PHE  43           2HD      PHE  43   1.699  -0.458   4.485
  282    HD2  PHE  43           1HD      PHE  43   3.160  -1.702   8.284
  283    HE1  PHE  43           2HE      PHE  43   2.385  -2.612   3.512
  284    HE2  PHE  43           1HE      PHE  43   3.850  -3.857   7.317
  285    HZ   PHE  43           HZ       PHE  43   3.461  -4.315   4.929
  286    H    ARG  44           H        ARG  44  -1.665  -0.781   6.985
  287    HA   ARG  44           HA       ARG  44  -1.344  -1.832   9.677
  288    HB2  ARG  44           1HB      ARG  44  -3.616  -0.040   8.842
  289    HB3  ARG  44           2HB      ARG  44  -3.779  -1.189  10.164
  290    HG2  ARG  44           1HG      ARG  44  -2.168  -0.081  11.467
  291    HG3  ARG  44           2HG      ARG  44  -1.591   0.863  10.092
  292    HD2  ARG  44           1HD      ARG  44  -3.847   1.943   9.998
  293    HD3  ARG  44           2HD      ARG  44  -4.241   1.115  11.504
  294    HE   ARG  44           HE       ARG  44  -1.829   2.681  11.622
  295   HH11  ARG  44          2HH1      ARG  44  -5.290   2.698  11.996
  296   HH12  ARG  44          1HH1      ARG  44  -5.300   4.074  13.049
  297   HH21  ARG  44          2HH2      ARG  44  -1.829   4.492  13.009
  298   HH22  ARG  44          1HH2      ARG  44  -3.331   5.093  13.625
  299    H    CYS  45           H        CYS  45  -3.296  -3.328  10.178
  300    HA   CYS  45           HA       CYS  45  -3.358  -5.337   8.210
  301    HB2  CYS  45           1HB      CYS  45  -3.679  -5.652  10.693
  302    HB3  CYS  45           2HB      CYS  45  -5.312  -5.023  10.493
  303    H    HIS  46           H        HIS  46  -5.426  -6.289   7.337
  304    HA   HIS  46           HA       HIS  46  -7.028  -4.125   6.170
  305    HB2  HIS  46           1HB      HIS  46  -6.045  -5.413   4.453
  306    HB3  HIS  46           2HB      HIS  46  -6.404  -6.931   5.271
  307    HD1  HIS  46           1HD      HIS  46  -7.728  -4.586   2.795
  308    HD2  HIS  46           2HD      HIS  46  -9.215  -7.646   5.180
  309    HE1  HIS  46           1HE      HIS  46  -9.960  -5.187   1.804
  310    H    THR  47           H        THR  47  -7.191  -6.402   8.584
  311    HA   THR  47           HA       THR  47 -10.133  -6.516   8.421
  312    HB   THR  47           HB       THR  47  -8.181  -8.550   9.484
  313    HG1  THR  47           1HG      THR  47 -10.297  -8.598   7.577
  314   HG21  THR  47          1HG2      THR  47 -11.171  -8.528   9.910
  315   HG22  THR  47          2HG2      THR  47  -9.968  -8.200  11.157
  316   HG23  THR  47          3HG2      THR  47 -10.049  -9.794  10.406
  317    H    CYS  48           H        CYS  48  -7.332  -5.904  10.414
  318    HA   CYS  48           HA       CYS  48  -9.120  -4.911  12.536
  319    HB2  CYS  48           1HB      CYS  48  -7.425  -5.518  14.186
  320    HB3  CYS  48           2HB      CYS  48  -7.912  -6.934  13.260
  321    H    GLU  49           H        GLU  49  -7.104  -3.989  10.149
  322    HA   GLU  49           HA       GLU  49  -5.686  -2.220   9.769
  323    HB2  GLU  49           1HB      GLU  49  -6.699  -0.050  10.479
  324    HB3  GLU  49           2HB      GLU  49  -7.813  -1.119   9.639
  325    HG2  GLU  49           1HG      GLU  49  -8.713  -1.829  11.834
  326    HG3  GLU  49           2HG      GLU  49  -7.670  -0.635  12.605
  327    H    ALA  50           H        ALA  50  -4.627  -3.730  11.794
  328    HA   ALA  50           HA       ALA  50  -3.875  -1.889  13.935
  329    HB1  ALA  50           1HB      ALA  50  -2.980  -4.744  13.674
  330    HB2  ALA  50           2HB      ALA  50  -3.081  -3.748  15.127
  331    HB3  ALA  50           3HB      ALA  50  -4.555  -4.311  14.340
  332    H    THR  51           H        THR  51  -1.957  -0.898  14.042
  333    HA   THR  51           HA       THR  51  -0.275  -0.468  11.972
  334    HB   THR  51           HB       THR  51   0.679  -0.696  14.832
  335    HG1  THR  51           1HG      THR  51   0.192   1.693  14.644
  336   HG21  THR  51          1HG2      THR  51   2.393   0.847  14.220
  337   HG22  THR  51          2HG2      THR  51   1.678   1.103  12.628
  338   HG23  THR  51          3HG2      THR  51   2.413  -0.450  13.025
  339    H    LEU  52           H        LEU  52   0.463  -2.052  10.672
  340    HA   LEU  52           HA       LEU  52   1.442  -4.552  11.677
  341    HB2  LEU  52           1HB      LEU  52   1.647  -3.352   8.919
  342    HB3  LEU  52           2HB      LEU  52   1.999  -5.027   9.342
  343    HG   LEU  52           HG       LEU  52  -0.714  -3.724   9.565
  344   HD11  LEU  52          1HD1      LEU  52   0.612  -5.280   7.394
  345   HD12  LEU  52          2HD1      LEU  52  -0.442  -3.871   7.287
  346   HD13  LEU  52          3HD1      LEU  52  -1.123  -5.455   7.656
  347   HD21  LEU  52          1HD2      LEU  52  -0.509  -6.634   9.458
  348   HD22  LEU  52          2HD2      LEU  52  -1.458  -5.600  10.527
  349   HD23  LEU  52          3HD2      LEU  52   0.238  -5.925  10.889
  350    H    TRP  53           H        TRP  53   3.202  -4.221  12.983
  351    HA   TRP  53           HA       TRP  53   5.360  -2.500  12.355
  352    HB2  TRP  53           1HB      TRP  53   5.676  -4.902  14.125
  353    HB3  TRP  53           2HB      TRP  53   6.381  -3.297  14.294
  354    HD1  TRP  53           HD       TRP  53   3.142  -5.229  14.967
  355    HE1  TRP  53           1HE      TRP  53   1.710  -3.876  16.623
  356    HE3  TRP  53           3HE      TRP  53   5.925  -0.944  15.134
  357    HZ2  TRP  53           2HZ      TRP  53   1.754  -1.329  17.839
  358    HZ3  TRP  53           3HZ      TRP  53   5.161   0.904  16.568
  359    HH2  TRP  53           HH       TRP  53   3.118   0.713  17.891
  360    HA   PRO  54           HA       PRO  54   7.789  -4.845   9.550
  361    HB2  PRO  54           1HB      PRO  54  10.298  -4.120  10.291
  362    HB3  PRO  54           2HB      PRO  54   9.195  -3.032   9.438
  363    HG2  PRO  54           1HG      PRO  54   9.829  -3.178  12.360
  364    HG3  PRO  54           2HG      PRO  54   9.652  -1.750  11.324
  365    HD2  PRO  54           1HD      PRO  54   7.685  -2.602  12.978
  366    HD3  PRO  54           2HD      PRO  54   7.350  -1.804  11.428
  367    H    GLY  55           H        GLY  55   7.072  -6.876  10.645
  368    HA2  GLY  55           1HA      GLY  55   8.826  -8.820  10.899
  369    HA3  GLY  55           2HA      GLY  55   9.051  -8.041  12.459
  370    H    GLY  56           H        GLY  56   5.943  -7.457  11.915
  371    HA2  GLY  56           1HA      GLY  56   5.052 -10.067  12.973
  372    HA3  GLY  56           2HA      GLY  56   4.526  -8.551  13.691
  373    H    TYR  57           H        TYR  57   4.857  -9.420  10.269
  374    HA   TYR  57           HA       TYR  57   2.003  -9.623   9.914
  375    HB2  TYR  57           1HB      TYR  57   1.642  -7.709   8.597
  376    HB3  TYR  57           2HB      TYR  57   2.588  -7.122   9.960
  377    HD1  TYR  57           2HD      TYR  57   5.141  -6.935   9.607
  378    HD2  TYR  57           1HD      TYR  57   2.347  -7.283   6.417
  379    HE1  TYR  57           2HE      TYR  57   6.805  -6.000   8.056
  380    HE2  TYR  57           1HE      TYR  57   4.003  -6.350   4.857
  381    HH   TYR  57           HH       TYR  57   7.035  -6.291   5.212
  382    H    GLU  58           H        GLU  58   1.453  -9.959   7.566
  383    HA   GLU  58           HA       GLU  58   3.653 -10.861   5.896
  384    HB2  GLU  58           1HB      GLU  58   1.728 -12.685   7.242
  385    HB3  GLU  58           2HB      GLU  58   2.141 -13.042   5.571
  386    HG2  GLU  58           1HG      GLU  58   4.338 -12.514   7.503
  387    HG3  GLU  58           2HG      GLU  58   3.504 -14.066   7.560
  388    H    GLN  59           H        GLN  59   3.118 -11.045   3.707
  389    HA   GLN  59           HA       GLN  59   0.563  -9.785   2.998
  390    HB2  GLN  59           1HB      GLN  59   2.538  -8.590   2.228
  391    HB3  GLN  59           2HB      GLN  59   3.134 -10.039   1.430
  392    HG2  GLN  59           1HG      GLN  59   0.979  -9.958   0.065
  393    HG3  GLN  59           2HG      GLN  59   0.801  -8.316   0.681
  394   HE21  GLN  59          1HE2      GLN  59   0.995  -8.755  -1.996
  395   HE22  GLN  59          2HE2      GLN  59   2.512  -8.173  -2.584
  396    H    HIS  60           H        HIS  60  -0.850 -11.474   2.863
  397    HA   HIS  60           HA       HIS  60  -0.436 -14.033   1.976
  398    HB2  HIS  60           1HB      HIS  60  -2.562 -13.019   2.953
  399    HB3  HIS  60           2HB      HIS  60  -2.943 -12.491   1.317
  400    HD1  HIS  60           1HD      HIS  60  -3.904 -14.207  -0.267
  401    HD2  HIS  60           2HD      HIS  60  -2.572 -15.864   3.304
  402    HE1  HIS  60           1HE      HIS  60  -4.724 -16.585  -0.281
  403    HA   PRO  61           HA       PRO  61   0.612 -13.624  -2.297
  404    HB2  PRO  61           1HB      PRO  61   0.289 -16.227  -2.995
  405    HB3  PRO  61           2HB      PRO  61   1.674 -15.648  -2.063
  406    HG2  PRO  61           1HG      PRO  61  -0.822 -16.995  -1.106
  407    HG3  PRO  61           2HG      PRO  61   0.858 -17.269  -0.609
  408    HD2  PRO  61           1HD      PRO  61  -0.870 -15.785   0.854
  409    HD3  PRO  61           2HD      PRO  61   0.872 -15.445   0.799
  410    H    GLY  62           H        GLY  62  -2.180 -15.738  -1.579
  411    HA2  GLY  62           1HA      GLY  62  -3.512 -15.860  -3.898
  412    HA3  GLY  62           2HA      GLY  62  -4.354 -15.569  -2.383
  413    H    ASP  63           H        ASP  63  -4.989 -13.463  -1.839
  414    HA   ASP  63           HA       ASP  63  -5.861 -11.862  -3.952
  415    HB2  ASP  63           1HB      ASP  63  -6.074 -10.090  -2.045
  416    HB3  ASP  63           2HB      ASP  63  -7.062 -11.547  -1.990
  417    H    GLY  64           H        GLY  64  -3.316 -11.060  -1.574
  418    HA2  GLY  64           1HA      GLY  64  -1.133 -10.341  -2.475
  419    HA3  GLY  64           2HA      GLY  64  -2.032  -9.443  -3.689
  420    H    HIS  65           H        HIS  65  -2.951  -9.593  -0.309
  421    HA   HIS  65           HA       HIS  65  -2.283  -6.733  -0.077
  422    HB2  HIS  65           1HB      HIS  65  -4.609  -8.336   0.919
  423    HB3  HIS  65           2HB      HIS  65  -4.110  -6.895   1.800
  424    HD1  HIS  65           1HD      HIS  65  -4.172  -4.615   0.389
  425    HD2  HIS  65           2HD      HIS  65  -6.135  -7.864  -1.299
  426    HE1  HIS  65           1HE      HIS  65  -5.680  -3.647  -1.375
  427    H    PHE  66           H        PHE  66  -2.460  -6.266   2.537
  428    HA   PHE  66           HA       PHE  66  -0.472  -8.084   3.732
  429    HB2  PHE  66           1HB      PHE  66  -0.801  -5.099   4.090
  430    HB3  PHE  66           2HB      PHE  66   0.309  -6.094   5.026
  431    HD1  PHE  66           1HD      PHE  66   2.273  -7.096   3.969
  432    HD2  PHE  66           2HD      PHE  66  -0.325  -4.492   1.828
  433    HE1  PHE  66           1HE      PHE  66   3.995  -6.809   2.235
  434    HE2  PHE  66           2HE      PHE  66   1.392  -4.202   0.090
  435    HZ   PHE  66           HZ       PHE  66   3.555  -5.361   0.292
  436    H    TYR  67           H        TYR  67  -1.136  -9.162   5.458
  437    HA   TYR  67           HA       TYR  67  -3.185  -7.953   7.187
  438    HB2  TYR  67           1HB      TYR  67  -3.111 -10.887   6.474
  439    HB3  TYR  67           2HB      TYR  67  -4.353 -10.039   7.389
  440    HD1  TYR  67           2HD      TYR  67  -2.851 -10.395   4.022
  441    HD2  TYR  67           1HD      TYR  67  -6.155  -8.971   6.294
  442    HE1  TYR  67           2HE      TYR  67  -4.104 -10.001   1.942
  443    HE2  TYR  67           1HE      TYR  67  -7.418  -8.574   4.220
  444    HH   TYR  67           HH       TYR  67  -6.536  -9.842   1.261
  445    H    CYS  68           H        CYS  68  -3.217  -8.797   9.376
  446    HA   CYS  68           HA       CYS  68  -0.600  -9.050  10.455
  447    HB2  CYS  68           1HB      CYS  68  -1.698  -9.199  12.614
  448    HB3  CYS  68           2HB      CYS  68  -2.477  -7.950  11.647
  449    H    LEU  69           H        LEU  69  -0.137 -10.823  12.126
  450    HA   LEU  69           HA       LEU  69  -0.223 -13.343  10.741
  451    HB2  LEU  69           1HB      LEU  69   0.801 -12.908  13.528
  452    HB3  LEU  69           2HB      LEU  69   1.297 -14.126  12.355
  453    HG   LEU  69           HG       LEU  69   1.971 -11.192  12.373
  454   HD11  LEU  69          1HD1      LEU  69   3.919 -13.432  12.126
  455   HD12  LEU  69          2HD1      LEU  69   3.229 -13.064  13.707
  456   HD13  LEU  69          3HD1      LEU  69   4.126 -11.826  12.827
  457   HD21  LEU  69          1HD2      LEU  69   3.096 -11.522  10.259
  458   HD22  LEU  69          2HD2      LEU  69   1.385 -11.916  10.089
  459   HD23  LEU  69          3HD2      LEU  69   2.581 -13.208  10.214
  460    H    GLN  70           H        GLN  70  -2.625 -11.965  12.177
  461    HA   GLN  70           HA       GLN  70  -3.538 -14.407  13.548
  462    HB2  GLN  70           1HB      GLN  70  -3.195 -12.622  15.174
  463    HB3  GLN  70           2HB      GLN  70  -4.209 -11.539  14.229
  464    HG2  GLN  70           1HG      GLN  70  -6.116 -13.070  14.607
  465    HG3  GLN  70           2HG      GLN  70  -5.083 -14.040  15.655
  466   HE21  GLN  70          1HE2      GLN  70  -3.997 -12.757  17.429
  467   HE22  GLN  70          2HE2      GLN  70  -4.976 -11.596  18.252
  468    H    HIS  71           H        HIS  71  -4.038 -12.180  11.051
  469    HA   HIS  71           HA       HIS  71  -6.759 -13.224  10.614
  470    HB2  HIS  71           1HB      HIS  71  -5.641 -10.469  10.180
  471    HB3  HIS  71           2HB      HIS  71  -7.029 -11.029   9.251
  472    HD2  HIS  71           2HD      HIS  71  -7.901 -12.594  12.369
  473    HE1  HIS  71           1HE      HIS  71  -9.033  -8.558  13.025
  474    HE2  HIS  71           2HE      HIS  71  -9.185 -10.925  13.872
  475    H    LEU  72           H        LEU  72  -3.593 -12.858   9.411
  476    HA   LEU  72           HA       LEU  72  -3.881 -12.816   6.672
  477    HB2  LEU  72           1HB      LEU  72  -1.731 -12.737   7.853
  478    HB3  LEU  72           2HB      LEU  72  -1.902 -14.442   8.263
  479    HG   LEU  72           HG       LEU  72  -2.053 -14.642   5.605
  480   HD11  LEU  72          1HD1      LEU  72   0.066 -12.607   5.664
  481   HD12  LEU  72          2HD1      LEU  72  -1.580 -11.987   5.782
  482   HD13  LEU  72          3HD1      LEU  72  -1.112 -12.989   4.409
  483   HD21  LEU  72          1HD2      LEU  72   0.702 -14.305   6.632
  484   HD22  LEU  72          2HD2      LEU  72  -0.027 -15.649   5.754
  485   HD23  LEU  72          3HD2      LEU  72  -0.333 -15.453   7.480
  486    HA   PRO  73           HA       PRO  73  -6.227 -16.564   6.033
  487    HB2  PRO  73           1HB      PRO  73  -6.457 -16.266   3.344
  488    HB3  PRO  73           2HB      PRO  73  -7.445 -15.364   4.499
  489    HG2  PRO  73           1HG      PRO  73  -4.986 -14.498   3.027
  490    HG3  PRO  73           2HG      PRO  73  -6.488 -13.602   3.320
  491    HD2  PRO  73           1HD      PRO  73  -4.245 -13.202   4.782
  492    HD3  PRO  73           2HD      PRO  73  -5.874 -13.025   5.465
  493    H    GLN  74           H        GLN  74  -6.025 -18.155   3.903
  494    HA   GLN  74           HA       GLN  74  -3.311 -18.659   3.121
  495    HB2  GLN  74           1HB      GLN  74  -4.564 -20.177   5.344
  496    HB3  GLN  74           2HB      GLN  74  -3.651 -21.104   4.162
  497    HG2  GLN  74           1HG      GLN  74  -2.669 -18.890   5.934
  498    HG3  GLN  74           2HG      GLN  74  -2.167 -20.579   5.919
  499   HE21  GLN  74          1HE2      GLN  74  -0.902 -17.797   5.400
  500   HE22  GLN  74          2HE2      GLN  74   0.058 -18.071   3.990
  501    H    THR  75           H        THR  75  -3.307 -19.610   1.187
  502    HA   THR  75           HA       THR  75  -5.354 -19.975  -0.473
  503    HB   THR  75           HB       THR  75  -4.102 -21.690  -1.697
  504    HG1  THR  75           1HG      THR  75  -3.389 -22.874   0.178
  505   HG21  THR  75          1HG2      THR  75  -3.169 -19.691  -2.276
  506   HG22  THR  75          2HG2      THR  75  -1.765 -20.420  -1.497
  507   HG23  THR  75          3HG2      THR  75  -2.768 -19.271  -0.612
  508    H    ASP  76           H        ASP  76  -6.992 -21.372  -0.892
  509    HA   ASP  76           HA       ASP  76  -7.518 -23.411   1.141
  510    HB2  ASP  76           1HB      ASP  76  -9.823 -23.366   0.347
  511    HB3  ASP  76           2HB      ASP  76  -9.273 -21.730   0.699
  512    H    SER  77           H        SER  77  -7.398 -25.522   0.726
  513    HA   SER  77           HA       SER  77  -7.723 -26.547  -1.963
  514    HB2  SER  77           1HB      SER  77  -5.131 -27.054  -0.487
  515    HB3  SER  77           2HB      SER  77  -5.565 -27.628  -2.097
  516    HG   SER  77           HG       SER  77  -4.268 -25.808  -2.290
  517    H    GLY  78           H        GLY  78  -7.971 -28.846  -2.037
  518    HA2  GLY  78           1HA      GLY  78  -9.585 -30.026  -0.249
  519    HA3  GLY  78           2HA      GLY  78  -8.402 -30.953  -1.161
  520    HA   PRO  79           HA       PRO  79  -7.185 -30.230   3.506
  521    HB2  PRO  79           1HB      PRO  79  -9.156 -31.329   5.015
  522    HB3  PRO  79           2HB      PRO  79  -9.111 -29.612   4.597
  523    HG2  PRO  79           1HG      PRO  79 -10.688 -31.827   3.343
  524    HG3  PRO  79           2HG      PRO  79 -11.202 -30.180   3.754
  525    HD2  PRO  79           1HD      PRO  79 -10.529 -30.911   1.235
  526    HD3  PRO  79           2HD      PRO  79 -10.245 -29.275   1.863
  527    H    SER  80           H        SER  80  -9.154 -32.930   2.301
  528    HA   SER  80           HA       SER  80  -8.951 -35.202   2.680
  529    HB2  SER  80           1HB      SER  80  -6.357 -34.237   1.507
  530    HB3  SER  80           2HB      SER  80  -6.606 -35.951   1.837
  531    HG   SER  80           HG       SER  80  -8.706 -35.466   0.602
  532    H    SER  81           H        SER  81  -8.650 -33.873   5.113
  533    HA   SER  81           HA       SER  81  -6.337 -35.097   6.415
  534    HB2  SER  81           1HB      SER  81  -8.415 -33.233   7.587
  535    HB3  SER  81           2HB      SER  81  -6.890 -33.710   8.333
  536    HG   SER  81           HG       SER  81  -6.337 -31.861   7.406
  537    H    GLY  82           H        GLY  82  -6.493 -36.585   8.078
  538    HA2  GLY  82           1HA      GLY  82  -9.086 -37.973   8.227
  539    HA3  GLY  82           2HA      GLY  82  -7.522 -38.707   8.546
  Start of MODEL    2
    1    H1   GLY   1           H        GLY   1 -12.946  25.768 -44.916
    2    HA2  GLY   1           1HA      GLY   1 -12.530  27.273 -42.984
    3    HA3  GLY   1           2HA      GLY   1 -14.265  27.550 -42.961
    4    H    SER   2           H        SER   2 -14.787  26.762 -40.989
    5    HA   SER   2           HA       SER   2 -15.219  25.257 -39.339
    6    HB2  SER   2           1HB      SER   2 -15.076  23.502 -41.771
    7    HB3  SER   2           2HB      SER   2 -15.288  22.783 -40.175
    8    HG   SER   2           HG       SER   2 -17.288  23.401 -40.210
    9    H    SER   3           H        SER   3 -12.625  26.172 -39.404
   10    HA   SER   3           HA       SER   3 -10.871  23.870 -39.071
   11    HB2  SER   3           1HB      SER   3  -9.104  25.607 -38.713
   12    HB3  SER   3           2HB      SER   3  -9.929  25.750 -40.265
   13    HG   SER   3           HG       SER   3 -10.793  27.206 -38.008
   14    H    GLY   4           H        GLY   4  -9.420  23.836 -37.128
   15    HA2  GLY   4           1HA      GLY   4  -9.471  24.971 -34.770
   16    HA3  GLY   4           2HA      GLY   4 -11.070  24.244 -34.740
   17    H    SER   5           H        SER   5  -8.467  23.802 -33.212
   18    HA   SER   5           HA       SER   5  -8.769  21.019 -32.836
   19    HB2  SER   5           1HB      SER   5  -6.533  20.289 -33.639
   20    HB3  SER   5           2HB      SER   5  -7.582  20.823 -34.952
   21    HG   SER   5           HG       SER   5  -5.271  21.988 -33.925
   22    H    SER   6           H        SER   6  -8.004  20.460 -30.877
   23    HA   SER   6           HA       SER   6  -5.740  21.708 -29.660
   24    HB2  SER   6           1HB      SER   6  -7.663  23.404 -29.417
   25    HB3  SER   6           2HB      SER   6  -8.356  22.259 -28.269
   26    HG   SER   6           HG       SER   6  -5.976  22.431 -27.432
   27    H    GLY   7           H        GLY   7  -5.058  20.643 -27.788
   28    HA2  GLY   7           1HA      GLY   7  -6.423  18.943 -26.139
   29    HA3  GLY   7           2HA      GLY   7  -6.024  17.951 -27.533
   30    H    GLN   8           H        GLN   8  -4.898  19.314 -24.618
   31    HA   GLN   8           HA       GLN   8  -2.373  17.905 -24.924
   32    HB2  GLN   8           1HB      GLN   8  -1.033  19.821 -24.200
   33    HB3  GLN   8           2HB      GLN   8  -1.856  20.161 -25.717
   34    HG2  GLN   8           1HG      GLN   8  -3.122  20.986 -23.149
   35    HG3  GLN   8           2HG      GLN   8  -1.791  21.935 -23.810
   36   HE21  GLN   8          1HE2      GLN   8  -2.044  22.826 -25.936
   37   HE22  GLN   8          2HE2      GLN   8  -3.621  23.204 -26.532
   38    H    HIS   9           H        HIS   9  -1.228  17.640 -22.884
   39    HA   HIS   9           HA       HIS   9  -2.516  18.379 -20.428
   40    HB2  HIS   9           1HB      HIS   9  -3.919  16.469 -21.141
   41    HB3  HIS   9           2HB      HIS   9  -2.481  15.454 -21.201
   42    HD1  HIS   9           1HD      HIS   9  -4.398  17.520 -18.648
   43    HD2  HIS   9           2HD      HIS   9  -1.970  14.157 -18.878
   44    HE1  HIS   9           1HE      HIS   9  -4.386  16.540 -16.332
   45    H    GLN  10           H        GLN  10  -1.233  17.971 -18.596
   46    HA   GLN  10           HA       GLN  10   1.406  16.787 -19.094
   47    HB2  GLN  10           1HB      GLN  10   1.239  19.416 -19.167
   48    HB3  GLN  10           2HB      GLN  10   1.217  19.253 -17.416
   49    HG2  GLN  10           1HG      GLN  10   3.465  19.645 -18.531
   50    HG3  GLN  10           2HG      GLN  10   3.359  18.339 -17.352
   51   HE21  GLN  10          1HE2      GLN  10   4.875  16.970 -18.063
   52   HE22  GLN  10          2HE2      GLN  10   4.897  16.248 -19.632
   53    H    GLU  11           H        GLU  11   1.350  15.057 -17.798
   54    HA   GLU  11           HA       GLU  11   0.198  15.310 -15.118
   55    HB2  GLU  11           1HB      GLU  11  -0.555  13.425 -16.510
   56    HB3  GLU  11           2HB      GLU  11   1.102  12.849 -16.625
   57    HG2  GLU  11           1HG      GLU  11   1.166  12.385 -14.275
   58    HG3  GLU  11           2HG      GLU  11  -0.418  13.122 -14.044
   59    H    ALA  12           H        ALA  12   1.342  14.683 -13.254
   60    HA   ALA  12           HA       ALA  12   4.190  14.136 -13.489
   61    HB1  ALA  12           1HB      ALA  12   4.927  16.157 -12.948
   62    HB2  ALA  12           2HB      ALA  12   3.274  16.759 -13.075
   63    HB3  ALA  12           3HB      ALA  12   3.891  16.197 -11.522
   64    H    GLY  13           H        GLY  13   4.878  12.793 -11.928
   65    HA2  GLY  13           1HA      GLY  13   3.808  12.773  -9.282
   66    HA3  GLY  13           2HA      GLY  13   3.168  11.444 -10.236
   67    H    ALA  14           H        ALA  14   5.189  11.824  -7.908
   68    HA   ALA  14           HA       ALA  14   7.433  10.335  -9.079
   69    HB1  ALA  14           1HB      ALA  14   8.797  11.182  -7.462
   70    HB2  ALA  14           2HB      ALA  14   7.610  12.484  -7.546
   71    HB3  ALA  14           3HB      ALA  14   7.506  11.277  -6.264
   72    H    GLY  15           H        GLY  15   8.387   8.616  -7.634
   73    HA2  GLY  15           1HA      GLY  15   6.186   6.951  -6.615
   74    HA3  GLY  15           2HA      GLY  15   7.739   6.354  -7.179
   75    H    ASP  16           H        ASP  16   7.216   9.041  -4.955
   76    HA   ASP  16           HA       ASP  16   8.327   7.397  -2.783
   77    HB2  ASP  16           1HB      ASP  16   9.065  10.295  -3.166
   78    HB3  ASP  16           2HB      ASP  16   9.830   9.103  -2.118
   79    H    LEU  17           H        LEU  17   5.612   7.861  -3.162
   80    HA   LEU  17           HA       LEU  17   5.020   9.563  -0.840
   81    HB2  LEU  17           1HB      LEU  17   3.122   9.366  -3.146
   82    HB3  LEU  17           2HB      LEU  17   3.183  10.569  -1.860
   83    HG   LEU  17           HG       LEU  17   5.302  10.358  -3.988
   84   HD11  LEU  17          1HD1      LEU  17   3.375  12.541  -4.217
   85   HD12  LEU  17          2HD1      LEU  17   2.691  10.947  -4.534
   86   HD13  LEU  17          3HD1      LEU  17   4.081  11.511  -5.462
   87   HD21  LEU  17          1HD2      LEU  17   5.942  11.561  -1.978
   88   HD22  LEU  17          2HD2      LEU  17   4.490  12.556  -2.087
   89   HD23  LEU  17          3HD2      LEU  17   5.740  12.682  -3.325
   90    H    CYS  18           H        CYS  18   3.613   8.725   0.611
   91    HA   CYS  18           HA       CYS  18   3.194   6.120   1.023
   92    HB2  CYS  18           1HB      CYS  18   2.457   7.914   2.564
   93    HB3  CYS  18           2HB      CYS  18   1.074   8.222   1.519
   94    H    ALA  19           H        ALA  19   1.587   4.557   0.604
   95    HA   ALA  19           HA       ALA  19   0.313   4.891  -2.009
   96    HB1  ALA  19           1HB      ALA  19   1.760   2.816  -0.938
   97    HB2  ALA  19           2HB      ALA  19   0.094   2.260  -0.777
   98    HB3  ALA  19           3HB      ALA  19   0.720   2.724  -2.359
   99    H    LEU  20           H        LEU  20  -0.435   4.536   1.358
  100    HA   LEU  20           HA       LEU  20  -3.146   3.717   1.041
  101    HB2  LEU  20           1HB      LEU  20  -1.405   4.607   3.247
  102    HB3  LEU  20           2HB      LEU  20  -3.130   4.897   3.467
  103    HG   LEU  20           HG       LEU  20  -2.226   2.767   4.465
  104   HD11  LEU  20          1HD1      LEU  20  -4.651   3.319   3.630
  105   HD12  LEU  20          2HD1      LEU  20  -4.226   1.694   4.167
  106   HD13  LEU  20          3HD1      LEU  20  -4.296   2.063   2.444
  107   HD21  LEU  20          1HD2      LEU  20  -1.554   2.346   1.632
  108   HD22  LEU  20          2HD2      LEU  20  -2.301   0.972   2.447
  109   HD23  LEU  20          3HD2      LEU  20  -0.817   1.678   3.088
  110    H    CYS  21           H        CYS  21  -1.765   6.837   2.094
  111    HA   CYS  21           HA       CYS  21  -4.268   8.162   1.401
  112    HB2  CYS  21           1HB      CYS  21  -3.188  10.160   2.451
  113    HB3  CYS  21           2HB      CYS  21  -3.337   8.779   3.532
  114    H    GLY  22           H        GLY  22  -0.796   8.484   0.664
  115    HA2  GLY  22           1HA      GLY  22  -0.056   8.774  -1.611
  116    HA3  GLY  22           2HA      GLY  22  -1.565   9.609  -1.948
  117    H    GLU  23           H        GLU  23   0.514  10.156   0.845
  118    HA   GLU  23           HA       GLU  23   0.940  12.902  -0.125
  119    HB2  GLU  23           1HB      GLU  23   0.736  11.754   2.651
  120    HB3  GLU  23           2HB      GLU  23   1.441  13.338   2.356
  121    HG2  GLU  23           1HG      GLU  23  -0.798  13.750   1.061
  122    HG3  GLU  23           2HG      GLU  23  -1.380  12.437   2.083
  123    H    HIS  24           H        HIS  24   2.990  13.878   1.037
  124    HA   HIS  24           HA       HIS  24   5.234  12.631  -0.091
  125    HB2  HIS  24           1HB      HIS  24   4.804  15.111   0.722
  126    HB3  HIS  24           2HB      HIS  24   5.569  14.525   2.196
  127    HD1  HIS  24           1HD      HIS  24   6.308  15.704  -1.195
  128    HD2  HIS  24           2HD      HIS  24   8.285  13.609   1.799
  129    HE1  HIS  24           1HE      HIS  24   8.744  15.784  -1.815
  130    H    LEU  25           H        LEU  25   7.014  11.582   0.853
  131    HA   LEU  25           HA       LEU  25   6.418  10.295   3.435
  132    HB2  LEU  25           1HB      LEU  25   7.955   9.285   1.052
  133    HB3  LEU  25           2HB      LEU  25   7.940   8.477   2.617
  134    HG   LEU  25           HG       LEU  25   5.441   8.985   1.017
  135   HD11  LEU  25          1HD1      LEU  25   7.494   6.861   0.763
  136   HD12  LEU  25          2HD1      LEU  25   6.438   7.571  -0.457
  137   HD13  LEU  25          3HD1      LEU  25   5.799   6.380   0.675
  138   HD21  LEU  25          1HD2      LEU  25   6.138   7.284   3.396
  139   HD22  LEU  25          2HD2      LEU  25   4.684   7.021   2.432
  140   HD23  LEU  25          3HD2      LEU  25   4.919   8.553   3.275
  141    H    TYR  26           H        TYR  26   8.082  10.030   4.939
  142    HA   TYR  26           HA       TYR  26  10.393  11.801   4.506
  143    HB2  TYR  26           1HB      TYR  26   8.846  12.445   6.344
  144    HB3  TYR  26           2HB      TYR  26   9.187  10.909   7.133
  145    HD1  TYR  26           1HD      TYR  26  11.459  13.346   5.450
  146    HD2  TYR  26           2HD      TYR  26  10.372  11.387   9.067
  147    HE1  TYR  26           1HE      TYR  26  13.397  14.361   6.574
  148    HE2  TYR  26           2HE      TYR  26  12.307  12.397  10.202
  149    HH   TYR  26           HH       TYR  26  14.213  13.549   9.917
  150    H    VAL  27           H        VAL  27  12.440  11.160   5.400
  151    HA   VAL  27           HA       VAL  27  13.334   8.674   4.689
  152    HB   VAL  27           HB       VAL  27  15.250   9.047   6.261
  153   HG11  VAL  27          1HG1      VAL  27  16.212  10.689   4.936
  154   HG12  VAL  27          2HG1      VAL  27  14.922  10.070   3.904
  155   HG13  VAL  27          3HG1      VAL  27  14.703  11.587   4.776
  156   HG21  VAL  27          1HG2      VAL  27  15.061  10.418   7.997
  157   HG22  VAL  27          2HG2      VAL  27  14.658  11.763   6.930
  158   HG23  VAL  27          3HG2      VAL  27  13.381  10.717   7.551
  159    H    LEU  28           H        LEU  28  11.578   9.546   7.527
  160    HA   LEU  28           HA       LEU  28  12.087   6.897   8.705
  161    HB2  LEU  28           1HB      LEU  28  11.021   9.424   9.954
  162    HB3  LEU  28           2HB      LEU  28  11.150   7.875  10.785
  163    HG   LEU  28           HG       LEU  28  13.537   9.299   9.630
  164   HD11  LEU  28          1HD1      LEU  28  11.949  10.121  11.834
  165   HD12  LEU  28          2HD1      LEU  28  13.477  10.791  11.264
  166   HD13  LEU  28          3HD1      LEU  28  13.474   9.490  12.456
  167   HD21  LEU  28          1HD2      LEU  28  14.543   7.892  11.590
  168   HD22  LEU  28          2HD2      LEU  28  14.187   7.132  10.039
  169   HD23  LEU  28          3HD2      LEU  28  13.073   6.938  11.394
  170    H    GLU  29           H        GLU  29   9.524   9.200   7.885
  171    HA   GLU  29           HA       GLU  29   7.418   7.367   8.564
  172    HB2  GLU  29           1HB      GLU  29   7.147   9.840   6.863
  173    HB3  GLU  29           2HB      GLU  29   5.914   9.060   7.843
  174    HG2  GLU  29           1HG      GLU  29   8.338  10.088   9.210
  175    HG3  GLU  29           2HG      GLU  29   7.147  11.252   8.632
  176    H    ARG  30           H        ARG  30   9.037   5.992   6.912
  177    HA   ARG  30           HA       ARG  30   7.321   5.573   4.594
  178    HB2  ARG  30           1HB      ARG  30   9.023   5.699   2.976
  179    HB3  ARG  30           2HB      ARG  30   9.261   7.122   3.981
  180    HG2  ARG  30           1HG      ARG  30  11.103   6.105   5.109
  181    HG3  ARG  30           2HG      ARG  30  10.788   4.554   4.328
  182    HD2  ARG  30           1HD      ARG  30  11.579   5.279   2.278
  183    HD3  ARG  30           2HD      ARG  30  11.321   6.979   2.666
  184    HE   ARG  30           HE       ARG  30  13.359   7.020   3.778
  185   HH11  ARG  30          2HH1      ARG  30  12.579   3.796   2.723
  186   HH12  ARG  30          1HH1      ARG  30  14.174   3.179   2.999
  187   HH21  ARG  30          2HH2      ARG  30  15.463   6.221   4.145
  188   HH22  ARG  30          1HH2      ARG  30  15.814   4.559   3.809
  189    H    LEU  31           H        LEU  31   7.040   3.467   4.148
  190    HA   LEU  31           HA       LEU  31   8.800   1.543   5.520
  191    HB2  LEU  31           1HB      LEU  31   5.863   1.682   5.177
  192    HB3  LEU  31           2HB      LEU  31   6.601   0.084   5.082
  193    HG   LEU  31           HG       LEU  31   7.610   0.517   7.338
  194   HD11  LEU  31          1HD1      LEU  31   7.110   2.359   8.593
  195   HD12  LEU  31          2HD1      LEU  31   5.598   2.670   7.740
  196   HD13  LEU  31          3HD1      LEU  31   7.138   3.081   6.984
  197   HD21  LEU  31          1HD2      LEU  31   5.717  -0.900   7.234
  198   HD22  LEU  31          2HD2      LEU  31   4.623   0.460   6.981
  199   HD23  LEU  31          3HD2      LEU  31   5.411   0.241   8.543
  200    H    CYS  32           H        CYS  32  10.189   0.823   4.022
  201    HA   CYS  32           HA       CYS  32   9.601   0.601   1.261
  202    HB2  CYS  32           1HB      CYS  32  11.777  -1.021   2.515
  203    HB3  CYS  32           2HB      CYS  32  11.782  -0.127   1.000
  204    HG   CYS  32           HG       CYS  32  13.616   1.170   2.542
  205    H    VAL  33           H        VAL  33   7.894  -0.685   0.765
  206    HA   VAL  33           HA       VAL  33   8.119  -3.526   1.519
  207    HB   VAL  33           HB       VAL  33   5.588  -1.913   1.175
  208   HG11  VAL  33          1HG1      VAL  33   4.624  -4.177   2.064
  209   HG12  VAL  33          2HG1      VAL  33   4.948  -3.960   0.342
  210   HG13  VAL  33          3HG1      VAL  33   6.091  -4.848   1.351
  211   HG21  VAL  33          1HG2      VAL  33   7.187  -2.110   3.382
  212   HG22  VAL  33          2HG2      VAL  33   5.460  -1.754   3.408
  213   HG23  VAL  33          3HG2      VAL  33   6.023  -3.408   3.651
  214    H    ASN  34           H        ASN  34   9.005  -4.350  -0.309
  215    HA   ASN  34           HA       ASN  34   9.217  -5.018  -2.475
  216    HB2  ASN  34           1HB      ASN  34   6.234  -4.733  -2.191
  217    HB3  ASN  34           2HB      ASN  34   6.958  -5.257  -3.709
  218   HD21  ASN  34          1HD2      ASN  34   6.769  -5.994  -0.269
  219   HD22  ASN  34          2HD2      ASN  34   7.012  -7.697  -0.437
  220    H    GLY  35           H        GLY  35   9.705  -2.280  -2.004
  221    HA2  GLY  35           1HA      GLY  35  10.388  -0.641  -3.559
  222    HA3  GLY  35           2HA      GLY  35   9.197  -1.257  -4.695
  223    H    HIS  36           H        HIS  36   6.968  -1.238  -2.917
  224    HA   HIS  36           HA       HIS  36   6.239   1.527  -3.158
  225    HB2  HIS  36           1HB      HIS  36   4.646  -0.637  -1.785
  226    HB3  HIS  36           2HB      HIS  36   4.044   0.845  -2.523
  227    HD1  HIS  36           1HD      HIS  36   5.453   0.637  -5.261
  228    HD2  HIS  36           2HD      HIS  36   3.483  -2.506  -3.391
  229    HE1  HIS  36           1HE      HIS  36   4.825  -0.955  -7.104
  230    H    PHE  37           H        PHE  37   5.986   3.038  -1.585
  231    HA   PHE  37           HA       PHE  37   6.905   2.284   1.108
  232    HB2  PHE  37           1HB      PHE  37   6.990   4.993  -0.237
  233    HB3  PHE  37           2HB      PHE  37   7.595   4.626   1.375
  234    HD1  PHE  37           1HD      PHE  37   8.106   4.016  -2.224
  235    HD2  PHE  37           2HD      PHE  37   9.724   3.651   1.696
  236    HE1  PHE  37           1HE      PHE  37  10.295   3.433  -3.185
  237    HE2  PHE  37           2HE      PHE  37  11.915   3.069   0.741
  238    HZ   PHE  37           HZ       PHE  37  12.203   2.959  -1.703
  239    H    PHE  38           H        PHE  38   5.804   3.034   2.920
  240    HA   PHE  38           HA       PHE  38   3.300   4.482   2.496
  241    HB2  PHE  38           1HB      PHE  38   3.350   1.988   4.187
  242    HB3  PHE  38           2HB      PHE  38   1.950   2.895   3.625
  243    HD1  PHE  38           1HD      PHE  38   4.897   1.110   2.187
  244    HD2  PHE  38           2HD      PHE  38   0.740   1.984   1.908
  245    HE1  PHE  38           1HE      PHE  38   4.716  -0.385   0.241
  246    HE2  PHE  38           2HE      PHE  38   0.553   0.490  -0.038
  247    HZ   PHE  38           HZ       PHE  38   2.543  -0.698  -0.873
  248    H    HIS  39           H        HIS  39   2.315   5.180   4.583
  249    HA   HIS  39           HA       HIS  39   4.345   6.321   6.257
  250    HB2  HIS  39           1HB      HIS  39   1.355   6.496   6.129
  251    HB3  HIS  39           2HB      HIS  39   2.205   7.101   7.548
  252    HD2  HIS  39           2HD      HIS  39   4.722   8.480   5.798
  253    HE1  HIS  39           1HE      HIS  39   1.573  10.816   4.175
  254    HE2  HIS  39           2HE      HIS  39   4.067  10.580   4.436
  255    H    ARG  40           H        ARG  40   4.656   5.991   8.476
  256    HA   ARG  40           HA       ARG  40   4.488   3.308   9.338
  257    HB2  ARG  40           1HB      ARG  40   5.328   5.889  10.576
  258    HB3  ARG  40           2HB      ARG  40   5.035   4.516  11.635
  259    HG2  ARG  40           1HG      ARG  40   6.811   4.218   9.252
  260    HG3  ARG  40           2HG      ARG  40   7.420   4.956  10.735
  261    HD2  ARG  40           1HD      ARG  40   6.071   2.264  10.636
  262    HD3  ARG  40           2HD      ARG  40   7.817   2.486  10.529
  263    HE   ARG  40           HE       ARG  40   6.169   2.735  12.886
  264   HH11  ARG  40          2HH1      ARG  40   9.215   3.500  11.385
  265   HH12  ARG  40          1HH1      ARG  40  10.045   3.734  12.887
  266   HH21  ARG  40          2HH2      ARG  40   7.250   3.041  14.871
  267   HH22  ARG  40          1HH2      ARG  40   8.927   3.471  14.870
  268    H    SER  41           H        SER  41   2.190   5.774   9.319
  269    HA   SER  41           HA       SER  41   0.696   4.648  11.575
  270    HB2  SER  41           1HB      SER  41   0.576   7.240  10.077
  271    HB3  SER  41           2HB      SER  41  -0.856   6.673  10.937
  272    HG   SER  41           HG       SER  41   0.323   6.672  12.841
  273    H    CYS  42           H        CYS  42   0.222   5.534   8.161
  274    HA   CYS  42           HA       CYS  42  -2.346   4.473   7.866
  275    HB2  CYS  42           1HB      CYS  42  -0.150   4.712   5.798
  276    HB3  CYS  42           2HB      CYS  42  -1.853   4.441   5.444
  277    H    PHE  43           H        PHE  43   0.806   2.983   7.152
  278    HA   PHE  43           HA       PHE  43  -0.042   0.538   6.209
  279    HB2  PHE  43           1HB      PHE  43   2.358   1.505   6.517
  280    HB3  PHE  43           2HB      PHE  43   2.299   0.701   8.081
  281    HD1  PHE  43           2HD      PHE  43   1.648  -0.018   4.480
  282    HD2  PHE  43           1HD      PHE  43   3.074  -1.455   8.224
  283    HE1  PHE  43           2HE      PHE  43   2.312  -2.132   3.412
  284    HE2  PHE  43           1HE      PHE  43   3.741  -3.571   7.162
  285    HZ   PHE  43           HZ       PHE  43   3.359  -3.913   4.753
  286    H    ARG  44           H        ARG  44  -1.668  -0.565   7.134
  287    HA   ARG  44           HA       ARG  44  -1.207  -1.706   9.763
  288    HB2  ARG  44           1HB      ARG  44  -3.725  -0.147   9.149
  289    HB3  ARG  44           2HB      ARG  44  -3.428  -1.084  10.607
  290    HG2  ARG  44           1HG      ARG  44  -1.669   0.407  11.274
  291    HG3  ARG  44           2HG      ARG  44  -1.784   1.286   9.748
  292    HD2  ARG  44           1HD      ARG  44  -4.034   2.008  10.308
  293    HD3  ARG  44           2HD      ARG  44  -3.982   1.073  11.802
  294    HE   ARG  44           HE       ARG  44  -2.710   3.623  11.290
  295   HH11  ARG  44          2HH1      ARG  44  -2.893   0.810  13.333
  296   HH12  ARG  44          1HH1      ARG  44  -2.180   1.597  14.702
  297   HH21  ARG  44          2HH2      ARG  44  -1.771   4.670  13.085
  298   HH22  ARG  44          1HH2      ARG  44  -1.543   3.793  14.560
  299    H    CYS  45           H        CYS  45  -3.046  -3.294  10.293
  300    HA   CYS  45           HA       CYS  45  -3.168  -5.244   8.316
  301    HB2  CYS  45           1HB      CYS  45  -3.537  -5.583  10.780
  302    HB3  CYS  45           2HB      CYS  45  -5.152  -4.913  10.573
  303    H    HIS  46           H        HIS  46  -5.123  -6.149   7.282
  304    HA   HIS  46           HA       HIS  46  -6.735  -3.981   6.147
  305    HB2  HIS  46           1HB      HIS  46  -5.596  -5.295   4.489
  306    HB3  HIS  46           2HB      HIS  46  -6.180  -6.797   5.200
  307    HD1  HIS  46           1HD      HIS  46  -7.084  -4.145   2.807
  308    HD2  HIS  46           2HD      HIS  46  -8.964  -7.309   4.735
  309    HE1  HIS  46           1HE      HIS  46  -9.243  -4.499   1.568
  310    H    THR  47           H        THR  47  -6.979  -6.112   8.604
  311    HA   THR  47           HA       THR  47  -9.899  -6.364   8.282
  312    HB   THR  47           HB       THR  47  -7.940  -8.310   9.485
  313    HG1  THR  47           1HG      THR  47  -8.995  -8.190   7.157
  314   HG21  THR  47          1HG2      THR  47  -9.803  -9.580  10.376
  315   HG22  THR  47          2HG2      THR  47 -10.944  -8.368   9.792
  316   HG23  THR  47          3HG2      THR  47  -9.804  -7.961  11.075
  317    H    CYS  48           H        CYS  48  -7.230  -5.986  10.581
  318    HA   CYS  48           HA       CYS  48  -9.142  -4.876  12.526
  319    HB2  CYS  48           1HB      CYS  48  -7.486  -5.403  14.254
  320    HB3  CYS  48           2HB      CYS  48  -7.922  -6.844  13.342
  321    H    GLU  49           H        GLU  49  -6.905  -3.973  10.273
  322    HA   GLU  49           HA       GLU  49  -5.625  -2.120   9.898
  323    HB2  GLU  49           1HB      GLU  49  -7.878  -0.982  11.552
  324    HB3  GLU  49           2HB      GLU  49  -6.674   0.019  10.753
  325    HG2  GLU  49           1HG      GLU  49  -7.470  -0.450   8.655
  326    HG3  GLU  49           2HG      GLU  49  -8.175  -1.988   9.149
  327    H    ALA  50           H        ALA  50  -4.341  -3.562  11.697
  328    HA   ALA  50           HA       ALA  50  -3.650  -1.771  13.923
  329    HB1  ALA  50           1HB      ALA  50  -4.307  -4.042  14.553
  330    HB2  ALA  50           2HB      ALA  50  -3.004  -4.695  13.558
  331    HB3  ALA  50           3HB      ALA  50  -2.626  -3.715  14.974
  332    H    THR  51           H        THR  51  -1.653  -0.909  14.123
  333    HA   THR  51           HA       THR  51  -0.020  -0.415  12.001
  334    HB   THR  51           HB       THR  51   0.959  -0.726  14.846
  335    HG1  THR  51           1HG      THR  51  -0.039   1.101  15.255
  336   HG21  THR  51          1HG2      THR  51   2.714  -0.503  13.087
  337   HG22  THR  51          2HG2      THR  51   2.687   0.835  14.236
  338   HG23  THR  51          3HG2      THR  51   1.995   1.039  12.627
  339    H    LEU  52           H        LEU  52   0.707  -1.953  10.650
  340    HA   LEU  52           HA       LEU  52   1.641  -4.505  11.568
  341    HB2  LEU  52           1HB      LEU  52   1.844  -3.217   8.850
  342    HB3  LEU  52           2HB      LEU  52   2.183  -4.908   9.213
  343    HG   LEU  52           HG       LEU  52  -0.514  -3.584   9.493
  344   HD11  LEU  52          1HD1      LEU  52   0.632  -4.052   7.142
  345   HD12  LEU  52          2HD1      LEU  52  -1.088  -4.315   7.422
  346   HD13  LEU  52          3HD1      LEU  52   0.030  -5.678   7.468
  347   HD21  LEU  52          1HD2      LEU  52   0.132  -6.520   9.521
  348   HD22  LEU  52          2HD2      LEU  52  -1.377  -5.725   9.967
  349   HD23  LEU  52          3HD2      LEU  52   0.048  -5.552  10.993
  350    H    TRP  53           H        TRP  53   3.411  -4.238  12.878
  351    HA   TRP  53           HA       TRP  53   5.599  -2.541  12.277
  352    HB2  TRP  53           1HB      TRP  53   5.904  -4.976  13.998
  353    HB3  TRP  53           2HB      TRP  53   6.592  -3.368  14.208
  354    HD1  TRP  53           HD       TRP  53   3.259  -5.253  14.658
  355    HE1  TRP  53           1HE      TRP  53   1.851  -3.992  16.405
  356    HE3  TRP  53           3HE      TRP  53   6.264  -1.173  15.331
  357    HZ2  TRP  53           2HZ      TRP  53   1.995  -1.586  17.874
  358    HZ3  TRP  53           3HZ      TRP  53   5.557   0.563  16.925
  359    HH2  TRP  53           HH       TRP  53   3.466   0.359  18.169
  360    HA   PRO  54           HA       PRO  54   7.979  -4.884   9.429
  361    HB2  PRO  54           1HB      PRO  54  10.504  -4.235  10.187
  362    HB3  PRO  54           2HB      PRO  54   9.430  -3.103   9.358
  363    HG2  PRO  54           1HG      PRO  54  10.056  -3.328  12.276
  364    HG3  PRO  54           2HG      PRO  54   9.915  -1.874  11.271
  365    HD2  PRO  54           1HD      PRO  54   7.926  -2.713  12.905
  366    HD3  PRO  54           2HD      PRO  54   7.612  -1.874  11.372
  367    H    GLY  55           H        GLY  55   7.214  -6.920  10.476
  368    HA2  GLY  55           1HA      GLY  55   8.932  -8.905  10.694
  369    HA3  GLY  55           2HA      GLY  55   9.150  -8.171  12.276
  370    H    GLY  56           H        GLY  56   6.135  -7.438  11.986
  371    HA2  GLY  56           1HA      GLY  56   5.156 -10.082  12.873
  372    HA3  GLY  56           2HA      GLY  56   4.657  -8.570  13.616
  373    H    TYR  57           H        TYR  57   4.979  -9.421  10.185
  374    HA   TYR  57           HA       TYR  57   2.125  -9.544   9.816
  375    HB2  TYR  57           1HB      TYR  57   1.795  -7.599   8.558
  376    HB3  TYR  57           2HB      TYR  57   2.808  -7.052   9.889
  377    HD1  TYR  57           2HD      TYR  57   5.344  -6.924   9.451
  378    HD2  TYR  57           1HD      TYR  57   2.444  -7.211   6.351
  379    HE1  TYR  57           2HE      TYR  57   6.983  -6.039   7.845
  380    HE2  TYR  57           1HE      TYR  57   4.075  -6.327   4.736
  381    HH   TYR  57           HH       TYR  57   7.195  -6.312   5.095
  382    H    GLU  58           H        GLU  58   1.562  -9.898   7.495
  383    HA   GLU  58           HA       GLU  58   3.731 -10.763   5.775
  384    HB2  GLU  58           1HB      GLU  58   1.913 -12.636   7.193
  385    HB3  GLU  58           2HB      GLU  58   2.260 -12.985   5.505
  386    HG2  GLU  58           1HG      GLU  58   4.425 -12.489   7.522
  387    HG3  GLU  58           2HG      GLU  58   3.740 -14.088   7.235
  388    H    GLN  59           H        GLN  59   3.127 -10.998   3.602
  389    HA   GLN  59           HA       GLN  59   0.514  -9.815   2.968
  390    HB2  GLN  59           1HB      GLN  59   2.355  -8.514   2.121
  391    HB3  GLN  59           2HB      GLN  59   3.084  -9.936   1.387
  392    HG2  GLN  59           1HG      GLN  59   0.931 -10.084   0.005
  393    HG3  GLN  59           2HG      GLN  59   0.644  -8.427   0.535
  394   HE21  GLN  59          1HE2      GLN  59   0.748  -8.355  -1.945
  395   HE22  GLN  59          2HE2      GLN  59   2.288  -7.953  -2.615
  396    H    HIS  60           H        HIS  60  -0.911 -11.436   2.710
  397    HA   HIS  60           HA       HIS  60  -0.400 -14.022   1.847
  398    HB2  HIS  60           1HB      HIS  60  -2.521 -13.148   2.915
  399    HB3  HIS  60           2HB      HIS  60  -2.975 -12.531   1.329
  400    HD1  HIS  60           1HD      HIS  60  -3.863 -14.200  -0.373
  401    HD2  HIS  60           2HD      HIS  60  -2.540 -15.982   3.139
  402    HE1  HIS  60           1HE      HIS  60  -4.648 -16.586  -0.493
  403    HA   PRO  61           HA       PRO  61   0.501 -13.499  -2.451
  404    HB2  PRO  61           1HB      PRO  61   0.302 -16.110  -3.169
  405    HB3  PRO  61           2HB      PRO  61   1.682 -15.462  -2.274
  406    HG2  PRO  61           1HG      PRO  61  -0.702 -16.958  -1.255
  407    HG3  PRO  61           2HG      PRO  61   1.006 -17.142  -0.815
  408    HD2  PRO  61           1HD      PRO  61  -0.755 -15.772   0.720
  409    HD3  PRO  61           2HD      PRO  61   0.963 -15.334   0.614
  410    H    GLY  62           H        GLY  62  -2.191 -15.681  -1.590
  411    HA2  GLY  62           1HA      GLY  62  -3.592 -15.931  -3.860
  412    HA3  GLY  62           2HA      GLY  62  -4.392 -15.603  -2.330
  413    H    ASP  63           H        ASP  63  -5.106 -13.516  -1.863
  414    HA   ASP  63           HA       ASP  63  -6.024 -12.007  -4.036
  415    HB2  ASP  63           1HB      ASP  63  -5.772 -11.377  -1.098
  416    HB3  ASP  63           2HB      ASP  63  -6.472 -10.238  -2.244
  417    H    GLY  64           H        GLY  64  -3.518 -11.123  -1.647
  418    HA2  GLY  64           1HA      GLY  64  -1.368 -10.309  -2.522
  419    HA3  GLY  64           2HA      GLY  64  -2.286  -9.451  -3.750
  420    H    HIS  65           H        HIS  65  -2.841  -9.690  -0.253
  421    HA   HIS  65           HA       HIS  65  -2.417  -6.781  -0.074
  422    HB2  HIS  65           1HB      HIS  65  -4.654  -8.451   1.051
  423    HB3  HIS  65           2HB      HIS  65  -4.231  -6.893   1.755
  424    HD1  HIS  65           1HD      HIS  65  -4.278  -4.841  -0.085
  425    HD2  HIS  65           2HD      HIS  65  -6.440  -8.276  -0.974
  426    HE1  HIS  65           1HE      HIS  65  -5.927  -4.158  -1.857
  427    H    PHE  66           H        PHE  66  -2.468  -6.237   2.471
  428    HA   PHE  66           HA       PHE  66  -0.482  -8.042   3.686
  429    HB2  PHE  66           1HB      PHE  66  -0.820  -5.051   3.960
  430    HB3  PHE  66           2HB      PHE  66   0.283  -6.007   4.944
  431    HD1  PHE  66           1HD      PHE  66   2.301  -6.945   3.999
  432    HD2  PHE  66           2HD      PHE  66  -0.367  -4.629   1.626
  433    HE1  PHE  66           1HE      PHE  66   4.038  -6.721   2.271
  434    HE2  PHE  66           2HE      PHE  66   1.365  -4.401  -0.106
  435    HZ   PHE  66           HZ       PHE  66   3.571  -5.449   0.215
  436    H    TYR  67           H        TYR  67  -1.091  -9.076   5.461
  437    HA   TYR  67           HA       TYR  67  -3.140  -7.857   7.183
  438    HB2  TYR  67           1HB      TYR  67  -3.008 -10.807   6.545
  439    HB3  TYR  67           2HB      TYR  67  -4.249  -9.970   7.471
  440    HD1  TYR  67           2HD      TYR  67  -2.902 -10.560   4.099
  441    HD2  TYR  67           1HD      TYR  67  -6.022  -8.775   6.376
  442    HE1  TYR  67           2HE      TYR  67  -4.213 -10.243   2.043
  443    HE2  TYR  67           1HE      TYR  67  -7.343  -8.454   4.326
  444    HH   TYR  67           HH       TYR  67  -6.655  -9.986   1.439
  445    H    CYS  68           H        CYS  68  -3.166  -8.759   9.390
  446    HA   CYS  68           HA       CYS  68  -0.507  -8.899  10.436
  447    HB2  CYS  68           1HB      CYS  68  -1.568  -8.970  12.617
  448    HB3  CYS  68           2HB      CYS  68  -2.366  -7.759  11.619
  449    H    LEU  69           H        LEU  69  -0.027 -10.610  12.175
  450    HA   LEU  69           HA       LEU  69  -0.097 -13.174  10.880
  451    HB2  LEU  69           1HB      LEU  69   0.882 -12.700  13.670
  452    HB3  LEU  69           2HB      LEU  69   1.438 -13.882  12.488
  453    HG   LEU  69           HG       LEU  69   1.931 -10.907  12.365
  454   HD11  LEU  69          1HD1      LEU  69   3.209 -12.905  13.881
  455   HD12  LEU  69          2HD1      LEU  69   3.726 -11.239  13.619
  456   HD13  LEU  69          3HD1      LEU  69   4.284 -12.515  12.538
  457   HD21  LEU  69          1HD2      LEU  69   1.730 -12.107  10.168
  458   HD22  LEU  69          2HD2      LEU  69   3.114 -13.086  10.656
  459   HD23  LEU  69          3HD2      LEU  69   3.291 -11.341  10.464
  460    H    GLN  70           H        GLN  70  -2.514 -11.754  12.264
  461    HA   GLN  70           HA       GLN  70  -3.444 -14.170  13.669
  462    HB2  GLN  70           1HB      GLN  70  -3.058 -12.322  15.251
  463    HB3  GLN  70           2HB      GLN  70  -4.151 -11.304  14.322
  464    HG2  GLN  70           1HG      GLN  70  -6.028 -12.501  14.979
  465    HG3  GLN  70           2HG      GLN  70  -5.082 -13.912  15.450
  466   HE21  GLN  70          1HE2      GLN  70  -6.160 -10.742  16.366
  467   HE22  GLN  70          2HE2      GLN  70  -5.716 -10.849  18.032
  468    H    HIS  71           H        HIS  71  -3.875 -12.080  11.089
  469    HA   HIS  71           HA       HIS  71  -6.621 -13.065  10.683
  470    HB2  HIS  71           1HB      HIS  71  -5.495 -10.316  10.266
  471    HB3  HIS  71           2HB      HIS  71  -6.844 -10.872   9.280
  472    HD2  HIS  71           2HD      HIS  71  -7.784 -12.437  12.401
  473    HE1  HIS  71           1HE      HIS  71  -9.042  -8.422  12.944
  474    HE2  HIS  71           2HE      HIS  71  -9.158 -10.776  13.831
  475    H    LEU  72           H        LEU  72  -3.450 -12.728   9.488
  476    HA   LEU  72           HA       LEU  72  -3.769 -12.733   6.737
  477    HB2  LEU  72           1HB      LEU  72  -1.614 -12.550   7.924
  478    HB3  LEU  72           2HB      LEU  72  -1.713 -14.263   8.326
  479    HG   LEU  72           HG       LEU  72  -1.886 -14.439   5.660
  480   HD11  LEU  72          1HD1      LEU  72  -0.805 -11.764   6.234
  481   HD12  LEU  72          2HD1      LEU  72  -1.596 -12.387   4.786
  482   HD13  LEU  72          3HD1      LEU  72   0.111 -12.726   5.074
  483   HD21  LEU  72          1HD2      LEU  72   0.551 -14.865   5.674
  484   HD22  LEU  72          2HD2      LEU  72  -0.296 -15.644   7.011
  485   HD23  LEU  72          3HD2      LEU  72   0.634 -14.171   7.293
  486    HA   PRO  73           HA       PRO  73  -5.970 -16.579   6.204
  487    HB2  PRO  73           1HB      PRO  73  -6.180 -16.389   3.504
  488    HB3  PRO  73           2HB      PRO  73  -7.208 -15.475   4.615
  489    HG2  PRO  73           1HG      PRO  73  -4.762 -14.588   3.135
  490    HG3  PRO  73           2HG      PRO  73  -6.294 -13.730   3.380
  491    HD2  PRO  73           1HD      PRO  73  -4.079 -13.205   4.847
  492    HD3  PRO  73           2HD      PRO  73  -5.720 -13.054   5.508
  493    H    GLN  74           H        GLN  74  -5.711 -18.396   4.433
  494    HA   GLN  74           HA       GLN  74  -2.887 -18.825   3.793
  495    HB2  GLN  74           1HB      GLN  74  -4.547 -20.421   5.666
  496    HB3  GLN  74           2HB      GLN  74  -3.502 -21.317   4.571
  497    HG2  GLN  74           1HG      GLN  74  -2.518 -19.096   6.339
  498    HG3  GLN  74           2HG      GLN  74  -2.534 -20.791   6.823
  499   HE21  GLN  74          1HE2      GLN  74  -0.688 -18.400   5.526
  500   HE22  GLN  74          2HE2      GLN  74   0.506 -19.359   4.726
  501    H    THR  75           H        THR  75  -2.917 -19.034   1.653
  502    HA   THR  75           HA       THR  75  -5.082 -19.754   0.069
  503    HB   THR  75           HB       THR  75  -2.274 -20.381  -0.793
  504    HG1  THR  75           1HG      THR  75  -1.848 -18.393  -0.113
  505   HG21  THR  75          1HG2      THR  75  -3.603 -20.791  -2.600
  506   HG22  THR  75          2HG2      THR  75  -3.384 -19.055  -2.826
  507   HG23  THR  75          3HG2      THR  75  -4.855 -19.668  -2.071
  508    H    ASP  76           H        ASP  76  -6.179 -21.601   0.242
  509    HA   ASP  76           HA       ASP  76  -5.205 -24.023   1.233
  510    HB2  ASP  76           1HB      ASP  76  -7.581 -23.328  -0.480
  511    HB3  ASP  76           2HB      ASP  76  -7.242 -24.994  -0.018
  512    H    SER  77           H        SER  77  -5.662 -22.971  -2.132
  513    HA   SER  77           HA       SER  77  -4.891 -25.287  -3.432
  514    HB2  SER  77           1HB      SER  77  -5.746 -22.994  -4.363
  515    HB3  SER  77           2HB      SER  77  -4.028 -22.617  -4.496
  516    HG   SER  77           HG       SER  77  -5.180 -23.687  -6.353
  517    H    GLY  78           H        GLY  78  -2.978 -26.214  -4.025
  518    HA2  GLY  78           1HA      GLY  78  -0.512 -24.908  -3.061
  519    HA3  GLY  78           2HA      GLY  78  -0.826 -26.608  -2.747
  520    HA   PRO  79           HA       PRO  79   1.535 -25.976  -6.786
  521    HB2  PRO  79           1HB      PRO  79   3.832 -27.199  -6.016
  522    HB3  PRO  79           2HB      PRO  79   3.546 -25.469  -5.799
  523    HG2  PRO  79           1HG      PRO  79   3.283 -27.695  -3.815
  524    HG3  PRO  79           2HG      PRO  79   3.993 -26.084  -3.602
  525    HD2  PRO  79           1HD      PRO  79   1.497 -26.701  -2.753
  526    HD3  PRO  79           2HD      PRO  79   1.938 -25.078  -3.322
  527    H    SER  80           H        SER  80   1.238 -27.487  -8.301
  528    HA   SER  80           HA       SER  80   1.615 -30.298  -7.712
  529    HB2  SER  80           1HB      SER  80  -0.623 -30.974  -8.438
  530    HB3  SER  80           2HB      SER  80  -0.731 -29.906  -7.038
  531    HG   SER  80           HG       SER  80  -1.951 -29.602  -9.310
  532    H    SER  81           H        SER  81   1.186 -31.637  -9.737
  533    HA   SER  81           HA       SER  81   2.586 -30.389 -11.916
  534    HB2  SER  81           1HB      SER  81   2.648 -32.888 -11.033
  535    HB3  SER  81           2HB      SER  81   1.337 -33.089 -12.194
  536    HG   SER  81           HG       SER  81   2.936 -31.911 -13.650
  537    H    GLY  82           H        GLY  82   1.829 -30.384 -14.134
  538    HA2  GLY  82           1HA      GLY  82  -0.818 -30.876 -14.911
  539    HA3  GLY  82           2HA      GLY  82  -0.707 -29.193 -14.414
  Start of MODEL    3
    1    H1   GLY   1           H        GLY   1   7.987  19.459 -44.294
    2    HA2  GLY   1           1HA      GLY   1   6.877  22.114 -43.615
    3    HA3  GLY   1           2HA      GLY   1   5.942  20.631 -43.498
    4    H    SER   2           H        SER   2   5.802  21.875 -41.282
    5    HA   SER   2           HA       SER   2   7.150  20.261 -39.386
    6    HB2  SER   2           1HB      SER   2   8.395  22.127 -38.241
    7    HB3  SER   2           2HB      SER   2   9.071  21.647 -39.797
    8    HG   SER   2           HG       SER   2   7.979  23.440 -40.723
    9    H    SER   3           H        SER   3   5.966  20.169 -37.574
   10    HA   SER   3           HA       SER   3   4.307  22.433 -36.789
   11    HB2  SER   3           1HB      SER   3   3.046  20.794 -38.381
   12    HB3  SER   3           2HB      SER   3   2.991  19.739 -36.969
   13    HG   SER   3           HG       SER   3   2.223  21.965 -36.006
   14    H    GLY   4           H        GLY   4   4.874  22.746 -34.741
   15    HA2  GLY   4           1HA      GLY   4   4.307  21.025 -32.656
   16    HA3  GLY   4           2HA      GLY   4   5.977  20.698 -33.094
   17    H    SER   5           H        SER   5   5.224  21.660 -30.582
   18    HA   SER   5           HA       SER   5   6.313  24.399 -30.655
   19    HB2  SER   5           1HB      SER   5   4.133  23.192 -29.001
   20    HB3  SER   5           2HB      SER   5   5.119  24.475 -28.300
   21    HG   SER   5           HG       SER   5   3.882  24.724 -30.831
   22    H    SER   6           H        SER   6   6.100  21.436 -28.705
   23    HA   SER   6           HA       SER   6   8.894  21.578 -28.059
   24    HB2  SER   6           1HB      SER   6   8.660  21.761 -25.646
   25    HB3  SER   6           2HB      SER   6   7.917  23.165 -26.411
   26    HG   SER   6           HG       SER   6   5.887  22.065 -26.176
   27    H    GLY   7           H        GLY   7   9.673  19.575 -27.815
   28    HA2  GLY   7           1HA      GLY   7   7.714  17.402 -27.430
   29    HA3  GLY   7           2HA      GLY   7   9.226  17.243 -28.310
   30    H    GLN   8           H        GLN   8   8.532  18.632 -25.112
   31    HA   GLN   8           HA       GLN   8  10.748  17.140 -23.993
   32    HB2  GLN   8           1HB      GLN   8   8.849  19.137 -22.751
   33    HB3  GLN   8           2HB      GLN   8  10.219  18.410 -21.919
   34    HG2  GLN   8           1HG      GLN   8  11.564  19.369 -23.951
   35    HG3  GLN   8           2HG      GLN   8  10.177  20.447 -24.086
   36   HE21  GLN   8          1HE2      GLN   8  12.982  20.974 -23.361
   37   HE22  GLN   8          2HE2      GLN   8  12.923  21.759 -21.823
   38    H    HIS   9           H        HIS   9  10.340  15.051 -23.598
   39    HA   HIS   9           HA       HIS   9   7.864  13.900 -23.049
   40    HB2  HIS   9           1HB      HIS   9   9.205  11.976 -22.141
   41    HB3  HIS   9           2HB      HIS   9   9.682  12.505 -23.752
   42    HD1  HIS   9           1HD      HIS   9  11.024  11.805 -20.459
   43    HD2  HIS   9           2HD      HIS   9  12.097  14.191 -23.687
   44    HE1  HIS   9           1HE      HIS   9  13.449  12.368 -20.103
   45    H    GLN  10           H        GLN  10  10.439  14.840 -20.777
   46    HA   GLN  10           HA       GLN  10   8.626  15.689 -18.785
   47    HB2  GLN  10           1HB      GLN  10   8.734  13.970 -17.179
   48    HB3  GLN  10           2HB      GLN  10   8.387  13.150 -18.695
   49    HG2  GLN  10           1HG      GLN  10  10.977  12.883 -18.814
   50    HG3  GLN  10           2HG      GLN  10  10.886  13.160 -17.075
   51   HE21  GLN  10          1HE2      GLN  10  11.716  10.775 -18.471
   52   HE22  GLN  10          2HE2      GLN  10  10.651   9.511 -17.968
   53    H    GLU  11           H        GLU  11   9.789  16.101 -16.662
   54    HA   GLU  11           HA       GLU  11  12.599  16.788 -17.223
   55    HB2  GLU  11           1HB      GLU  11  12.307  18.667 -15.640
   56    HB3  GLU  11           2HB      GLU  11  11.246  18.786 -17.037
   57    HG2  GLU  11           1HG      GLU  11   9.480  17.678 -15.552
   58    HG3  GLU  11           2HG      GLU  11  10.551  18.083 -14.212
   59    H    ALA  12           H        ALA  12  10.339  15.976 -14.599
   60    HA   ALA  12           HA       ALA  12  12.579  14.658 -13.209
   61    HB1  ALA  12           1HB      ALA  12  11.743  15.367 -11.093
   62    HB2  ALA  12           2HB      ALA  12  11.853  16.794 -12.124
   63    HB3  ALA  12           3HB      ALA  12  10.287  16.040 -11.828
   64    H    GLY  13           H        GLY  13  12.081  12.768 -12.029
   65    HA2  GLY  13           1HA      GLY  13   9.436  11.603 -12.643
   66    HA3  GLY  13           2HA      GLY  13  10.919  10.678 -12.824
   67    H    ALA  14           H        ALA  14   9.632  12.812 -10.274
   68    HA   ALA  14           HA       ALA  14  10.691  11.246  -8.171
   69    HB1  ALA  14           1HB      ALA  14  10.323  13.464  -7.603
   70    HB2  ALA  14           2HB      ALA  14   8.704  13.480  -8.304
   71    HB3  ALA  14           3HB      ALA  14   9.000  12.627  -6.790
   72    H    GLY  15           H        GLY  15   9.367  10.222  -6.446
   73    HA2  GLY  15           1HA      GLY  15   6.721   9.367  -6.863
   74    HA3  GLY  15           2HA      GLY  15   7.808   8.131  -7.478
   75    H    ASP  16           H        ASP  16   7.735  10.241  -4.602
   76    HA   ASP  16           HA       ASP  16   8.023   7.818  -2.951
   77    HB2  ASP  16           1HB      ASP  16  10.065   9.504  -3.261
   78    HB3  ASP  16           2HB      ASP  16   9.211  10.376  -1.992
   79    H    LEU  17           H        LEU  17   5.565   8.338  -3.180
   80    HA   LEU  17           HA       LEU  17   4.816   9.939  -0.829
   81    HB2  LEU  17           1HB      LEU  17   2.977   9.725  -3.169
   82    HB3  LEU  17           2HB      LEU  17   3.039  10.949  -1.903
   83    HG   LEU  17           HG       LEU  17   5.072  10.680  -4.115
   84   HD11  LEU  17          1HD1      LEU  17   2.430  11.892  -4.067
   85   HD12  LEU  17          2HD1      LEU  17   3.502  11.561  -5.427
   86   HD13  LEU  17          3HD1      LEU  17   3.704  13.038  -4.486
   87   HD21  LEU  17          1HD2      LEU  17   6.214  12.336  -3.142
   88   HD22  LEU  17          2HD2      LEU  17   5.304  11.932  -1.686
   89   HD23  LEU  17          3HD2      LEU  17   4.750  13.234  -2.741
   90    H    CYS  18           H        CYS  18   3.566   8.916   0.605
   91    HA   CYS  18           HA       CYS  18   3.171   6.301   0.860
   92    HB2  CYS  18           1HB      CYS  18   2.408   8.043   2.483
   93    HB3  CYS  18           2HB      CYS  18   0.975   8.283   1.489
   94    H    ALA  19           H        ALA  19   1.662   4.712   0.312
   95    HA   ALA  19           HA       ALA  19   0.361   5.154  -2.259
   96    HB1  ALA  19           1HB      ALA  19   1.691   2.973  -1.061
   97    HB2  ALA  19           2HB      ALA  19   0.012   2.488  -1.306
   98    HB3  ALA  19           3HB      ALA  19   0.972   3.062  -2.670
   99    H    LEU  20           H        LEU  20  -0.429   4.842   1.074
  100    HA   LEU  20           HA       LEU  20  -3.175   4.068   0.636
  101    HB2  LEU  20           1HB      LEU  20  -1.440   4.621   2.964
  102    HB3  LEU  20           2HB      LEU  20  -3.165   4.910   3.182
  103    HG   LEU  20           HG       LEU  20  -3.282   2.446   2.153
  104   HD11  LEU  20          1HD1      LEU  20  -1.452   1.120   3.244
  105   HD12  LEU  20          2HD1      LEU  20  -0.589   2.639   3.483
  106   HD13  LEU  20          3HD1      LEU  20  -0.956   2.081   1.851
  107   HD21  LEU  20          1HD2      LEU  20  -4.349   2.981   4.191
  108   HD22  LEU  20          2HD2      LEU  20  -2.813   3.286   5.004
  109   HD23  LEU  20          3HD2      LEU  20  -3.260   1.640   4.551
  110    H    CYS  21           H        CYS  21  -1.768   6.912   2.269
  111    HA   CYS  21           HA       CYS  21  -4.144   8.457   1.764
  112    HB2  CYS  21           1HB      CYS  21  -2.844  10.291   2.881
  113    HB3  CYS  21           2HB      CYS  21  -3.019   8.832   3.849
  114    H    GLY  22           H        GLY  22  -0.739   8.639   0.736
  115    HA2  GLY  22           1HA      GLY  22  -0.121   9.140  -1.516
  116    HA3  GLY  22           2HA      GLY  22  -1.644   9.995  -1.709
  117    H    GLU  23           H        GLU  23   0.614  10.349   0.977
  118    HA   GLU  23           HA       GLU  23   1.005  13.150   0.157
  119    HB2  GLU  23           1HB      GLU  23   0.997  11.878   2.895
  120    HB3  GLU  23           2HB      GLU  23   1.540  13.524   2.599
  121    HG2  GLU  23           1HG      GLU  23  -1.213  12.472   1.990
  122    HG3  GLU  23           2HG      GLU  23  -0.772  13.415   3.412
  123    H    HIS  24           H        HIS  24   3.108  13.998   1.436
  124    HA   HIS  24           HA       HIS  24   5.303  12.851   0.102
  125    HB2  HIS  24           1HB      HIS  24   5.022  15.247   1.001
  126    HB3  HIS  24           2HB      HIS  24   5.561  14.592   2.545
  127    HD1  HIS  24           1HD      HIS  24   7.984  13.241   2.307
  128    HD2  HIS  24           2HD      HIS  24   7.061  16.131  -0.532
  129    HE1  HIS  24           1HE      HIS  24  10.177  13.868   1.248
  130    H    LEU  25           H        LEU  25   7.167  11.803   0.966
  131    HA   LEU  25           HA       LEU  25   6.657  10.325   3.463
  132    HB2  LEU  25           1HB      LEU  25   7.801   9.355   0.859
  133    HB3  LEU  25           2HB      LEU  25   8.036   8.486   2.373
  134    HG   LEU  25           HG       LEU  25   5.287   9.127   1.352
  135   HD11  LEU  25          1HD1      LEU  25   5.378   6.698   0.517
  136   HD12  LEU  25          2HD1      LEU  25   7.127   6.915   0.518
  137   HD13  LEU  25          3HD1      LEU  25   6.111   7.954  -0.480
  138   HD21  LEU  25          1HD2      LEU  25   4.546   7.718   2.961
  139   HD22  LEU  25          2HD2      LEU  25   6.058   8.191   3.737
  140   HD23  LEU  25          3HD2      LEU  25   5.959   6.669   2.850
  141    H    TYR  26           H        TYR  26   8.589   9.582   4.587
  142    HA   TYR  26           HA       TYR  26  10.863  11.403   4.147
  143    HB2  TYR  26           1HB      TYR  26   9.451  11.571   6.305
  144    HB3  TYR  26           2HB      TYR  26  10.246  10.072   6.774
  145    HD1  TYR  26           1HD      TYR  26  11.607  13.056   4.998
  146    HD2  TYR  26           2HD      TYR  26  11.702  10.634   8.495
  147    HE1  TYR  26           1HE      TYR  26  13.530  14.344   5.830
  148    HE2  TYR  26           2HE      TYR  26  13.625  11.916   9.337
  149    HH   TYR  26           HH       TYR  26  14.583  14.865   8.032
  150    H    VAL  27           H        VAL  27  12.984  10.598   4.542
  151    HA   VAL  27           HA       VAL  27  13.603   8.179   3.381
  152    HB   VAL  27           HB       VAL  27  15.277   9.913   3.710
  153   HG11  VAL  27          1HG1      VAL  27  14.368  10.360   6.115
  154   HG12  VAL  27          2HG1      VAL  27  15.582   9.171   6.587
  155   HG13  VAL  27          3HG1      VAL  27  16.069  10.644   5.748
  156   HG21  VAL  27          1HG2      VAL  27  15.800   7.179   4.795
  157   HG22  VAL  27          2HG2      VAL  27  16.330   7.903   3.277
  158   HG23  VAL  27          3HG2      VAL  27  17.088   8.384   4.795
  159    H    LEU  28           H        LEU  28  12.866   8.876   6.739
  160    HA   LEU  28           HA       LEU  28  13.439   6.117   7.510
  161    HB2  LEU  28           1HB      LEU  28  12.724   8.581   9.079
  162    HB3  LEU  28           2HB      LEU  28  12.817   6.979   9.807
  163    HG   LEU  28           HG       LEU  28  15.130   8.316   8.412
  164   HD11  LEU  28          1HD1      LEU  28  15.683   8.236  11.115
  165   HD12  LEU  28          2HD1      LEU  28  14.005   8.774  11.047
  166   HD13  LEU  28          3HD1      LEU  28  15.253   9.666  10.177
  167   HD21  LEU  28          1HD2      LEU  28  16.456   6.628   9.543
  168   HD22  LEU  28          2HD2      LEU  28  15.213   5.863   8.551
  169   HD23  LEU  28          3HD2      LEU  28  15.006   5.966  10.300
  170    H    GLU  29           H        GLU  29  10.757   8.431   7.961
  171    HA   GLU  29           HA       GLU  29   8.812   6.761   8.877
  172    HB2  GLU  29           1HB      GLU  29   8.361   8.902   6.792
  173    HB3  GLU  29           2HB      GLU  29   7.169   8.270   7.919
  174    HG2  GLU  29           1HG      GLU  29   8.456   9.178   9.788
  175    HG3  GLU  29           2HG      GLU  29   9.641   9.822   8.653
  176    H    ARG  30           H        ARG  30   9.321   7.489   5.420
  177    HA   ARG  30           HA       ARG  30   7.528   5.923   4.194
  178    HB2  ARG  30           1HB      ARG  30   8.913   5.847   2.317
  179    HB3  ARG  30           2HB      ARG  30   9.499   7.255   3.192
  180    HG2  ARG  30           1HG      ARG  30  11.238   5.708   4.210
  181    HG3  ARG  30           2HG      ARG  30  10.755   4.541   2.978
  182    HD2  ARG  30           1HD      ARG  30  11.270   6.204   1.236
  183    HD3  ARG  30           2HD      ARG  30  11.803   7.326   2.487
  184    HE   ARG  30           HE       ARG  30  13.187   4.847   2.653
  185   HH11  ARG  30          2HH1      ARG  30  13.035   7.835   0.872
  186   HH12  ARG  30          1HH1      ARG  30  14.701   7.789   0.399
  187   HH21  ARG  30          2HH2      ARG  30  15.382   4.776   2.037
  188   HH22  ARG  30          1HH2      ARG  30  16.035   6.049   1.062
  189    H    LEU  31           H        LEU  31   7.002   3.830   4.019
  190    HA   LEU  31           HA       LEU  31   8.731   1.879   5.372
  191    HB2  LEU  31           1HB      LEU  31   6.242   2.321   5.986
  192    HB3  LEU  31           2HB      LEU  31   5.904   1.339   4.562
  193    HG   LEU  31           HG       LEU  31   7.567  -0.328   5.816
  194   HD11  LEU  31          1HD1      LEU  31   7.118  -0.285   8.226
  195   HD12  LEU  31          2HD1      LEU  31   6.265   1.247   8.034
  196   HD13  LEU  31          3HD1      LEU  31   7.993   1.151   7.692
  197   HD21  LEU  31          1HD2      LEU  31   4.690  -0.082   6.662
  198   HD22  LEU  31          2HD2      LEU  31   5.661  -1.547   6.515
  199   HD23  LEU  31          3HD2      LEU  31   5.182  -0.658   5.069
  200    H    CYS  32           H        CYS  32  10.107   1.095   3.871
  201    HA   CYS  32           HA       CYS  32   9.441   0.672   1.150
  202    HB2  CYS  32           1HB      CYS  32  11.592  -0.534   1.032
  203    HB3  CYS  32           2HB      CYS  32  11.749   1.018   1.845
  204    HG   CYS  32           HG       CYS  32  11.137  -1.155   4.169
  205    H    VAL  33           H        VAL  33   7.826  -0.695   0.665
  206    HA   VAL  33           HA       VAL  33   8.084  -3.470   1.602
  207    HB   VAL  33           HB       VAL  33   5.485  -1.944   1.389
  208   HG11  VAL  33          1HG1      VAL  33   5.552  -4.602   2.649
  209   HG12  VAL  33          2HG1      VAL  33   4.344  -3.876   1.587
  210   HG13  VAL  33          3HG1      VAL  33   5.808  -4.584   0.904
  211   HG21  VAL  33          1HG2      VAL  33   6.633  -1.283   3.377
  212   HG22  VAL  33          2HG2      VAL  33   5.361  -2.412   3.844
  213   HG23  VAL  33          3HG2      VAL  33   7.037  -2.955   3.766
  214    H    ASN  34           H        ASN  34   8.692  -4.491  -0.211
  215    HA   ASN  34           HA       ASN  34   8.632  -5.350  -2.315
  216    HB2  ASN  34           1HB      ASN  34   5.769  -4.512  -1.942
  217    HB3  ASN  34           2HB      ASN  34   6.314  -5.182  -3.477
  218   HD21  ASN  34          1HD2      ASN  34   4.639  -6.784  -2.838
  219   HD22  ASN  34          2HD2      ASN  34   5.148  -8.131  -1.883
  220    H    GLY  35           H        GLY  35   9.402  -2.551  -1.859
  221    HA2  GLY  35           1HA      GLY  35  10.390  -1.143  -3.499
  222    HA3  GLY  35           2HA      GLY  35   9.166  -1.666  -4.646
  223    H    HIS  36           H        HIS  36   6.939  -1.264  -2.840
  224    HA   HIS  36           HA       HIS  36   6.526   1.533  -3.332
  225    HB2  HIS  36           1HB      HIS  36   4.769  -0.445  -1.863
  226    HB3  HIS  36           2HB      HIS  36   4.281   1.149  -2.433
  227    HD1  HIS  36           1HD      HIS  36   5.221   1.175  -5.279
  228    HD2  HIS  36           2HD      HIS  36   3.529  -2.185  -3.515
  229    HE1  HIS  36           1HE      HIS  36   4.349  -0.217  -7.183
  230    H    PHE  37           H        PHE  37   5.807   3.058  -1.686
  231    HA   PHE  37           HA       PHE  37   7.060   2.545   0.932
  232    HB2  PHE  37           1HB      PHE  37   6.955   5.136  -0.626
  233    HB3  PHE  37           2HB      PHE  37   7.553   4.986   1.023
  234    HD1  PHE  37           2HD      PHE  37   9.592   3.616   1.463
  235    HD2  PHE  37           1HD      PHE  37   8.308   4.599  -2.474
  236    HE1  PHE  37           2HE      PHE  37  11.832   3.077   0.601
  237    HE2  PHE  37           1HE      PHE  37  10.546   4.061  -3.343
  238    HZ   PHE  37           HZ       PHE  37  12.312   3.300  -1.804
  239    H    PHE  38           H        PHE  38   5.952   3.127   2.748
  240    HA   PHE  38           HA       PHE  38   3.459   4.617   2.489
  241    HB2  PHE  38           1HB      PHE  38   3.412   2.014   3.990
  242    HB3  PHE  38           2HB      PHE  38   2.059   2.965   3.385
  243    HD1  PHE  38           1HD      PHE  38   5.022   1.077   2.141
  244    HD2  PHE  38           2HD      PHE  38   0.993   2.273   1.470
  245    HE1  PHE  38           1HE      PHE  38   4.944  -0.329   0.123
  246    HE2  PHE  38           2HE      PHE  38   0.908   0.868  -0.548
  247    HZ   PHE  38           HZ       PHE  38   2.885  -0.436  -1.223
  248    H    HIS  39           H        HIS  39   2.543   5.212   4.607
  249    HA   HIS  39           HA       HIS  39   4.628   6.063   6.384
  250    HB2  HIS  39           1HB      HIS  39   1.628   6.383   6.427
  251    HB3  HIS  39           2HB      HIS  39   2.669   7.011   7.701
  252    HD2  HIS  39           2HD      HIS  39   4.999   8.297   5.731
  253    HE1  HIS  39           1HE      HIS  39   1.758  10.539   4.159
  254    HE2  HIS  39           2HE      HIS  39   4.263  10.315   4.290
  255    H    ARG  40           H        ARG  40   5.395   4.987   8.071
  256    HA   ARG  40           HA       ARG  40   4.876   2.458   8.828
  257    HB2  ARG  40           1HB      ARG  40   5.603   4.760  10.645
  258    HB3  ARG  40           2HB      ARG  40   5.694   3.068  11.116
  259    HG2  ARG  40           1HG      ARG  40   7.232   2.781   9.091
  260    HG3  ARG  40           2HG      ARG  40   7.343   4.543   9.099
  261    HD2  ARG  40           1HD      ARG  40   8.436   4.596  11.134
  262    HD3  ARG  40           2HD      ARG  40   7.817   3.019  11.623
  263    HE   ARG  40           HE       ARG  40   9.550   2.833   9.367
  264   HH11  ARG  40          2HH1      ARG  40   9.487   3.160  12.832
  265   HH12  ARG  40          1HH1      ARG  40  11.045   2.437  13.060
  266   HH21  ARG  40          2HH2      ARG  40  11.602   1.879   9.653
  267   HH22  ARG  40          1HH2      ARG  40  12.247   1.709  11.250
  268    H    SER  41           H        SER  41   2.882   5.209   9.487
  269    HA   SER  41           HA       SER  41   1.293   3.837  11.486
  270    HB2  SER  41           1HB      SER  41   1.804   6.373  11.402
  271    HB3  SER  41           2HB      SER  41   0.544   6.439  10.170
  272    HG   SER  41           HG       SER  41   0.150   5.270  12.719
  273    H    CYS  42           H        CYS  42   0.744   5.173   8.229
  274    HA   CYS  42           HA       CYS  42  -1.860   4.332   7.852
  275    HB2  CYS  42           1HB      CYS  42   0.430   4.840   5.993
  276    HB3  CYS  42           2HB      CYS  42  -1.055   4.144   5.352
  277    H    PHE  43           H        PHE  43   1.086   2.603   6.821
  278    HA   PHE  43           HA       PHE  43  -0.099   0.304   5.860
  279    HB2  PHE  43           1HB      PHE  43   2.410   1.057   5.942
  280    HB3  PHE  43           2HB      PHE  43   2.448   0.112   7.427
  281    HD1  PHE  43           1HD      PHE  43   2.071  -2.309   7.367
  282    HD2  PHE  43           2HD      PHE  43   2.274   0.011   3.804
  283    HE1  PHE  43           1HE      PHE  43   2.400  -4.363   6.052
  284    HE2  PHE  43           2HE      PHE  43   2.602  -2.039   2.484
  285    HZ   PHE  43           HZ       PHE  43   2.665  -4.229   3.608
  286    H    ARG  44           H        ARG  44  -1.724  -0.656   6.950
  287    HA   ARG  44           HA       ARG  44  -1.052  -1.898   9.511
  288    HB2  ARG  44           1HB      ARG  44  -3.628  -0.387   9.043
  289    HB3  ARG  44           2HB      ARG  44  -3.184  -1.259  10.503
  290    HG2  ARG  44           1HG      ARG  44  -1.570   0.320  11.098
  291    HG3  ARG  44           2HG      ARG  44  -1.524   1.012   9.475
  292    HD2  ARG  44           1HD      ARG  44  -3.653   2.021   9.752
  293    HD3  ARG  44           2HD      ARG  44  -3.967   1.109  11.228
  294    HE   ARG  44           HE       ARG  44  -1.782   2.515  11.892
  295   HH11  ARG  44          2HH1      ARG  44  -4.785   3.447  10.398
  296   HH12  ARG  44          1HH1      ARG  44  -4.764   5.051  11.052
  297   HH21  ARG  44          2HH2      ARG  44  -1.743   4.624  12.760
  298   HH22  ARG  44          1HH2      ARG  44  -3.032   5.720  12.395
  299    H    CYS  45           H        CYS  45  -3.131  -3.316  10.146
  300    HA   CYS  45           HA       CYS  45  -3.264  -5.361   8.220
  301    HB2  CYS  45           1HB      CYS  45  -3.595  -5.597  10.718
  302    HB3  CYS  45           2HB      CYS  45  -5.215  -4.946  10.488
  303    H    HIS  46           H        HIS  46  -5.368  -6.265   7.377
  304    HA   HIS  46           HA       HIS  46  -6.914  -4.073   6.182
  305    HB2  HIS  46           1HB      HIS  46  -5.951  -5.388   4.473
  306    HB3  HIS  46           2HB      HIS  46  -6.344  -6.895   5.295
  307    HD1  HIS  46           1HD      HIS  46  -7.611  -4.531   2.807
  308    HD2  HIS  46           2HD      HIS  46  -9.170  -7.550   5.198
  309    HE1  HIS  46           1HE      HIS  46  -9.853  -5.087   1.812
  310    H    THR  47           H        THR  47  -7.121  -6.359   8.593
  311    HA   THR  47           HA       THR  47 -10.065  -6.417   8.427
  312    HB   THR  47           HB       THR  47  -8.142  -8.473   9.495
  313    HG1  THR  47           1HG      THR  47  -9.697  -8.202   7.302
  314   HG21  THR  47          1HG2      THR  47 -11.124  -8.386   9.970
  315   HG22  THR  47          2HG2      THR  47  -9.890  -8.086  11.195
  316   HG23  THR  47          3HG2      THR  47 -10.024  -9.678  10.449
  317    H    CYS  48           H        CYS  48  -7.267  -5.772  10.396
  318    HA   CYS  48           HA       CYS  48  -9.046  -4.734  12.502
  319    HB2  CYS  48           1HB      CYS  48  -7.370  -5.365  14.177
  320    HB3  CYS  48           2HB      CYS  48  -7.934  -6.776  13.287
  321    H    GLU  49           H        GLU  49  -6.960  -3.915  10.135
  322    HA   GLU  49           HA       GLU  49  -5.499  -2.189   9.740
  323    HB2  GLU  49           1HB      GLU  49  -6.424   0.013  10.409
  324    HB3  GLU  49           2HB      GLU  49  -7.617  -1.032   9.650
  325    HG2  GLU  49           1HG      GLU  49  -8.468  -1.631  11.886
  326    HG3  GLU  49           2HG      GLU  49  -7.323  -0.494  12.596
  327    H    ALA  50           H        ALA  50  -4.476  -3.737  11.749
  328    HA   ALA  50           HA       ALA  50  -3.640  -1.925  13.886
  329    HB1  ALA  50           1HB      ALA  50  -4.278  -4.011  14.747
  330    HB2  ALA  50           2HB      ALA  50  -3.399  -4.892  13.496
  331    HB3  ALA  50           3HB      ALA  50  -2.514  -4.038  14.760
  332    H    THR  51           H        THR  51  -1.695  -0.992  13.954
  333    HA   THR  51           HA       THR  51  -0.011  -0.635  11.882
  334    HB   THR  51           HB       THR  51   1.008  -0.930  14.712
  335    HG1  THR  51           1HG      THR  51  -0.153   0.771  15.168
  336   HG21  THR  51          1HG2      THR  51   2.542   0.915  13.951
  337   HG22  THR  51          2HG2      THR  51   1.957   0.631  12.312
  338   HG23  THR  51          3HG2      THR  51   2.813  -0.646  13.177
  339    H    LEU  52           H        LEU  52   0.525  -2.325  10.580
  340    HA   LEU  52           HA       LEU  52   1.445  -4.838  11.562
  341    HB2  LEU  52           1HB      LEU  52   1.700  -3.647   8.805
  342    HB3  LEU  52           2HB      LEU  52   1.942  -5.341   9.227
  343    HG   LEU  52           HG       LEU  52  -0.679  -3.865   9.471
  344   HD11  LEU  52          1HD1      LEU  52   0.023  -5.946   7.424
  345   HD12  LEU  52          2HD1      LEU  52   0.237  -4.222   7.124
  346   HD13  LEU  52          3HD1      LEU  52  -1.369  -4.863   7.466
  347   HD21  LEU  52          1HD2      LEU  52  -0.410  -6.827   9.414
  348   HD22  LEU  52          2HD2      LEU  52  -1.627  -5.815  10.194
  349   HD23  LEU  52          3HD2      LEU  52  -0.022  -5.976  10.910
  350    H    TRP  53           H        TRP  53   3.243  -4.661  12.824
  351    HA   TRP  53           HA       TRP  53   5.453  -3.004  12.304
  352    HB2  TRP  53           1HB      TRP  53   5.646  -5.611  13.798
  353    HB3  TRP  53           2HB      TRP  53   6.540  -4.118  14.075
  354    HD1  TRP  53           HD       TRP  53   3.182  -5.780  14.811
  355    HE1  TRP  53           1HE      TRP  53   1.970  -4.425  16.633
  356    HE3  TRP  53           3HE      TRP  53   6.325  -1.756  15.056
  357    HZ2  TRP  53           2HZ      TRP  53   2.301  -1.974  17.993
  358    HZ3  TRP  53           3HZ      TRP  53   5.806   0.051  16.643
  359    HH2  TRP  53           HH       TRP  53   3.835  -0.057  18.080
  360    HA   PRO  54           HA       PRO  54   7.750  -5.085   9.196
  361    HB2  PRO  54           1HB      PRO  54  10.299  -4.568   9.974
  362    HB3  PRO  54           2HB      PRO  54   9.236  -3.335   9.284
  363    HG2  PRO  54           1HG      PRO  54   9.901  -3.874  12.153
  364    HG3  PRO  54           2HG      PRO  54   9.776  -2.321  11.306
  365    HD2  PRO  54           1HD      PRO  54   7.795  -3.287  12.879
  366    HD3  PRO  54           2HD      PRO  54   7.475  -2.287  11.447
  367    H    GLY  55           H        GLY  55   7.380  -6.341  12.162
  368    HA2  GLY  55           1HA      GLY  55   8.888  -8.750  11.448
  369    HA3  GLY  55           2HA      GLY  55   9.196  -8.025  13.019
  370    H    GLY  56           H        GLY  56   6.009  -7.939  11.621
  371    HA2  GLY  56           1HA      GLY  56   5.108 -10.321  12.984
  372    HA3  GLY  56           2HA      GLY  56   4.593  -8.827  13.751
  373    H    TYR  57           H        TYR  57   4.895  -9.771  10.332
  374    HA   TYR  57           HA       TYR  57   2.037  -9.787   9.976
  375    HB2  TYR  57           1HB      TYR  57   1.839  -7.916   8.527
  376    HB3  TYR  57           2HB      TYR  57   2.712  -7.339   9.942
  377    HD1  TYR  57           2HD      TYR  57   5.391  -7.660   9.677
  378    HD2  TYR  57           1HD      TYR  57   2.615  -7.189   6.488
  379    HE1  TYR  57           2HE      TYR  57   7.202  -6.840   8.230
  380    HE2  TYR  57           1HE      TYR  57   4.418  -6.368   5.031
  381    HH   TYR  57           HH       TYR  57   6.674  -5.256   5.343
  382    H    GLU  58           H        GLU  58   1.502 -10.068   7.576
  383    HA   GLU  58           HA       GLU  58   3.619 -11.185   5.954
  384    HB2  GLU  58           1HB      GLU  58   1.599 -12.872   7.351
  385    HB3  GLU  58           2HB      GLU  58   2.037 -13.307   5.705
  386    HG2  GLU  58           1HG      GLU  58   4.349 -13.530   6.325
  387    HG3  GLU  58           2HG      GLU  58   4.004 -12.947   7.953
  388    H    GLN  59           H        GLN  59   3.134 -11.192   3.795
  389    HA   GLN  59           HA       GLN  59   0.595  -9.930   3.068
  390    HB2  GLN  59           1HB      GLN  59   2.607  -8.806   2.286
  391    HB3  GLN  59           2HB      GLN  59   3.156 -10.280   1.502
  392    HG2  GLN  59           1HG      GLN  59   0.910 -10.103   0.204
  393    HG3  GLN  59           2HG      GLN  59   0.971  -8.415   0.709
  394   HE21  GLN  59          1HE2      GLN  59   1.132  -9.528  -1.962
  395   HE22  GLN  59          2HE2      GLN  59   2.642  -9.006  -2.619
  396    H    HIS  60           H        HIS  60  -0.981 -11.297   2.559
  397    HA   HIS  60           HA       HIS  60  -0.581 -13.978   1.762
  398    HB2  HIS  60           1HB      HIS  60  -2.646 -12.970   2.871
  399    HB3  HIS  60           2HB      HIS  60  -3.093 -12.382   1.272
  400    HD1  HIS  60           1HD      HIS  60  -4.094 -14.051  -0.353
  401    HD2  HIS  60           2HD      HIS  60  -2.732 -15.805   3.158
  402    HE1  HIS  60           1HE      HIS  60  -4.959 -16.412  -0.401
  403    HA   PRO  61           HA       PRO  61   0.350 -13.280  -2.521
  404    HB2  PRO  61           1HB      PRO  61   0.314 -15.888  -3.271
  405    HB3  PRO  61           2HB      PRO  61   1.656 -15.164  -2.378
  406    HG2  PRO  61           1HG      PRO  61  -0.619 -16.823  -1.362
  407    HG3  PRO  61           2HG      PRO  61   1.101 -16.902  -0.936
  408    HD2  PRO  61           1HD      PRO  61  -0.733 -15.668   0.629
  409    HD3  PRO  61           2HD      PRO  61   0.952 -15.118   0.517
  410    H    GLY  62           H        GLY  62  -2.394 -15.158  -1.373
  411    HA2  GLY  62           1HA      GLY  62  -3.780 -15.738  -3.652
  412    HA3  GLY  62           2HA      GLY  62  -4.560 -15.237  -2.159
  413    H    ASP  63           H        ASP  63  -4.784 -12.884  -1.809
  414    HA   ASP  63           HA       ASP  63  -5.784 -11.646  -4.208
  415    HB2  ASP  63           1HB      ASP  63  -5.659 -10.673  -1.346
  416    HB3  ASP  63           2HB      ASP  63  -6.446  -9.801  -2.658
  417    H    GLY  64           H        GLY  64  -3.435 -10.612  -1.722
  418    HA2  GLY  64           1HA      GLY  64  -1.208  -9.932  -2.662
  419    HA3  GLY  64           2HA      GLY  64  -2.133  -8.978  -3.812
  420    H    HIS  65           H        HIS  65  -2.797  -9.350  -0.365
  421    HA   HIS  65           HA       HIS  65  -2.160  -6.494  -0.015
  422    HB2  HIS  65           1HB      HIS  65  -4.394  -8.046   1.309
  423    HB3  HIS  65           2HB      HIS  65  -4.009  -6.351   1.595
  424    HD1  HIS  65           1HD      HIS  65  -5.363  -4.764   0.277
  425    HD2  HIS  65           2HD      HIS  65  -5.090  -8.469  -1.583
  426    HE1  HIS  65           1HE      HIS  65  -6.804  -4.593  -1.777
  427    H    PHE  66           H        PHE  66  -2.340  -6.174   2.626
  428    HA   PHE  66           HA       PHE  66  -0.435  -8.129   3.736
  429    HB2  PHE  66           1HB      PHE  66  -0.548  -5.132   4.078
  430    HB3  PHE  66           2HB      PHE  66   0.401  -6.177   5.130
  431    HD1  PHE  66           2HD      PHE  66   0.057  -4.847   1.730
  432    HD2  PHE  66           1HD      PHE  66   2.437  -7.181   4.376
  433    HE1  PHE  66           2HE      PHE  66   1.918  -4.764   0.123
  434    HE2  PHE  66           1HE      PHE  66   4.303  -7.101   2.774
  435    HZ   PHE  66           HZ       PHE  66   4.045  -5.892   0.644
  436    H    TYR  67           H        TYR  67  -1.095  -9.173   5.489
  437    HA   TYR  67           HA       TYR  67  -3.113  -7.910   7.217
  438    HB2  TYR  67           1HB      TYR  67  -3.115 -10.851   6.539
  439    HB3  TYR  67           2HB      TYR  67  -4.351  -9.945   7.404
  440    HD1  TYR  67           2HD      TYR  67  -2.766 -10.388   4.081
  441    HD2  TYR  67           1HD      TYR  67  -6.107  -8.882   6.243
  442    HE1  TYR  67           2HE      TYR  67  -3.956 -10.003   1.964
  443    HE2  TYR  67           1HE      TYR  67  -7.306  -8.493   4.131
  444    HH   TYR  67           HH       TYR  67  -5.995  -9.565   1.050
  445    H    CYS  68           H        CYS  68  -3.189  -8.802   9.403
  446    HA   CYS  68           HA       CYS  68  -0.579  -9.092  10.494
  447    HB2  CYS  68           1HB      CYS  68  -1.684  -9.226  12.645
  448    HB3  CYS  68           2HB      CYS  68  -2.455  -7.972  11.678
  449    H    LEU  69           H        LEU  69  -0.175 -10.885  12.173
  450    HA   LEU  69           HA       LEU  69  -0.305 -13.397  10.765
  451    HB2  LEU  69           1HB      LEU  69   0.778 -12.932  13.531
  452    HB3  LEU  69           2HB      LEU  69   1.189 -14.227  12.408
  453    HG   LEU  69           HG       LEU  69   1.966 -11.321  12.197
  454   HD11  LEU  69          1HD1      LEU  69   4.170 -12.037  12.596
  455   HD12  LEU  69          2HD1      LEU  69   3.745 -13.735  12.380
  456   HD13  LEU  69          3HD1      LEU  69   3.184 -12.861  13.805
  457   HD21  LEU  69          1HD2      LEU  69   3.041 -11.821  10.141
  458   HD22  LEU  69          2HD2      LEU  69   1.381 -12.402  10.003
  459   HD23  LEU  69          3HD2      LEU  69   2.694 -13.543  10.300
  460    H    GLN  70           H        GLN  70  -2.690 -12.010  12.163
  461    HA   GLN  70           HA       GLN  70  -3.631 -14.435  13.542
  462    HB2  GLN  70           1HB      GLN  70  -3.252 -12.769  15.238
  463    HB3  GLN  70           2HB      GLN  70  -4.118 -11.554  14.307
  464    HG2  GLN  70           1HG      GLN  70  -6.199 -12.708  14.637
  465    HG3  GLN  70           2HG      GLN  70  -5.372 -14.045  15.435
  466   HE21  GLN  70          1HE2      GLN  70  -6.142 -13.966  17.446
  467   HE22  GLN  70          2HE2      GLN  70  -6.062 -12.592  18.489
  468    H    HIS  71           H        HIS  71  -4.058 -12.272  11.026
  469    HA   HIS  71           HA       HIS  71  -6.838 -13.172  10.649
  470    HB2  HIS  71           1HB      HIS  71  -5.626 -10.459  10.209
  471    HB3  HIS  71           2HB      HIS  71  -7.042 -10.964   9.293
  472    HD2  HIS  71           2HD      HIS  71  -7.844 -12.494  12.482
  473    HE1  HIS  71           1HE      HIS  71  -8.985  -8.447  13.046
  474    HE2  HIS  71           2HE      HIS  71  -9.101 -10.789  13.966
  475    H    LEU  72           H        LEU  72  -3.677 -12.845   9.376
  476    HA   LEU  72           HA       LEU  72  -4.003 -12.808   6.653
  477    HB2  LEU  72           1HB      LEU  72  -1.838 -12.822   7.839
  478    HB3  LEU  72           2HB      LEU  72  -2.060 -14.536   8.179
  479    HG   LEU  72           HG       LEU  72  -2.250 -14.600   5.508
  480   HD11  LEU  72          1HD1      LEU  72  -1.213 -12.945   4.391
  481   HD12  LEU  72          2HD1      LEU  72  -0.036 -12.669   5.674
  482   HD13  LEU  72          3HD1      LEU  72  -1.657 -11.988   5.805
  483   HD21  LEU  72          1HD2      LEU  72   0.534 -14.558   6.107
  484   HD22  LEU  72          2HD2      LEU  72  -0.525 -15.947   5.864
  485   HD23  LEU  72          3HD2      LEU  72  -0.330 -15.258   7.476
  486    HA   PRO  73           HA       PRO  73  -6.475 -16.464   5.998
  487    HB2  PRO  73           1HB      PRO  73  -6.664 -16.175   3.305
  488    HB3  PRO  73           2HB      PRO  73  -7.625 -15.224   4.443
  489    HG2  PRO  73           1HG      PRO  73  -5.116 -14.473   2.992
  490    HG3  PRO  73           2HG      PRO  73  -6.582 -13.513   3.264
  491    HD2  PRO  73           1HD      PRO  73  -4.338 -13.198   4.747
  492    HD3  PRO  73           2HD      PRO  73  -5.965 -12.948   5.411
  493    H    GLN  74           H        GLN  74  -6.347 -18.261   4.215
  494    HA   GLN  74           HA       GLN  74  -3.667 -18.828   3.287
  495    HB2  GLN  74           1HB      GLN  74  -4.878 -20.180   5.640
  496    HB3  GLN  74           2HB      GLN  74  -4.015 -21.194   4.490
  497    HG2  GLN  74           1HG      GLN  74  -2.847 -18.753   5.804
  498    HG3  GLN  74           2HG      GLN  74  -2.637 -20.401   6.394
  499   HE21  GLN  74          1HE2      GLN  74  -0.854 -18.232   5.160
  500   HE22  GLN  74          2HE2      GLN  74   0.062 -19.095   3.977
  501    H    THR  75           H        THR  75  -3.611 -20.305   1.626
  502    HA   THR  75           HA       THR  75  -5.677 -20.590  -0.089
  503    HB   THR  75           HB       THR  75  -4.586 -22.632  -0.990
  504    HG1  THR  75           1HG      THR  75  -2.683 -23.360   0.093
  505   HG21  THR  75          1HG2      THR  75  -2.468 -21.584  -1.566
  506   HG22  THR  75          2HG2      THR  75  -2.637 -20.456  -0.221
  507   HG23  THR  75          3HG2      THR  75  -3.759 -20.384  -1.579
  508    H    ASP  76           H        ASP  76  -7.075 -22.380  -0.676
  509    HA   ASP  76           HA       ASP  76  -7.952 -23.935   1.671
  510    HB2  ASP  76           1HB      ASP  76  -9.547 -22.554  -0.474
  511    HB3  ASP  76           2HB      ASP  76 -10.231 -23.884   0.456
  512    H    SER  77           H        SER  77  -7.339 -25.977   1.400
  513    HA   SER  77           HA       SER  77  -6.800 -27.156  -1.121
  514    HB2  SER  77           1HB      SER  77  -7.208 -28.436   1.593
  515    HB3  SER  77           2HB      SER  77  -6.580 -29.269   0.171
  516    HG   SER  77           HG       SER  77  -5.395 -27.232   1.709
  517    H    GLY  78           H        GLY  78  -8.752 -26.779  -2.301
  518    HA2  GLY  78           1HA      GLY  78 -10.451 -28.977  -2.490
  519    HA3  GLY  78           2HA      GLY  78 -11.272 -27.786  -1.492
  520    HA   PRO  79           HA       PRO  79 -10.986 -26.568  -6.205
  521    HB2  PRO  79           1HB      PRO  79 -12.266 -28.514  -7.598
  522    HB3  PRO  79           2HB      PRO  79 -10.516 -28.502  -7.351
  523    HG2  PRO  79           1HG      PRO  79 -12.626 -30.039  -5.885
  524    HG3  PRO  79           2HG      PRO  79 -11.038 -30.584  -6.456
  525    HD2  PRO  79           1HD      PRO  79 -11.503 -29.902  -3.878
  526    HD3  PRO  79           2HD      PRO  79  -9.932 -29.648  -4.664
  527    H    SER  80           H        SER  80 -13.242 -27.503  -3.944
  528    HA   SER  80           HA       SER  80 -15.390 -26.106  -5.395
  529    HB2  SER  80           1HB      SER  80 -15.748 -28.450  -3.512
  530    HB3  SER  80           2HB      SER  80 -17.037 -27.580  -4.343
  531    HG   SER  80           HG       SER  80 -14.992 -28.622  -5.915
  532    H    SER  81           H        SER  81 -15.706 -24.216  -4.438
  533    HA   SER  81           HA       SER  81 -16.150 -24.112  -1.572
  534    HB2  SER  81           1HB      SER  81 -13.821 -23.672  -1.515
  535    HB3  SER  81           2HB      SER  81 -13.902 -22.634  -2.938
  536    HG   SER  81           HG       SER  81 -13.750 -21.417  -1.012
  537    H    GLY  82           H        GLY  82 -17.551 -22.512  -0.970
  538    HA2  GLY  82           1HA      GLY  82 -18.963 -21.181  -3.117
  539    HA3  GLY  82           2HA      GLY  82 -19.403 -21.177  -1.416
  Start of MODEL    4
    1    H1   GLY   1           H        GLY   1 -13.529  26.876 -39.328
    2    HA2  GLY   1           1HA      GLY   1 -15.806  27.690 -38.256
    3    HA3  GLY   1           2HA      GLY   1 -16.381  26.279 -39.130
    4    H    SER   2           H        SER   2 -14.448  24.435 -38.748
    5    HA   SER   2           HA       SER   2 -14.293  24.179 -35.815
    6    HB2  SER   2           1HB      SER   2 -15.980  22.650 -36.667
    7    HB3  SER   2           2HB      SER   2 -14.846  22.016 -37.860
    8    HG   SER   2           HG       SER   2 -14.757  21.741 -35.043
    9    H    SER   3           H        SER   3 -12.502  23.018 -34.970
   10    HA   SER   3           HA       SER   3 -10.305  22.460 -36.822
   11    HB2  SER   3           1HB      SER   3 -10.249  24.452 -34.569
   12    HB3  SER   3           2HB      SER   3  -8.774  23.641 -35.092
   13    HG   SER   3           HG       SER   3  -8.781  25.321 -36.409
   14    H    GLY   4           H        GLY   4  -8.481  21.320 -35.713
   15    HA2  GLY   4           1HA      GLY   4  -9.461  19.730 -33.424
   16    HA3  GLY   4           2HA      GLY   4  -8.681  18.971 -34.804
   17    H    SER   5           H        SER   5  -8.021  19.234 -31.845
   18    HA   SER   5           HA       SER   5  -5.184  19.644 -32.240
   19    HB2  SER   5           1HB      SER   5  -6.879  21.517 -30.638
   20    HB3  SER   5           2HB      SER   5  -5.249  21.152 -30.072
   21    HG   SER   5           HG       SER   5  -5.289  22.973 -31.457
   22    H    SER   6           H        SER   6  -3.900  18.804 -30.524
   23    HA   SER   6           HA       SER   6  -5.073  17.614 -28.212
   24    HB2  SER   6           1HB      SER   6  -5.788  15.982 -29.938
   25    HB3  SER   6           2HB      SER   6  -4.098  15.728 -30.371
   26    HG   SER   6           HG       SER   6  -4.260  14.218 -28.900
   27    H    GLY   7           H        GLY   7  -3.425  16.256 -27.010
   28    HA2  GLY   7           1HA      GLY   7  -0.656  16.826 -27.744
   29    HA3  GLY   7           2HA      GLY   7  -1.237  17.530 -26.242
   30    H    GLN   8           H        GLN   8   0.600  16.204 -25.409
   31    HA   GLN   8           HA       GLN   8  -0.373  13.928 -24.073
   32    HB2  GLN   8           1HB      GLN   8   0.098  13.139 -26.531
   33    HB3  GLN   8           2HB      GLN   8   1.775  13.138 -26.002
   34    HG2  GLN   8           1HG      GLN   8   1.122  10.963 -25.621
   35    HG3  GLN   8           2HG      GLN   8   0.914  11.707 -24.037
   36   HE21  GLN   8          1HE2      GLN   8  -0.686  10.400 -26.827
   37   HE22  GLN   8          2HE2      GLN   8  -2.260  10.285 -26.124
   38    H    HIS   9           H        HIS   9   0.757  13.720 -22.248
   39    HA   HIS   9           HA       HIS   9   3.587  14.012 -22.104
   40    HB2  HIS   9           1HB      HIS   9   3.518  15.979 -20.511
   41    HB3  HIS   9           2HB      HIS   9   3.205  16.360 -22.202
   42    HD1  HIS   9           1HD      HIS   9   2.025  17.253 -19.030
   43    HD2  HIS   9           2HD      HIS   9   0.141  16.226 -22.588
   44    HE1  HIS   9           1HE      HIS   9  -0.303  18.189 -18.853
   45    H    GLN  10           H        GLN  10   4.057  12.441 -20.726
   46    HA   GLN  10           HA       GLN  10   2.976  12.438 -18.065
   47    HB2  GLN  10           1HB      GLN  10   2.133  10.387 -20.074
   48    HB3  GLN  10           2HB      GLN  10   2.333   9.913 -18.392
   49    HG2  GLN  10           1HG      GLN  10   0.777  11.827 -17.816
   50    HG3  GLN  10           2HG      GLN  10   0.422  11.919 -19.541
   51   HE21  GLN  10          1HE2      GLN  10  -1.648  11.249 -19.541
   52   HE22  GLN  10          2HE2      GLN  10  -2.170   9.688 -19.014
   53    H    GLU  11           H        GLU  11   4.488  11.741 -16.691
   54    HA   GLU  11           HA       GLU  11   6.523   9.857 -17.642
   55    HB2  GLU  11           1HB      GLU  11   8.330  11.169 -16.757
   56    HB3  GLU  11           2HB      GLU  11   7.399  12.182 -17.852
   57    HG2  GLU  11           1HG      GLU  11   6.201  13.064 -15.811
   58    HG3  GLU  11           2HG      GLU  11   7.431  12.244 -14.852
   59    H    ALA  12           H        ALA  12   7.652   8.742 -15.942
   60    HA   ALA  12           HA       ALA  12   5.953   7.970 -13.810
   61    HB1  ALA  12           1HB      ALA  12   7.478   6.323 -13.372
   62    HB2  ALA  12           2HB      ALA  12   7.899   6.697 -15.044
   63    HB3  ALA  12           3HB      ALA  12   8.863   7.357 -13.723
   64    H    GLY  13           H        GLY  13   8.919   9.922 -13.939
   65    HA2  GLY  13           1HA      GLY  13   9.696  11.541 -12.501
   66    HA3  GLY  13           2HA      GLY  13   8.120  11.517 -11.724
   67    H    ALA  14           H        ALA  14   7.884  10.509  -9.799
   68    HA   ALA  14           HA       ALA  14   9.654   8.485  -8.855
   69    HB1  ALA  14           1HB      ALA  14  10.125  11.309  -8.020
   70    HB2  ALA  14           2HB      ALA  14  10.389  10.007  -6.860
   71    HB3  ALA  14           3HB      ALA  14  11.287  10.031  -8.378
   72    H    GLY  15           H        GLY  15   8.308   7.230  -7.751
   73    HA2  GLY  15           1HA      GLY  15   5.948   8.378  -6.488
   74    HA3  GLY  15           2HA      GLY  15   6.287   6.667  -6.706
   75    H    ASP  16           H        ASP  16   7.629   9.472  -4.960
   76    HA   ASP  16           HA       ASP  16   8.345   7.684  -2.752
   77    HB2  ASP  16           1HB      ASP  16   9.636   9.652  -1.908
   78    HB3  ASP  16           2HB      ASP  16  10.155   9.088  -3.494
   79    H    LEU  17           H        LEU  17   5.604   8.263  -3.150
   80    HA   LEU  17           HA       LEU  17   5.042   9.820  -0.714
   81    HB2  LEU  17           1HB      LEU  17   3.071   9.650  -2.953
   82    HB3  LEU  17           2HB      LEU  17   3.197  10.847  -1.665
   83    HG   LEU  17           HG       LEU  17   5.316  10.681  -3.772
   84   HD11  LEU  17          1HD1      LEU  17   3.794  12.645  -4.744
   85   HD12  LEU  17          2HD1      LEU  17   2.525  11.604  -4.099
   86   HD13  LEU  17          3HD1      LEU  17   3.663  10.974  -5.291
   87   HD21  LEU  17          1HD2      LEU  17   5.231  12.126  -1.552
   88   HD22  LEU  17          2HD2      LEU  17   4.276  13.194  -2.581
   89   HD23  LEU  17          3HD2      LEU  17   5.919  12.754  -3.049
   90    H    CYS  18           H        CYS  18   3.762   8.871   0.765
   91    HA   CYS  18           HA       CYS  18   3.370   6.234   1.035
   92    HB2  CYS  18           1HB      CYS  18   2.777   7.855   2.775
   93    HB3  CYS  18           2HB      CYS  18   1.367   8.353   1.844
   94    H    ALA  19           H        ALA  19   1.619   4.752   0.724
   95    HA   ALA  19           HA       ALA  19   0.190   5.249  -1.789
   96    HB1  ALA  19           1HB      ALA  19   0.329   3.033  -2.249
   97    HB2  ALA  19           2HB      ALA  19   1.717   3.154  -1.166
   98    HB3  ALA  19           3HB      ALA  19   0.173   2.557  -0.558
   99    H    LEU  20           H        LEU  20  -0.303   4.593   1.597
  100    HA   LEU  20           HA       LEU  20  -3.020   3.832   1.478
  101    HB2  LEU  20           1HB      LEU  20  -1.131   4.730   3.562
  102    HB3  LEU  20           2HB      LEU  20  -2.843   4.952   3.917
  103    HG   LEU  20           HG       LEU  20  -1.996   2.871   4.864
  104   HD11  LEU  20          1HD1      LEU  20  -3.577   1.422   3.115
  105   HD12  LEU  20          2HD1      LEU  20  -4.187   3.071   2.982
  106   HD13  LEU  20          3HD1      LEU  20  -4.118   2.282   4.557
  107   HD21  LEU  20          1HD2      LEU  20  -1.502   1.026   3.125
  108   HD22  LEU  20          2HD2      LEU  20  -0.232   2.184   3.523
  109   HD23  LEU  20          3HD2      LEU  20  -1.160   2.369   2.034
  110    H    CYS  21           H        CYS  21  -1.527   6.969   2.286
  111    HA   CYS  21           HA       CYS  21  -4.118   8.263   1.820
  112    HB2  CYS  21           1HB      CYS  21  -3.046  10.244   2.907
  113    HB3  CYS  21           2HB      CYS  21  -3.138   8.826   3.946
  114    H    GLY  22           H        GLY  22  -0.672   8.657   1.004
  115    HA2  GLY  22           1HA      GLY  22  -0.007   9.023  -1.287
  116    HA3  GLY  22           2HA      GLY  22  -1.527   9.866  -1.544
  117    H    GLU  23           H        GLU  23   0.803  10.253   1.098
  118    HA   GLU  23           HA       GLU  23   1.164  13.047   0.234
  119    HB2  GLU  23           1HB      GLU  23   1.069  11.865   3.009
  120    HB3  GLU  23           2HB      GLU  23   1.648  13.492   2.680
  121    HG2  GLU  23           1HG      GLU  23  -0.692  13.661   1.443
  122    HG3  GLU  23           2HG      GLU  23  -1.103  12.403   2.608
  123    H    HIS  24           H        HIS  24   3.238  13.912   1.586
  124    HA   HIS  24           HA       HIS  24   5.465  12.768   0.318
  125    HB2  HIS  24           1HB      HIS  24   5.064  15.148   1.412
  126    HB3  HIS  24           2HB      HIS  24   5.836  14.387   2.799
  127    HD1  HIS  24           1HD      HIS  24   8.250  13.187   2.114
  128    HD2  HIS  24           2HD      HIS  24   6.833  16.257  -0.299
  129    HE1  HIS  24           1HE      HIS  24  10.250  14.010   0.830
  130    H    LEU  25           H        LEU  25   7.355  11.791   1.300
  131    HA   LEU  25           HA       LEU  25   6.722  10.212   3.704
  132    HB2  LEU  25           1HB      LEU  25   8.080   9.342   1.166
  133    HB3  LEU  25           2HB      LEU  25   8.177   8.423   2.666
  134    HG   LEU  25           HG       LEU  25   5.568   9.078   1.313
  135   HD11  LEU  25          1HD1      LEU  25   6.597   7.787  -0.316
  136   HD12  LEU  25          2HD1      LEU  25   5.740   6.590   0.654
  137   HD13  LEU  25          3HD1      LEU  25   7.477   6.816   0.865
  138   HD21  LEU  25          1HD2      LEU  25   4.967   8.432   3.408
  139   HD22  LEU  25          2HD2      LEU  25   6.431   7.480   3.658
  140   HD23  LEU  25          3HD2      LEU  25   5.119   6.838   2.668
  141    H    TYR  26           H        TYR  26   8.374   9.865   5.165
  142    HA   TYR  26           HA       TYR  26  10.854  11.376   4.661
  143    HB2  TYR  26           1HB      TYR  26   9.284  12.325   6.409
  144    HB3  TYR  26           2HB      TYR  26   9.615  10.889   7.372
  145    HD1  TYR  26           1HD      TYR  26  11.403  13.661   5.621
  146    HD2  TYR  26           2HD      TYR  26  11.363  10.939   8.891
  147    HE1  TYR  26           1HE      TYR  26  13.405  14.751   6.545
  148    HE2  TYR  26           2HE      TYR  26  13.364  12.023   9.825
  149    HH   TYR  26           HH       TYR  26  15.402  13.544   8.535
  150    H    VAL  27           H        VAL  27  12.661  10.627   6.199
  151    HA   VAL  27           HA       VAL  27  13.386   8.021   5.564
  152    HB   VAL  27           HB       VAL  27  14.387   9.628   7.919
  153   HG11  VAL  27          1HG1      VAL  27  16.509   8.280   7.322
  154   HG12  VAL  27          2HG1      VAL  27  15.220   7.479   8.224
  155   HG13  VAL  27          3HG1      VAL  27  15.395   7.195   6.492
  156   HG21  VAL  27          1HG2      VAL  27  14.494  10.848   5.762
  157   HG22  VAL  27          2HG2      VAL  27  16.082  10.502   6.447
  158   HG23  VAL  27          3HG2      VAL  27  15.470   9.534   5.106
  159    H    LEU  28           H        LEU  28  12.502   9.212   8.813
  160    HA   LEU  28           HA       LEU  28  12.093   6.524   9.766
  161    HB2  LEU  28           1HB      LEU  28  11.946   9.256  10.951
  162    HB3  LEU  28           2HB      LEU  28  11.173   7.914  11.793
  163    HG   LEU  28           HG       LEU  28  14.086   7.923  11.023
  164   HD11  LEU  28          1HD1      LEU  28  14.644   9.075  12.856
  165   HD12  LEU  28          2HD1      LEU  28  13.414   8.286  13.843
  166   HD13  LEU  28          3HD1      LEU  28  12.979   9.656  12.822
  167   HD21  LEU  28          1HD2      LEU  28  12.871   6.354  13.247
  168   HD22  LEU  28          2HD2      LEU  28  14.289   6.000  12.260
  169   HD23  LEU  28          3HD2      LEU  28  12.671   5.790  11.588
  170    H    GLU  29           H        GLU  29  10.306   8.278   7.767
  171    HA   GLU  29           HA       GLU  29   7.782   7.199   8.825
  172    HB2  GLU  29           1HB      GLU  29   7.909   9.777   7.277
  173    HB3  GLU  29           2HB      GLU  29   6.577   9.141   8.233
  174    HG2  GLU  29           1HG      GLU  29   8.065   9.418  10.254
  175    HG3  GLU  29           2HG      GLU  29   9.154  10.330   9.210
  176    H    ARG  30           H        ARG  30   9.067   5.604   7.201
  177    HA   ARG  30           HA       ARG  30   7.399   5.488   4.876
  178    HB2  ARG  30           1HB      ARG  30   8.992   5.755   3.171
  179    HB3  ARG  30           2HB      ARG  30   9.305   7.089   4.273
  180    HG2  ARG  30           1HG      ARG  30  11.186   5.911   5.225
  181    HG3  ARG  30           2HG      ARG  30  10.840   4.499   4.225
  182    HD2  ARG  30           1HD      ARG  30  12.669   5.844   3.301
  183    HD3  ARG  30           2HD      ARG  30  11.281   5.790   2.214
  184    HE   ARG  30           HE       ARG  30  10.864   8.058   3.619
  185   HH11  ARG  30          2HH1      ARG  30  13.597   6.820   1.853
  186   HH12  ARG  30          1HH1      ARG  30  14.190   8.387   1.415
  187   HH21  ARG  30          2HH2      ARG  30  11.635  10.128   3.049
  188   HH22  ARG  30          1HH2      ARG  30  13.074  10.268   2.097
  189    H    LEU  31           H        LEU  31   7.092   3.420   4.291
  190    HA   LEU  31           HA       LEU  31   8.918   1.405   5.424
  191    HB2  LEU  31           1HB      LEU  31   5.952   1.394   4.987
  192    HB3  LEU  31           2HB      LEU  31   6.857  -0.109   5.152
  193    HG   LEU  31           HG       LEU  31   7.668   0.824   7.387
  194   HD11  LEU  31          1HD1      LEU  31   5.216   2.464   7.491
  195   HD12  LEU  31          2HD1      LEU  31   6.574   3.136   6.590
  196   HD13  LEU  31          3HD1      LEU  31   6.774   2.693   8.285
  197   HD21  LEU  31          1HD2      LEU  31   5.039   0.470   8.159
  198   HD22  LEU  31          2HD2      LEU  31   6.248  -0.798   7.953
  199   HD23  LEU  31          3HD2      LEU  31   5.148  -0.403   6.631
  200    H    CYS  32           H        CYS  32  10.253   0.797   3.833
  201    HA   CYS  32           HA       CYS  32   9.513   0.760   1.081
  202    HB2  CYS  32           1HB      CYS  32  11.726  -0.387   0.782
  203    HB3  CYS  32           2HB      CYS  32  11.814   1.150   1.634
  204    HG   CYS  32           HG       CYS  32  12.051  -1.969   3.017
  205    H    VAL  33           H        VAL  33   7.741  -0.580   0.816
  206    HA   VAL  33           HA       VAL  33   8.255  -3.452   1.244
  207    HB   VAL  33           HB       VAL  33   5.565  -2.079   1.291
  208   HG11  VAL  33          1HG1      VAL  33   5.963  -4.835   2.298
  209   HG12  VAL  33          2HG1      VAL  33   4.573  -4.112   1.487
  210   HG13  VAL  33          3HG1      VAL  33   5.984  -4.607   0.550
  211   HG21  VAL  33          1HG2      VAL  33   6.738  -1.473   3.275
  212   HG22  VAL  33          2HG2      VAL  33   5.594  -2.742   3.710
  213   HG23  VAL  33          3HG2      VAL  33   7.304  -3.125   3.517
  214    H    ASN  34           H        ASN  34   8.451  -4.557  -0.580
  215    HA   ASN  34           HA       ASN  34   8.427  -5.069  -2.805
  216    HB2  ASN  34           1HB      ASN  34   5.605  -4.439  -2.075
  217    HB3  ASN  34           2HB      ASN  34   5.980  -4.683  -3.778
  218   HD21  ASN  34          1HD2      ASN  34   5.776  -6.148  -0.647
  219   HD22  ASN  34          2HD2      ASN  34   5.912  -7.787  -1.177
  220    H    GLY  35           H        GLY  35   9.366  -2.441  -2.234
  221    HA2  GLY  35           1HA      GLY  35  10.163  -0.775  -3.666
  222    HA3  GLY  35           2HA      GLY  35   8.971  -1.265  -4.861
  223    H    HIS  36           H        HIS  36   6.786  -1.136  -2.863
  224    HA   HIS  36           HA       HIS  36   6.185   1.663  -3.208
  225    HB2  HIS  36           1HB      HIS  36   4.557  -0.450  -1.784
  226    HB3  HIS  36           2HB      HIS  36   3.983   1.109  -2.369
  227    HD1  HIS  36           1HD      HIS  36   4.934   1.160  -5.213
  228    HD2  HIS  36           2HD      HIS  36   3.415  -2.268  -3.423
  229    HE1  HIS  36           1HE      HIS  36   4.144  -0.294  -7.107
  230    H    PHE  37           H        PHE  37   5.815   3.179  -1.592
  231    HA   PHE  37           HA       PHE  37   6.957   2.485   1.033
  232    HB2  PHE  37           1HB      PHE  37   6.888   5.177  -0.348
  233    HB3  PHE  37           2HB      PHE  37   7.582   4.858   1.238
  234    HD1  PHE  37           1HD      PHE  37   7.961   4.307  -2.373
  235    HD2  PHE  37           2HD      PHE  37   9.726   3.840   1.472
  236    HE1  PHE  37           1HE      PHE  37  10.117   3.771  -3.431
  237    HE2  PHE  37           2HE      PHE  37  11.884   3.304   0.420
  238    HZ   PHE  37           HZ       PHE  37  12.082   3.269  -2.034
  239    H    PHE  38           H        PHE  38   5.937   3.188   2.900
  240    HA   PHE  38           HA       PHE  38   3.429   4.651   2.668
  241    HB2  PHE  38           1HB      PHE  38   3.432   2.071   4.212
  242    HB3  PHE  38           2HB      PHE  38   2.058   3.014   3.642
  243    HD1  PHE  38           1HD      PHE  38   5.029   1.266   2.207
  244    HD2  PHE  38           2HD      PHE  38   0.878   2.147   1.885
  245    HE1  PHE  38           1HE      PHE  38   4.885  -0.163   0.210
  246    HE2  PHE  38           2HE      PHE  38   0.726   0.718  -0.113
  247    HZ   PHE  38           HZ       PHE  38   2.731  -0.440  -0.952
  248    H    HIS  39           H        HIS  39   2.569   5.307   4.783
  249    HA   HIS  39           HA       HIS  39   4.665   6.241   6.480
  250    HB2  HIS  39           1HB      HIS  39   1.663   6.432   6.571
  251    HB3  HIS  39           2HB      HIS  39   2.658   7.031   7.896
  252    HD2  HIS  39           2HD      HIS  39   4.970   8.527   6.091
  253    HE1  HIS  39           1HE      HIS  39   1.687  10.679   4.481
  254    HE2  HIS  39           2HE      HIS  39   4.192  10.573   4.712
  255    H    ARG  40           H        ARG  40   5.004   5.774   8.685
  256    HA   ARG  40           HA       ARG  40   4.880   3.038   9.353
  257    HB2  ARG  40           1HB      ARG  40   5.636   5.531  10.829
  258    HB3  ARG  40           2HB      ARG  40   5.468   4.020  11.712
  259    HG2  ARG  40           1HG      ARG  40   7.124   2.987  10.210
  260    HG3  ARG  40           2HG      ARG  40   7.326   4.544   9.403
  261    HD2  ARG  40           1HD      ARG  40   9.095   4.325  10.982
  262    HD3  ARG  40           2HD      ARG  40   7.959   5.512  11.622
  263    HE   ARG  40           HE       ARG  40   7.143   3.183  12.744
  264   HH11  ARG  40          2HH1      ARG  40  10.201   4.837  12.574
  265   HH12  ARG  40          1HH1      ARG  40  10.763   4.228  14.096
  266   HH21  ARG  40          2HH2      ARG  40   7.871   2.375  14.749
  267   HH22  ARG  40          1HH2      ARG  40   9.437   2.827  15.332
  268    H    SER  41           H        SER  41   2.578   5.519   9.615
  269    HA   SER  41           HA       SER  41   1.103   4.148  11.742
  270    HB2  SER  41           1HB      SER  41   0.939   6.886  10.522
  271    HB3  SER  41           2HB      SER  41  -0.446   6.225  11.392
  272    HG   SER  41           HG       SER  41   1.036   5.875  13.172
  273    H    CYS  42           H        CYS  42   0.596   5.404   8.451
  274    HA   CYS  42           HA       CYS  42  -1.980   4.456   8.040
  275    HB2  CYS  42           1HB      CYS  42   0.251   4.703   6.009
  276    HB3  CYS  42           2HB      CYS  42  -1.464   4.571   5.632
  277    H    PHE  43           H        PHE  43   1.114   2.849   7.341
  278    HA   PHE  43           HA       PHE  43   0.108   0.504   6.233
  279    HB2  PHE  43           1HB      PHE  43   2.523   1.228   6.313
  280    HB3  PHE  43           2HB      PHE  43   2.563   0.679   7.986
  281    HD1  PHE  43           2HD      PHE  43   2.144  -0.408   4.489
  282    HD2  PHE  43           1HD      PHE  43   2.766  -1.613   8.523
  283    HE1  PHE  43           2HE      PHE  43   2.671  -2.686   3.723
  284    HE2  PHE  43           1HE      PHE  43   3.295  -3.893   7.764
  285    HZ   PHE  43           HZ       PHE  43   3.246  -4.433   5.362
  286    H    ARG  44           H        ARG  44  -1.548  -0.541   7.181
  287    HA   ARG  44           HA       ARG  44  -1.033  -1.814   9.750
  288    HB2  ARG  44           1HB      ARG  44  -3.610  -0.317   9.264
  289    HB3  ARG  44           2HB      ARG  44  -3.119  -1.142  10.738
  290    HG2  ARG  44           1HG      ARG  44  -1.550   0.500  11.276
  291    HG3  ARG  44           2HG      ARG  44  -1.539   1.152   9.636
  292    HD2  ARG  44           1HD      ARG  44  -3.613   2.191   9.909
  293    HD3  ARG  44           2HD      ARG  44  -4.025   1.202  11.309
  294    HE   ARG  44           HE       ARG  44  -1.778   2.678  11.991
  295   HH11  ARG  44          2HH1      ARG  44  -5.092   3.269  11.105
  296   HH12  ARG  44          1HH1      ARG  44  -5.213   4.732  12.024
  297   HH21  ARG  44          2HH2      ARG  44  -1.925   4.603  13.205
  298   HH22  ARG  44          1HH2      ARG  44  -3.411   5.491  13.217
  299    H    CYS  45           H        CYS  45  -2.908  -3.376  10.265
  300    HA   CYS  45           HA       CYS  45  -3.067  -5.311   8.304
  301    HB2  CYS  45           1HB      CYS  45  -3.581  -5.588  10.756
  302    HB3  CYS  45           2HB      CYS  45  -5.159  -4.873  10.440
  303    H    HIS  46           H        HIS  46  -5.049  -6.155   7.225
  304    HA   HIS  46           HA       HIS  46  -6.509  -3.925   5.994
  305    HB2  HIS  46           1HB      HIS  46  -5.271  -5.301   4.421
  306    HB3  HIS  46           2HB      HIS  46  -6.048  -6.758   5.036
  307    HD1  HIS  46           1HD      HIS  46  -6.504  -3.971   2.662
  308    HD2  HIS  46           2HD      HIS  46  -8.802  -7.021   4.300
  309    HE1  HIS  46           1HE      HIS  46  -8.564  -4.106   1.226
  310    H    THR  47           H        THR  47  -6.933  -6.088   8.404
  311    HA   THR  47           HA       THR  47  -9.838  -6.263   7.924
  312    HB   THR  47           HB       THR  47  -7.989  -8.265   9.206
  313    HG1  THR  47           1HG      THR  47 -10.039  -8.556   7.246
  314   HG21  THR  47          1HG2      THR  47  -9.917  -7.891  10.709
  315   HG22  THR  47          2HG2      THR  47  -9.927  -9.500   9.986
  316   HG23  THR  47          3HG2      THR  47 -11.005  -8.248   9.368
  317    H    CYS  48           H        CYS  48  -7.257  -5.654  10.212
  318    HA   CYS  48           HA       CYS  48  -9.258  -4.620  12.113
  319    HB2  CYS  48           1HB      CYS  48  -7.637  -5.136  13.917
  320    HB3  CYS  48           2HB      CYS  48  -8.173  -6.575  13.057
  321    H    GLU  49           H        GLU  49  -6.788  -3.833  10.021
  322    HA   GLU  49           HA       GLU  49  -5.491  -1.991   9.681
  323    HB2  GLU  49           1HB      GLU  49  -7.543  -0.569  11.378
  324    HB3  GLU  49           2HB      GLU  49  -6.515   0.133  10.136
  325    HG2  GLU  49           1HG      GLU  49  -8.439  -0.050   8.957
  326    HG3  GLU  49           2HG      GLU  49  -7.750  -1.636   8.615
  327    H    ALA  50           H        ALA  50  -4.388  -3.498  11.588
  328    HA   ALA  50           HA       ALA  50  -3.742  -1.730  13.838
  329    HB1  ALA  50           1HB      ALA  50  -3.386  -4.682  13.406
  330    HB2  ALA  50           2HB      ALA  50  -2.606  -3.820  14.733
  331    HB3  ALA  50           3HB      ALA  50  -4.365  -3.859  14.620
  332    H    THR  51           H        THR  51  -1.731  -0.926  14.170
  333    HA   THR  51           HA       THR  51   0.003  -0.427  12.114
  334    HB   THR  51           HB       THR  51   0.860  -0.746  14.996
  335    HG1  THR  51           1HG      THR  51  -0.994   0.837  14.063
  336   HG21  THR  51          1HG2      THR  51   2.429   1.127  14.318
  337   HG22  THR  51          2HG2      THR  51   1.983   0.773  12.649
  338   HG23  THR  51          3HG2      THR  51   2.777  -0.458  13.630
  339    H    LEU  52           H        LEU  52   0.575  -2.123  10.816
  340    HA   LEU  52           HA       LEU  52   1.500  -4.626  11.788
  341    HB2  LEU  52           1HB      LEU  52   1.821  -3.333   9.084
  342    HB3  LEU  52           2HB      LEU  52   2.200  -5.015   9.450
  343    HG   LEU  52           HG       LEU  52  -0.535  -3.743   9.538
  344   HD11  LEU  52          1HD1      LEU  52   0.852  -4.515   7.336
  345   HD12  LEU  52          2HD1      LEU  52  -0.906  -4.519   7.469
  346   HD13  LEU  52          3HD1      LEU  52   0.003  -6.004   7.752
  347   HD21  LEU  52          1HD2      LEU  52   0.253  -6.622   9.968
  348   HD22  LEU  52          2HD2      LEU  52  -1.378  -5.952  10.014
  349   HD23  LEU  52          3HD2      LEU  52  -0.202  -5.498  11.249
  350    H    TRP  53           H        TRP  53   3.164  -4.218  13.256
  351    HA   TRP  53           HA       TRP  53   5.405  -2.613  12.802
  352    HB2  TRP  53           1HB      TRP  53   5.610  -5.139  14.408
  353    HB3  TRP  53           2HB      TRP  53   6.314  -3.556  14.728
  354    HD1  TRP  53           HD       TRP  53   3.016  -5.486  15.068
  355    HE1  TRP  53           1HE      TRP  53   1.520  -4.254  16.761
  356    HE3  TRP  53           3HE      TRP  53   5.858  -1.293  15.760
  357    HZ2  TRP  53           2HZ      TRP  53   1.541  -1.825  18.200
  358    HZ3  TRP  53           3HZ      TRP  53   5.048   0.437  17.312
  359    HH2  TRP  53           HH       TRP  53   2.934   0.175  18.504
  360    HA   PRO  54           HA       PRO  54   7.914  -4.807   9.946
  361    HB2  PRO  54           1HB      PRO  54  10.400  -4.182  10.842
  362    HB3  PRO  54           2HB      PRO  54   9.354  -3.018  10.020
  363    HG2  PRO  54           1HG      PRO  54   9.856  -3.375  12.950
  364    HG3  PRO  54           2HG      PRO  54   9.748  -1.877  12.008
  365    HD2  PRO  54           1HD      PRO  54   7.697  -2.802  13.514
  366    HD3  PRO  54           2HD      PRO  54   7.443  -1.893  12.010
  367    H    GLY  55           H        GLY  55   7.163  -6.913  10.784
  368    HA2  GLY  55           1HA      GLY  55   8.771  -8.926  10.978
  369    HA3  GLY  55           2HA      GLY  55   9.099  -8.236  12.560
  370    H    GLY  56           H        GLY  56   5.957  -7.543  11.982
  371    HA2  GLY  56           1HA      GLY  56   5.016 -10.111  13.099
  372    HA3  GLY  56           2HA      GLY  56   4.520  -8.574  13.792
  373    H    TYR  57           H        TYR  57   4.831  -9.537  10.390
  374    HA   TYR  57           HA       TYR  57   1.975  -9.670  10.036
  375    HB2  TYR  57           1HB      TYR  57   1.704  -7.795   8.596
  376    HB3  TYR  57           2HB      TYR  57   2.534  -7.198  10.029
  377    HD1  TYR  57           2HD      TYR  57   5.085  -6.954   9.898
  378    HD2  TYR  57           1HD      TYR  57   2.611  -7.445   6.471
  379    HE1  TYR  57           2HE      TYR  57   6.872  -6.031   8.482
  380    HE2  TYR  57           1HE      TYR  57   4.392  -6.525   5.046
  381    HH   TYR  57           HH       TYR  57   6.500  -4.820   5.605
  382    H    GLU  58           H        GLU  58   1.489  -9.845   7.574
  383    HA   GLU  58           HA       GLU  58   3.638 -10.889   5.964
  384    HB2  GLU  58           1HB      GLU  58   1.515 -12.706   7.096
  385    HB3  GLU  58           2HB      GLU  58   2.418 -13.105   5.642
  386    HG2  GLU  58           1HG      GLU  58   4.516 -12.838   7.005
  387    HG3  GLU  58           2HG      GLU  58   3.479 -12.747   8.428
  388    H    GLN  59           H        GLN  59   3.056 -11.186   3.778
  389    HA   GLN  59           HA       GLN  59   0.511  -9.898   3.066
  390    HB2  GLN  59           1HB      GLN  59   2.427  -8.681   2.250
  391    HB3  GLN  59           2HB      GLN  59   3.106 -10.139   1.538
  392    HG2  GLN  59           1HG      GLN  59   0.797 -10.121   0.236
  393    HG3  GLN  59           2HG      GLN  59   0.914  -8.396   0.576
  394   HE21  GLN  59          1HE2      GLN  59   0.925  -8.690  -1.914
  395   HE22  GLN  59          2HE2      GLN  59   2.493  -8.700  -2.639
  396    H    HIS  60           H        HIS  60  -0.975 -11.446   2.759
  397    HA   HIS  60           HA       HIS  60  -0.499 -14.068   1.918
  398    HB2  HIS  60           1HB      HIS  60  -2.600 -13.090   3.013
  399    HB3  HIS  60           2HB      HIS  60  -3.073 -12.591   1.391
  400    HD1  HIS  60           1HD      HIS  60  -4.060 -14.352  -0.125
  401    HD2  HIS  60           2HD      HIS  60  -2.504 -15.931   3.389
  402    HE1  HIS  60           1HE      HIS  60  -4.807 -16.753  -0.078
  403    HA   PRO  61           HA       PRO  61   0.381 -13.427  -2.382
  404    HB2  PRO  61           1HB      PRO  61   0.378 -16.046  -3.096
  405    HB3  PRO  61           2HB      PRO  61   1.715 -15.291  -2.220
  406    HG2  PRO  61           1HG      PRO  61  -0.533 -16.967  -1.170
  407    HG3  PRO  61           2HG      PRO  61   1.190 -17.017  -0.752
  408    HD2  PRO  61           1HD      PRO  61  -0.653 -15.787   0.805
  409    HD3  PRO  61           2HD      PRO  61   1.023 -15.216   0.677
  410    H    GLY  62           H        GLY  62  -2.297 -15.425  -1.239
  411    HA2  GLY  62           1HA      GLY  62  -3.687 -16.006  -3.503
  412    HA3  GLY  62           2HA      GLY  62  -4.472 -15.535  -2.003
  413    H    ASP  63           H        ASP  63  -4.819 -13.219  -1.644
  414    HA   ASP  63           HA       ASP  63  -5.888 -11.993  -3.999
  415    HB2  ASP  63           1HB      ASP  63  -5.788 -11.293  -1.091
  416    HB3  ASP  63           2HB      ASP  63  -6.215 -10.045  -2.258
  417    H    GLY  64           H        GLY  64  -3.331 -11.047  -1.696
  418    HA2  GLY  64           1HA      GLY  64  -1.201 -10.292  -2.683
  419    HA3  GLY  64           2HA      GLY  64  -2.161  -9.412  -3.862
  420    H    HIS  65           H        HIS  65  -2.701  -9.623  -0.375
  421    HA   HIS  65           HA       HIS  65  -2.071  -6.753  -0.175
  422    HB2  HIS  65           1HB      HIS  65  -4.335  -8.175   1.239
  423    HB3  HIS  65           2HB      HIS  65  -3.941  -6.463   1.362
  424    HD1  HIS  65           1HD      HIS  65  -5.639  -5.172   0.129
  425    HD2  HIS  65           2HD      HIS  65  -4.664  -8.699  -1.839
  426    HE1  HIS  65           1HE      HIS  65  -6.981  -5.149  -1.998
  427    H    PHE  66           H        PHE  66  -2.249  -6.279   2.430
  428    HA   PHE  66           HA       PHE  66  -0.386  -8.206   3.655
  429    HB2  PHE  66           1HB      PHE  66  -0.515  -5.199   3.912
  430    HB3  PHE  66           2HB      PHE  66   0.449  -6.218   4.977
  431    HD1  PHE  66           2HD      PHE  66   0.002  -5.153   1.468
  432    HD2  PHE  66           1HD      PHE  66   2.555  -7.023   4.313
  433    HE1  PHE  66           2HE      PHE  66   1.851  -5.089  -0.154
  434    HE2  PHE  66           1HE      PHE  66   4.409  -6.961   2.696
  435    HZ   PHE  66           HZ       PHE  66   4.058  -5.994   0.459
  436    H    TYR  67           H        TYR  67  -1.034  -9.157   5.469
  437    HA   TYR  67           HA       TYR  67  -3.090  -7.843   7.107
  438    HB2  TYR  67           1HB      TYR  67  -3.079 -10.805   6.520
  439    HB3  TYR  67           2HB      TYR  67  -4.317  -9.885   7.368
  440    HD1  TYR  67           2HD      TYR  67  -2.790 -10.506   4.061
  441    HD2  TYR  67           1HD      TYR  67  -6.035  -8.749   6.180
  442    HE1  TYR  67           2HE      TYR  67  -3.989 -10.175   1.939
  443    HE2  TYR  67           1HE      TYR  67  -7.243  -8.415   4.064
  444    HH   TYR  67           HH       TYR  67  -5.978  -9.652   1.011
  445    H    CYS  68           H        CYS  68  -3.252  -8.816   9.311
  446    HA   CYS  68           HA       CYS  68  -0.625  -9.029  10.445
  447    HB2  CYS  68           1HB      CYS  68  -1.761  -9.065  12.591
  448    HB3  CYS  68           2HB      CYS  68  -2.470  -7.817  11.571
  449    H    LEU  69           H        LEU  69  -0.240 -10.759  12.173
  450    HA   LEU  69           HA       LEU  69  -0.402 -13.319  10.879
  451    HB2  LEU  69           1HB      LEU  69   0.564 -12.901  13.680
  452    HB3  LEU  69           2HB      LEU  69   1.098 -14.082  12.486
  453    HG   LEU  69           HG       LEU  69   1.704 -11.126  12.473
  454   HD11  LEU  69          1HD1      LEU  69   3.846 -13.142  12.572
  455   HD12  LEU  69          2HD1      LEU  69   2.862 -12.999  14.028
  456   HD13  LEU  69          3HD1      LEU  69   3.705 -11.587  13.392
  457   HD21  LEU  69          1HD2      LEU  69   1.426 -12.062  10.209
  458   HD22  LEU  69          2HD2      LEU  69   2.637 -13.288  10.586
  459   HD23  LEU  69          3HD2      LEU  69   3.091 -11.584  10.544
  460    H    GLN  70           H        GLN  70  -2.763 -11.788  12.258
  461    HA   GLN  70           HA       GLN  70  -3.799 -14.155  13.674
  462    HB2  GLN  70           1HB      GLN  70  -3.405 -12.318  15.240
  463    HB3  GLN  70           2HB      GLN  70  -4.387 -11.246  14.250
  464    HG2  GLN  70           1HG      GLN  70  -6.368 -12.365  14.803
  465    HG3  GLN  70           2HG      GLN  70  -5.500 -13.764  15.432
  466   HE21  GLN  70          1HE2      GLN  70  -6.724 -13.566  17.357
  467   HE22  GLN  70          2HE2      GLN  70  -6.317 -12.381  18.547
  468    H    HIS  71           H        HIS  71  -4.127 -12.105  11.043
  469    HA   HIS  71           HA       HIS  71  -6.896 -13.015  10.613
  470    HB2  HIS  71           1HB      HIS  71  -5.663 -10.323  10.130
  471    HB3  HIS  71           2HB      HIS  71  -7.016 -10.860   9.140
  472    HD2  HIS  71           2HD      HIS  71  -8.011 -12.279  12.333
  473    HE1  HIS  71           1HE      HIS  71  -9.214  -8.223  12.658
  474    HE2  HIS  71           2HE      HIS  71  -9.371 -10.527  13.664
  475    H    LEU  72           H        LEU  72  -3.694 -12.769   9.440
  476    HA   LEU  72           HA       LEU  72  -3.962 -12.864   6.697
  477    HB2  LEU  72           1HB      LEU  72  -1.828 -12.754   7.958
  478    HB3  LEU  72           2HB      LEU  72  -2.004 -14.466   8.337
  479    HG   LEU  72           HG       LEU  72  -2.121 -14.618   5.672
  480   HD11  LEU  72          1HD1      LEU  72  -1.802 -12.518   4.878
  481   HD12  LEU  72          2HD1      LEU  72  -0.113 -12.989   5.053
  482   HD13  LEU  72          3HD1      LEU  72  -0.884 -12.000   6.292
  483   HD21  LEU  72          1HD2      LEU  72   0.440 -14.375   7.246
  484   HD22  LEU  72          2HD2      LEU  72   0.227 -15.223   5.714
  485   HD23  LEU  72          3HD2      LEU  72  -0.578 -15.813   7.169
  486    HA   PRO  73           HA       PRO  73  -6.321 -16.627   6.232
  487    HB2  PRO  73           1HB      PRO  73  -6.507 -16.483   3.527
  488    HB3  PRO  73           2HB      PRO  73  -7.506 -15.508   4.612
  489    HG2  PRO  73           1HG      PRO  73  -5.017 -14.747   3.133
  490    HG3  PRO  73           2HG      PRO  73  -6.515 -13.825   3.350
  491    HD2  PRO  73           1HD      PRO  73  -4.291 -13.358   4.822
  492    HD3  PRO  73           2HD      PRO  73  -5.929 -13.130   5.468
  493    H    GLN  74           H        GLN  74  -6.123 -18.513   4.558
  494    HA   GLN  74           HA       GLN  74  -3.424 -19.033   3.659
  495    HB2  GLN  74           1HB      GLN  74  -4.586 -20.296   6.084
  496    HB3  GLN  74           2HB      GLN  74  -3.684 -21.339   4.992
  497    HG2  GLN  74           1HG      GLN  74  -2.649 -18.820   6.275
  498    HG3  GLN  74           2HG      GLN  74  -2.280 -20.468   6.782
  499   HE21  GLN  74          1HE2      GLN  74  -0.174 -18.999   6.290
  500   HE22  GLN  74          2HE2      GLN  74   0.554 -19.381   4.771
  501    H    THR  75           H        THR  75  -3.793 -19.724   1.662
  502    HA   THR  75           HA       THR  75  -6.223 -21.100   0.952
  503    HB   THR  75           HB       THR  75  -5.327 -19.531  -0.645
  504    HG1  THR  75           1HG      THR  75  -4.975 -22.216  -1.545
  505   HG21  THR  75          1HG2      THR  75  -3.007 -19.495  -0.183
  506   HG22  THR  75          2HG2      THR  75  -3.154 -20.124  -1.824
  507   HG23  THR  75          3HG2      THR  75  -2.844 -21.225  -0.482
  508    H    ASP  76           H        ASP  76  -2.901 -21.943   1.603
  509    HA   ASP  76           HA       ASP  76  -1.750 -23.933   1.368
  510    HB2  ASP  76           1HB      ASP  76  -2.857 -25.741   2.710
  511    HB3  ASP  76           2HB      ASP  76  -2.757 -24.187   3.533
  512    H    SER  77           H        SER  77  -2.916 -23.414  -1.053
  513    HA   SER  77           HA       SER  77  -3.894 -24.337  -2.927
  514    HB2  SER  77           1HB      SER  77  -1.560 -25.247  -2.802
  515    HB3  SER  77           2HB      SER  77  -2.218 -26.695  -2.039
  516    HG   SER  77           HG       SER  77  -1.930 -26.823  -4.365
  517    H    GLY  78           H        GLY  78  -5.846 -24.449  -1.171
  518    HA2  GLY  78           1HA      GLY  78  -6.745 -27.120  -0.603
  519    HA3  GLY  78           2HA      GLY  78  -7.657 -25.637  -0.359
  520    HA   PRO  79           HA       PRO  79  -9.001 -28.113  -4.226
  521    HB2  PRO  79           1HB      PRO  79 -11.152 -29.409  -3.194
  522    HB3  PRO  79           2HB      PRO  79  -9.529 -30.109  -3.217
  523    HG2  PRO  79           1HG      PRO  79 -10.972 -28.745  -0.977
  524    HG3  PRO  79           2HG      PRO  79  -9.986 -30.218  -0.939
  525    HD2  PRO  79           1HD      PRO  79  -9.040 -27.811  -0.138
  526    HD3  PRO  79           2HD      PRO  79  -8.005 -29.041  -0.891
  527    H    SER  80           H        SER  80  -9.804 -26.366  -5.270
  528    HA   SER  80           HA       SER  80 -12.441 -25.385  -4.403
  529    HB2  SER  80           1HB      SER  80 -10.085 -23.754  -5.365
  530    HB3  SER  80           2HB      SER  80 -11.730 -23.123  -5.297
  531    HG   SER  80           HG       SER  80  -9.929 -23.489  -3.292
  532    H    SER  81           H        SER  81 -13.813 -26.139  -5.881
  533    HA   SER  81           HA       SER  81 -13.364 -25.464  -8.676
  534    HB2  SER  81           1HB      SER  81 -13.777 -27.701  -9.498
  535    HB3  SER  81           2HB      SER  81 -12.431 -27.764  -8.360
  536    HG   SER  81           HG       SER  81 -15.128 -28.504  -7.890
  537    H    GLY  82           H        GLY  82 -15.328 -25.794 -10.001
  538    HA2  GLY  82           1HA      GLY  82 -17.801 -25.886  -8.409
  539    HA3  GLY  82           2HA      GLY  82 -17.505 -24.511  -9.463
  Start of MODEL    5
    1    H1   GLY   1           H        GLY   1 -22.755  16.912 -35.187
    2    HA2  GLY   1           1HA      GLY   1 -23.452  14.160 -35.426
    3    HA3  GLY   1           2HA      GLY   1 -21.745  14.406 -35.765
    4    H    SER   2           H        SER   2 -20.926  13.381 -33.987
    5    HA   SER   2           HA       SER   2 -21.468  14.691 -31.407
    6    HB2  SER   2           1HB      SER   2 -21.372  11.759 -32.049
    7    HB3  SER   2           2HB      SER   2 -20.945  12.327 -30.436
    8    HG   SER   2           HG       SER   2 -23.043  12.163 -30.179
    9    H    SER   3           H        SER   3 -19.585  15.964 -31.865
   10    HA   SER   3           HA       SER   3 -17.118  14.559 -31.144
   11    HB2  SER   3           1HB      SER   3 -17.404  16.451 -33.489
   12    HB3  SER   3           2HB      SER   3 -15.860  15.901 -32.840
   13    HG   SER   3           HG       SER   3 -17.680  13.907 -33.427
   14    H    GLY   4           H        GLY   4 -15.485  15.932 -30.224
   15    HA2  GLY   4           1HA      GLY   4 -14.887  18.263 -29.608
   16    HA3  GLY   4           2HA      GLY   4 -16.583  18.478 -29.199
   17    H    SER   5           H        SER   5 -13.516  17.296 -28.159
   18    HA   SER   5           HA       SER   5 -14.525  17.077 -25.442
   19    HB2  SER   5           1HB      SER   5 -13.023  14.784 -26.729
   20    HB3  SER   5           2HB      SER   5 -13.586  14.861 -25.059
   21    HG   SER   5           HG       SER   5 -15.250  14.925 -27.360
   22    H    SER   6           H        SER   6 -12.716  16.785 -23.864
   23    HA   SER   6           HA       SER   6 -10.056  17.434 -24.777
   24    HB2  SER   6           1HB      SER   6  -9.861  19.547 -23.596
   25    HB3  SER   6           2HB      SER   6 -11.195  19.650 -24.745
   26    HG   SER   6           HG       SER   6 -11.780  18.810 -22.150
   27    H    GLY   7           H        GLY   7  -8.470  17.080 -23.213
   28    HA2  GLY   7           1HA      GLY   7  -9.096  16.618 -20.464
   29    HA3  GLY   7           2HA      GLY   7  -8.899  15.107 -21.340
   30    H    GLN   8           H        GLN   8  -7.309  16.679 -19.220
   31    HA   GLN   8           HA       GLN   8  -4.705  16.222 -20.492
   32    HB2  GLN   8           1HB      GLN   8  -5.702  18.724 -19.242
   33    HB3  GLN   8           2HB      GLN   8  -4.042  18.266 -18.888
   34    HG2  GLN   8           1HG      GLN   8  -5.027  18.340 -21.708
   35    HG3  GLN   8           2HG      GLN   8  -4.526  19.818 -20.887
   36   HE21  GLN   8          1HE2      GLN   8  -3.509  17.431 -22.872
   37   HE22  GLN   8          2HE2      GLN   8  -1.809  17.495 -22.569
   38    H    HIS   9           H        HIS   9  -3.112  15.415 -19.155
   39    HA   HIS   9           HA       HIS   9  -3.943  14.777 -16.401
   40    HB2  HIS   9           1HB      HIS   9  -2.613  12.678 -16.629
   41    HB3  HIS   9           2HB      HIS   9  -4.007  12.746 -17.703
   42    HD1  HIS   9           1HD      HIS   9  -2.958  11.092 -19.370
   43    HD2  HIS   9           2HD      HIS   9  -0.707  14.532 -18.771
   44    HE1  HIS   9           1HE      HIS   9  -1.227  11.089 -21.194
   45    H    GLN  10           H        GLN  10  -1.887  14.014 -15.114
   46    HA   GLN  10           HA       GLN  10   0.330  15.853 -15.713
   47    HB2  GLN  10           1HB      GLN  10   0.545  16.316 -13.307
   48    HB3  GLN  10           2HB      GLN  10  -1.016  16.829 -13.934
   49    HG2  GLN  10           1HG      GLN  10  -2.056  14.831 -13.012
   50    HG3  GLN  10           2HG      GLN  10  -0.493  14.290 -12.405
   51   HE21  GLN  10          1HE2      GLN  10  -1.355  14.253 -10.298
   52   HE22  GLN  10          2HE2      GLN  10  -1.575  15.710  -9.396
   53    H    GLU  11           H        GLU  11   2.366  15.273 -14.604
   54    HA   GLU  11           HA       GLU  11   2.575  12.369 -14.153
   55    HB2  GLU  11           1HB      GLU  11   3.548  13.465 -16.358
   56    HB3  GLU  11           2HB      GLU  11   4.880  13.886 -15.291
   57    HG2  GLU  11           1HG      GLU  11   5.413  11.839 -16.381
   58    HG3  GLU  11           2HG      GLU  11   5.082  11.489 -14.685
   59    H    ALA  12           H        ALA  12   4.182  11.676 -12.680
   60    HA   ALA  12           HA       ALA  12   4.932  13.749 -10.735
   61    HB1  ALA  12           1HB      ALA  12   5.395  11.364  -9.479
   62    HB2  ALA  12           2HB      ALA  12   3.917  12.318  -9.346
   63    HB3  ALA  12           3HB      ALA  12   4.007  10.987 -10.500
   64    H    GLY  13           H        GLY  13   7.024  13.688  -9.756
   65    HA2  GLY  13           1HA      GLY  13   9.060  12.552 -11.561
   66    HA3  GLY  13           2HA      GLY  13   9.290  13.967 -10.545
   67    H    ALA  14           H        ALA  14   8.725  13.333  -8.094
   68    HA   ALA  14           HA       ALA  14  10.457  11.029  -7.506
   69    HB1  ALA  14           1HB      ALA  14   9.920  12.806  -5.271
   70    HB2  ALA  14           2HB      ALA  14  11.458  12.249  -5.931
   71    HB3  ALA  14           3HB      ALA  14  10.644  13.641  -6.645
   72    H    GLY  15           H        GLY  15   9.449   9.255  -6.842
   73    HA2  GLY  15           1HA      GLY  15   6.739   9.414  -5.800
   74    HA3  GLY  15           2HA      GLY  15   7.616   7.947  -6.210
   75    H    ASP  16           H        ASP  16   8.417  10.623  -4.009
   76    HA   ASP  16           HA       ASP  16   8.955   8.645  -1.919
   77    HB2  ASP  16           1HB      ASP  16   9.866  10.823  -0.766
   78    HB3  ASP  16           2HB      ASP  16  10.803  10.030  -2.029
   79    H    LEU  17           H        LEU  17   6.293   8.896  -2.364
   80    HA   LEU  17           HA       LEU  17   5.396  10.278   0.067
   81    HB2  LEU  17           1HB      LEU  17   3.766  10.226  -2.457
   82    HB3  LEU  17           2HB      LEU  17   3.474  11.161  -0.992
   83    HG   LEU  17           HG       LEU  17   5.779  11.626  -2.880
   84   HD11  LEU  17          1HD1      LEU  17   4.287  13.793  -3.204
   85   HD12  LEU  17          2HD1      LEU  17   2.996  12.649  -2.836
   86   HD13  LEU  17          3HD1      LEU  17   4.075  12.352  -4.198
   87   HD21  LEU  17          1HD2      LEU  17   6.559  13.060  -1.375
   88   HD22  LEU  17          2HD2      LEU  17   5.374  12.426  -0.233
   89   HD23  LEU  17          3HD2      LEU  17   4.984  13.837  -1.218
   90    H    CYS  18           H        CYS  18   4.015   9.142   1.316
   91    HA   CYS  18           HA       CYS  18   3.792   6.464   1.319
   92    HB2  CYS  18           1HB      CYS  18   2.946   7.741   3.168
   93    HB3  CYS  18           2HB      CYS  18   1.693   8.465   2.164
   94    H    ALA  19           H        ALA  19   2.140   4.931   0.738
   95    HA   ALA  19           HA       ALA  19   1.098   5.439  -1.927
   96    HB1  ALA  19           1HB      ALA  19   1.271   3.232  -2.264
   97    HB2  ALA  19           2HB      ALA  19   2.227   3.235  -0.781
   98    HB3  ALA  19           3HB      ALA  19   0.510   2.839  -0.722
   99    H    LEU  20           H        LEU  20  -0.102   4.693   1.309
  100    HA   LEU  20           HA       LEU  20  -2.795   4.298   0.691
  101    HB2  LEU  20           1HB      LEU  20  -1.244   5.014   3.093
  102    HB3  LEU  20           2HB      LEU  20  -2.954   5.441   3.129
  103    HG   LEU  20           HG       LEU  20  -3.169   2.888   2.355
  104   HD11  LEU  20          1HD1      LEU  20  -1.129   2.330   4.335
  105   HD12  LEU  20          2HD1      LEU  20  -0.460   3.062   2.877
  106   HD13  LEU  20          3HD1      LEU  20  -1.414   1.584   2.763
  107   HD21  LEU  20          1HD2      LEU  20  -2.862   2.765   5.159
  108   HD22  LEU  20          2HD2      LEU  20  -4.350   2.947   4.231
  109   HD23  LEU  20          3HD2      LEU  20  -3.466   4.375   4.770
  110    H    CYS  21           H        CYS  21  -1.324   7.278   1.996
  111    HA   CYS  21           HA       CYS  21  -3.530   8.796   0.781
  112    HB2  CYS  21           1HB      CYS  21  -2.864  10.603   2.374
  113    HB3  CYS  21           2HB      CYS  21  -3.407   9.126   3.163
  114    H    GLY  22           H        GLY  22  -0.018   8.976   1.361
  115    HA2  GLY  22           1HA      GLY  22   1.611   9.594  -0.204
  116    HA3  GLY  22           2HA      GLY  22   0.336  10.137  -1.284
  117    H    GLU  23           H        GLU  23   1.193  11.009   2.062
  118    HA   GLU  23           HA       GLU  23   0.884  13.817   1.382
  119    HB2  GLU  23           1HB      GLU  23   1.125  12.260   3.920
  120    HB3  GLU  23           2HB      GLU  23   1.526  13.971   3.938
  121    HG2  GLU  23           1HG      GLU  23  -0.692  14.517   3.108
  122    HG3  GLU  23           2HG      GLU  23  -1.099  12.803   3.042
  123    H    HIS  24           H        HIS  24   3.332  12.128   3.344
  124    HA   HIS  24           HA       HIS  24   5.524  12.957   1.747
  125    HB2  HIS  24           1HB      HIS  24   4.634  15.075   3.078
  126    HB3  HIS  24           2HB      HIS  24   5.581  14.361   4.379
  127    HD1  HIS  24           1HD      HIS  24   8.179  14.134   3.943
  128    HD2  HIS  24           2HD      HIS  24   6.089  16.358   1.124
  129    HE1  HIS  24           1HE      HIS  24   9.928  15.406   2.660
  130    H    LEU  25           H        LEU  25   7.154  11.597   2.125
  131    HA   LEU  25           HA       LEU  25   7.074  10.007   4.592
  132    HB2  LEU  25           1HB      LEU  25   8.430   9.478   1.953
  133    HB3  LEU  25           2HB      LEU  25   8.514   8.420   3.360
  134    HG   LEU  25           HG       LEU  25   5.876   9.111   2.113
  135   HD11  LEU  25          1HD1      LEU  25   7.872   7.063   1.194
  136   HD12  LEU  25          2HD1      LEU  25   7.035   8.288   0.241
  137   HD13  LEU  25          3HD1      LEU  25   6.143   6.908   0.882
  138   HD21  LEU  25          1HD2      LEU  25   6.258   6.437   3.126
  139   HD22  LEU  25          2HD2      LEU  25   5.070   7.656   3.587
  140   HD23  LEU  25          3HD2      LEU  25   6.662   7.644   4.347
  141    H    TYR  26           H        TYR  26   9.120   9.421   5.599
  142    HA   TYR  26           HA       TYR  26  11.257  11.392   5.148
  143    HB2  TYR  26           1HB      TYR  26   9.815  11.945   7.149
  144    HB3  TYR  26           2HB      TYR  26  10.385  10.450   7.882
  145    HD1  TYR  26           1HD      TYR  26  12.216  13.037   5.914
  146    HD2  TYR  26           2HD      TYR  26  11.754  11.060   9.653
  147    HE1  TYR  26           1HE      TYR  26  14.192  14.221   6.777
  148    HE2  TYR  26           2HE      TYR  26  13.728  12.239  10.527
  149    HH   TYR  26           HH       TYR  26  15.478  13.539  10.001
  150    H    VAL  27           H        VAL  27  13.323  10.715   6.286
  151    HA   VAL  27           HA       VAL  27  14.071   8.141   5.370
  152    HB   VAL  27           HB       VAL  27  16.227   8.582   6.532
  153   HG11  VAL  27          1HG1      VAL  27  15.906  11.139   5.217
  154   HG12  VAL  27          2HG1      VAL  27  16.852   9.731   4.730
  155   HG13  VAL  27          3HG1      VAL  27  15.143   9.837   4.305
  156   HG21  VAL  27          1HG2      VAL  27  14.827  10.087   8.255
  157   HG22  VAL  27          2HG2      VAL  27  16.560  10.279   7.993
  158   HG23  VAL  27          3HG2      VAL  27  15.421  11.350   7.177
  159    H    LEU  28           H        LEU  28  12.591   9.190   8.240
  160    HA   LEU  28           HA       LEU  28  13.244   6.632   9.549
  161    HB2  LEU  28           1HB      LEU  28  12.763   9.343  10.763
  162    HB3  LEU  28           2HB      LEU  28  12.745   7.851  11.701
  163    HG   LEU  28           HG       LEU  28  15.152   8.592  10.078
  164   HD11  LEU  28          1HD1      LEU  28  16.050   9.630  12.178
  165   HD12  LEU  28          2HD1      LEU  28  14.399   9.642  12.797
  166   HD13  LEU  28          3HD1      LEU  28  14.805  10.567  11.351
  167   HD21  LEU  28          1HD2      LEU  28  14.532   6.369  11.490
  168   HD22  LEU  28          2HD2      LEU  28  15.350   7.326  12.726
  169   HD23  LEU  28          3HD2      LEU  28  16.177   6.944  11.215
  170    H    GLU  29           H        GLU  29  10.939   7.968   7.827
  171    HA   GLU  29           HA       GLU  29   8.770   6.851   9.480
  172    HB2  GLU  29           1HB      GLU  29   8.662   9.215   7.601
  173    HB3  GLU  29           2HB      GLU  29   7.250   8.472   8.339
  174    HG2  GLU  29           1HG      GLU  29   8.578   8.938  10.560
  175    HG3  GLU  29           2HG      GLU  29   9.368  10.158   9.562
  176    H    ARG  30           H        ARG  30   9.896   7.487   6.180
  177    HA   ARG  30           HA       ARG  30   8.003   6.205   4.685
  178    HB2  ARG  30           1HB      ARG  30   9.581   6.040   2.967
  179    HB3  ARG  30           2HB      ARG  30  10.168   7.382   3.940
  180    HG2  ARG  30           1HG      ARG  30  11.825   5.977   4.972
  181    HG3  ARG  30           2HG      ARG  30  11.179   4.555   4.149
  182    HD2  ARG  30           1HD      ARG  30  13.046   5.168   2.878
  183    HD3  ARG  30           2HD      ARG  30  11.671   5.808   1.979
  184    HE   ARG  30           HE       ARG  30  12.826   7.697   3.808
  185   HH11  ARG  30          2HH1      ARG  30  13.012   6.332   0.610
  186   HH12  ARG  30          1HH1      ARG  30  13.803   7.714  -0.074
  187   HH21  ARG  30          2HH2      ARG  30  13.866   9.521   2.918
  188   HH22  ARG  30          1HH2      ARG  30  14.288   9.527   1.239
  189    H    LEU  31           H        LEU  31   7.584   4.113   4.017
  190    HA   LEU  31           HA       LEU  31   9.011   1.972   5.446
  191    HB2  LEU  31           1HB      LEU  31   6.651   2.620   6.289
  192    HB3  LEU  31           2HB      LEU  31   6.084   1.802   4.834
  193    HG   LEU  31           HG       LEU  31   7.606  -0.150   5.805
  194   HD11  LEU  31          1HD1      LEU  31   6.614   1.148   8.326
  195   HD12  LEU  31          2HD1      LEU  31   8.263   1.354   7.736
  196   HD13  LEU  31          3HD1      LEU  31   7.671  -0.253   8.154
  197   HD21  LEU  31          1HD2      LEU  31   5.086  -0.005   5.323
  198   HD22  LEU  31          2HD2      LEU  31   4.918   0.311   7.050
  199   HD23  LEU  31          3HD2      LEU  31   5.643  -1.199   6.495
  200    H    CYS  32           H        CYS  32  10.211   1.227   3.761
  201    HA   CYS  32           HA       CYS  32   9.241   0.950   1.110
  202    HB2  CYS  32           1HB      CYS  32  11.690   1.070   2.008
  203    HB3  CYS  32           2HB      CYS  32  11.526  -0.673   2.178
  204    HG   CYS  32           HG       CYS  32  11.965   1.168  -0.574
  205    H    VAL  33           H        VAL  33   7.780  -0.461   0.437
  206    HA   VAL  33           HA       VAL  33   7.839  -3.190   1.531
  207    HB   VAL  33           HB       VAL  33   5.298  -1.654   0.975
  208   HG11  VAL  33          1HG1      VAL  33   4.775  -3.853   2.596
  209   HG12  VAL  33          2HG1      VAL  33   4.389  -3.684   0.882
  210   HG13  VAL  33          3HG1      VAL  33   5.899  -4.452   1.376
  211   HG21  VAL  33          1HG2      VAL  33   6.936  -1.955   3.413
  212   HG22  VAL  33          2HG2      VAL  33   5.830  -0.665   2.940
  213   HG23  VAL  33          3HG2      VAL  33   5.196  -2.168   3.610
  214    H    ASN  34           H        ASN  34   8.741  -4.115  -0.262
  215    HA   ASN  34           HA       ASN  34   8.778  -5.116  -2.307
  216    HB2  ASN  34           1HB      ASN  34   5.931  -4.134  -2.604
  217    HB3  ASN  34           2HB      ASN  34   6.704  -5.419  -3.529
  218   HD21  ASN  34          1HD2      ASN  34   6.918  -7.431  -2.647
  219   HD22  ASN  34          2HD2      ASN  34   6.185  -7.894  -1.153
  220    H    GLY  35           H        GLY  35   9.614  -2.373  -1.945
  221    HA2  GLY  35           1HA      GLY  35  10.704  -1.077  -3.629
  222    HA3  GLY  35           2HA      GLY  35   9.430  -1.526  -4.753
  223    H    HIS  36           H        HIS  36   7.227  -0.943  -3.036
  224    HA   HIS  36           HA       HIS  36   7.082   1.897  -3.467
  225    HB2  HIS  36           1HB      HIS  36   5.076   0.038  -2.172
  226    HB3  HIS  36           2HB      HIS  36   4.762   1.684  -2.714
  227    HD1  HIS  36           1HD      HIS  36   5.422   1.936  -5.461
  228    HD2  HIS  36           2HD      HIS  36   4.240  -1.764  -3.988
  229    HE1  HIS  36           1HE      HIS  36   4.662   0.626  -7.468
  230    H    PHE  37           H        PHE  37   5.939   3.203  -1.632
  231    HA   PHE  37           HA       PHE  37   7.237   2.602   0.939
  232    HB2  PHE  37           1HB      PHE  37   7.168   5.254  -0.507
  233    HB3  PHE  37           2HB      PHE  37   7.613   5.083   1.188
  234    HD1  PHE  37           2HD      PHE  37   9.641   3.764   1.792
  235    HD2  PHE  37           1HD      PHE  37   8.701   4.787  -2.231
  236    HE1  PHE  37           2HE      PHE  37  11.966   3.303   1.135
  237    HE2  PHE  37           1HE      PHE  37  11.025   4.326  -2.895
  238    HZ   PHE  37           HZ       PHE  37  12.662   3.584  -1.210
  239    H    PHE  38           H        PHE  38   6.149   3.299   2.794
  240    HA   PHE  38           HA       PHE  38   3.548   4.576   2.473
  241    HB2  PHE  38           1HB      PHE  38   3.809   1.967   3.973
  242    HB3  PHE  38           2HB      PHE  38   2.332   2.865   3.638
  243    HD1  PHE  38           1HD      PHE  38   5.153   1.200   1.863
  244    HD2  PHE  38           2HD      PHE  38   1.024   2.232   1.854
  245    HE1  PHE  38           1HE      PHE  38   4.836  -0.103  -0.199
  246    HE2  PHE  38           2HE      PHE  38   0.699   0.929  -0.208
  247    HZ   PHE  38           HZ       PHE  38   2.606  -0.241  -1.237
  248    H    HIS  39           H        HIS  39   2.558   5.088   4.625
  249    HA   HIS  39           HA       HIS  39   4.581   6.231   6.329
  250    HB2  HIS  39           1HB      HIS  39   1.565   6.299   6.369
  251    HB3  HIS  39           2HB      HIS  39   2.546   7.057   7.620
  252    HD2  HIS  39           2HD      HIS  39   4.747   8.553   5.734
  253    HE1  HIS  39           1HE      HIS  39   1.367  10.298   3.855
  254    HE2  HIS  39           2HE      HIS  39   3.866  10.400   4.152
  255    H    ARG  40           H        ARG  40   5.453   5.278   8.037
  256    HA   ARG  40           HA       ARG  40   5.152   2.756   8.908
  257    HB2  ARG  40           1HB      ARG  40   5.936   5.263  10.308
  258    HB3  ARG  40           2HB      ARG  40   5.663   3.833  11.294
  259    HG2  ARG  40           1HG      ARG  40   7.410   3.587   8.902
  260    HG3  ARG  40           2HG      ARG  40   8.040   4.405  10.333
  261    HD2  ARG  40           1HD      ARG  40   6.693   1.751  10.601
  262    HD3  ARG  40           2HD      ARG  40   8.365   1.835  10.047
  263    HE   ARG  40           HE       ARG  40   7.385   2.350  12.709
  264   HH11  ARG  40          2HH1      ARG  40   9.975   2.853  10.437
  265   HH12  ARG  40          1HH1      ARG  40  11.166   3.147  11.661
  266   HH21  ARG  40          2HH2      ARG  40   8.944   2.736  14.329
  267   HH22  ARG  40          1HH2      ARG  40  10.579   3.079  13.874
  268    H    SER  41           H        SER  41   2.938   5.359   9.488
  269    HA   SER  41           HA       SER  41   1.461   3.886  11.512
  270    HB2  SER  41           1HB      SER  41   1.000   6.584  10.224
  271    HB3  SER  41           2HB      SER  41  -0.059   5.887  11.450
  272    HG   SER  41           HG       SER  41   1.288   6.613  12.873
  273    H    CYS  42           H        CYS  42   0.721   5.302   8.321
  274    HA   CYS  42           HA       CYS  42  -1.793   4.303   7.923
  275    HB2  CYS  42           1HB      CYS  42   0.458   4.687   5.950
  276    HB3  CYS  42           2HB      CYS  42  -1.175   4.254   5.456
  277    H    PHE  43           H        PHE  43   1.270   2.654   7.197
  278    HA   PHE  43           HA       PHE  43   0.210   0.312   6.122
  279    HB2  PHE  43           1HB      PHE  43   2.649   1.058   6.191
  280    HB3  PHE  43           2HB      PHE  43   2.699   0.402   7.824
  281    HD1  PHE  43           2HD      PHE  43   1.993  -0.510   4.299
  282    HD2  PHE  43           1HD      PHE  43   3.094  -1.863   8.181
  283    HE1  PHE  43           2HE      PHE  43   2.469  -2.743   3.382
  284    HE2  PHE  43           1HE      PHE  43   3.574  -4.098   7.271
  285    HZ   PHE  43           HZ       PHE  43   3.260  -4.540   4.868
  286    H    ARG  44           H        ARG  44  -1.430  -0.712   7.120
  287    HA   ARG  44           HA       ARG  44  -0.862  -1.968   9.685
  288    HB2  ARG  44           1HB      ARG  44  -3.442  -0.457   9.262
  289    HB3  ARG  44           2HB      ARG  44  -2.901  -1.257  10.732
  290    HG2  ARG  44           1HG      ARG  44  -1.167   0.367  11.050
  291    HG3  ARG  44           2HG      ARG  44  -1.517   1.107   9.487
  292    HD2  ARG  44           1HD      ARG  44  -3.607   1.923  10.235
  293    HD3  ARG  44           2HD      ARG  44  -3.560   0.919  11.685
  294    HE   ARG  44           HE       ARG  44  -1.416   2.838  11.488
  295   HH11  ARG  44          2HH1      ARG  44  -4.660   2.232  12.597
  296   HH12  ARG  44          1HH1      ARG  44  -4.622   3.480  13.797
  297   HH21  ARG  44          2HH2      ARG  44  -1.354   4.485  13.065
  298   HH22  ARG  44          1HH2      ARG  44  -2.742   4.762  14.062
  299    H    CYS  45           H        CYS  45  -2.850  -3.434  10.267
  300    HA   CYS  45           HA       CYS  45  -3.059  -5.396   8.301
  301    HB2  CYS  45           1HB      CYS  45  -3.450  -5.703  10.764
  302    HB3  CYS  45           2HB      CYS  45  -5.024  -4.942  10.553
  303    H    HIS  46           H        HIS  46  -5.123  -6.221   7.344
  304    HA   HIS  46           HA       HIS  46  -6.609  -3.968   6.185
  305    HB2  HIS  46           1HB      HIS  46  -5.520  -5.298   4.510
  306    HB3  HIS  46           2HB      HIS  46  -6.150  -6.789   5.204
  307    HD1  HIS  46           1HD      HIS  46  -6.961  -4.099   2.828
  308    HD2  HIS  46           2HD      HIS  46  -8.960  -7.191   4.752
  309    HE1  HIS  46           1HE      HIS  46  -9.134  -4.367   1.591
  310    H    THR  47           H        THR  47  -6.939  -6.107   8.620
  311    HA   THR  47           HA       THR  47  -9.862  -6.283   8.273
  312    HB   THR  47           HB       THR  47  -7.960  -8.250   9.530
  313    HG1  THR  47           1HG      THR  47  -8.415  -8.605   7.352
  314   HG21  THR  47          1HG2      THR  47  -9.815  -7.861  11.102
  315   HG22  THR  47          2HG2      THR  47  -9.882  -9.474  10.392
  316   HG23  THR  47          3HG2      THR  47 -10.966  -8.210   9.813
  317    H    CYS  48           H        CYS  48  -7.192  -5.699  10.481
  318    HA   CYS  48           HA       CYS  48  -9.112  -4.553  12.401
  319    HB2  CYS  48           1HB      CYS  48  -7.440  -5.084  14.174
  320    HB3  CYS  48           2HB      CYS  48  -8.102  -6.513  13.386
  321    H    GLU  49           H        GLU  49  -6.758  -3.844  10.200
  322    HA   GLU  49           HA       GLU  49  -5.386  -2.066   9.801
  323    HB2  GLU  49           1HB      GLU  49  -7.487  -0.704  11.494
  324    HB3  GLU  49           2HB      GLU  49  -6.294   0.136  10.514
  325    HG2  GLU  49           1HG      GLU  49  -7.220  -0.807   8.499
  326    HG3  GLU  49           2HG      GLU  49  -8.356  -1.773   9.440
  327    H    ALA  50           H        ALA  50  -4.275  -3.606  11.690
  328    HA   ALA  50           HA       ALA  50  -3.467  -1.843  13.890
  329    HB1  ALA  50           1HB      ALA  50  -2.272  -4.088  14.576
  330    HB2  ALA  50           2HB      ALA  50  -3.993  -3.838  14.875
  331    HB3  ALA  50           3HB      ALA  50  -3.468  -4.790  13.486
  332    H    THR  51           H        THR  51  -1.415  -1.114  14.137
  333    HA   THR  51           HA       THR  51   0.249  -0.666  12.021
  334    HB   THR  51           HB       THR  51   1.260  -1.087  14.837
  335    HG1  THR  51           1HG      THR  51   0.313   0.743  15.367
  336   HG21  THR  51          1HG2      THR  51   2.801   0.801  14.110
  337   HG22  THR  51          2HG2      THR  51   2.249   0.482  12.465
  338   HG23  THR  51          3HG2      THR  51   3.090  -0.775  13.373
  339    H    LEU  52           H        LEU  52   0.783  -2.297  10.658
  340    HA   LEU  52           HA       LEU  52   1.614  -4.878  11.546
  341    HB2  LEU  52           1HB      LEU  52   1.850  -3.544   8.854
  342    HB3  LEU  52           2HB      LEU  52   2.194  -5.243   9.169
  343    HG   LEU  52           HG       LEU  52  -0.498  -3.910   9.460
  344   HD11  LEU  52          1HD1      LEU  52  -1.134  -4.955   7.460
  345   HD12  LEU  52          2HD1      LEU  52   0.304  -5.975   7.433
  346   HD13  LEU  52          3HD1      LEU  52   0.444  -4.245   7.118
  347   HD21  LEU  52          1HD2      LEU  52  -1.367  -6.105   9.877
  348   HD22  LEU  52          2HD2      LEU  52  -0.071  -5.790  11.030
  349   HD23  LEU  52          3HD2      LEU  52   0.223  -6.831   9.637
  350    H    TRP  53           H        TRP  53   3.403  -4.808  12.829
  351    HA   TRP  53           HA       TRP  53   5.677  -3.199  12.327
  352    HB2  TRP  53           1HB      TRP  53   5.863  -5.752  13.883
  353    HB3  TRP  53           2HB      TRP  53   6.624  -4.195  14.199
  354    HD1  TRP  53           HD       TRP  53   3.271  -6.021  14.623
  355    HE1  TRP  53           1HE      TRP  53   1.896  -4.790  16.417
  356    HE3  TRP  53           3HE      TRP  53   6.308  -1.971  15.336
  357    HZ2  TRP  53           2HZ      TRP  53   2.075  -2.416  17.934
  358    HZ3  TRP  53           3HZ      TRP  53   5.633  -0.266  16.976
  359    HH2  TRP  53           HH       TRP  53   3.560  -0.485  18.247
  360    HA   PRO  54           HA       PRO  54   7.940  -5.472   9.331
  361    HB2  PRO  54           1HB      PRO  54  10.494  -5.030  10.137
  362    HB3  PRO  54           2HB      PRO  54   9.493  -3.780   9.388
  363    HG2  PRO  54           1HG      PRO  54  10.088  -4.248  12.285
  364    HG3  PRO  54           2HG      PRO  54  10.039  -2.721  11.385
  365    HD2  PRO  54           1HD      PRO  54   7.995  -3.555  12.953
  366    HD3  PRO  54           2HD      PRO  54   7.740  -2.591  11.483
  367    H    GLY  55           H        GLY  55   7.338  -6.699  12.206
  368    HA2  GLY  55           1HA      GLY  55   8.801  -9.157  11.638
  369    HA3  GLY  55           2HA      GLY  55   9.119  -8.402  13.192
  370    H    GLY  56           H        GLY  56   5.978  -8.325  11.642
  371    HA2  GLY  56           1HA      GLY  56   4.943 -10.583  13.085
  372    HA3  GLY  56           2HA      GLY  56   4.482  -9.051  13.810
  373    H    TYR  57           H        TYR  57   4.842  -9.925  10.389
  374    HA   TYR  57           HA       TYR  57   1.994  -9.961   9.964
  375    HB2  TYR  57           1HB      TYR  57   1.702  -7.983   8.815
  376    HB3  TYR  57           2HB      TYR  57   2.877  -7.479  10.025
  377    HD1  TYR  57           2HD      TYR  57   5.357  -7.516   9.336
  378    HD2  TYR  57           1HD      TYR  57   2.151  -7.682   6.545
  379    HE1  TYR  57           2HE      TYR  57   6.877  -6.765   7.554
  380    HE2  TYR  57           1HE      TYR  57   3.662  -6.933   4.755
  381    HH   TYR  57           HH       TYR  57   6.042  -5.461   4.852
  382    H    GLU  58           H        GLU  58   1.488 -10.229   7.591
  383    HA   GLU  58           HA       GLU  58   3.655 -11.180   5.928
  384    HB2  GLU  58           1HB      GLU  58   1.661 -13.019   7.198
  385    HB3  GLU  58           2HB      GLU  58   2.277 -13.384   5.593
  386    HG2  GLU  58           1HG      GLU  58   4.601 -12.985   6.772
  387    HG3  GLU  58           2HG      GLU  58   3.672 -13.401   8.211
  388    H    GLN  59           H        GLN  59   3.066 -11.447   3.742
  389    HA   GLN  59           HA       GLN  59   0.550 -10.105   3.053
  390    HB2  GLN  59           1HB      GLN  59   2.358  -8.961   2.073
  391    HB3  GLN  59           2HB      GLN  59   3.161 -10.453   1.603
  392    HG2  GLN  59           1HG      GLN  59   1.573 -10.852  -0.126
  393    HG3  GLN  59           2HG      GLN  59   0.552  -9.528   0.432
  394   HE21  GLN  59          1HE2      GLN  59   1.075  -9.361  -2.089
  395   HE22  GLN  59          2HE2      GLN  59   2.310  -8.209  -2.452
  396    H    HIS  60           H        HIS  60  -1.053 -11.516   2.748
  397    HA   HIS  60           HA       HIS  60  -0.719 -14.207   1.972
  398    HB2  HIS  60           1HB      HIS  60  -2.720 -13.032   3.155
  399    HB3  HIS  60           2HB      HIS  60  -3.278 -12.704   1.517
  400    HD1  HIS  60           1HD      HIS  60  -4.322 -14.619   0.230
  401    HD2  HIS  60           2HD      HIS  60  -2.669 -15.801   3.854
  402    HE1  HIS  60           1HE      HIS  60  -5.096 -16.986   0.582
  403    HA   PRO  61           HA       PRO  61  -0.051 -13.575  -2.376
  404    HB2  PRO  61           1HB      PRO  61  -0.061 -16.202  -3.060
  405    HB3  PRO  61           2HB      PRO  61   1.314 -15.421  -2.271
  406    HG2  PRO  61           1HG      PRO  61  -0.847 -17.113  -1.074
  407    HG3  PRO  61           2HG      PRO  61   0.898 -17.136  -0.756
  408    HD2  PRO  61           1HD      PRO  61  -0.867 -15.911   0.892
  409    HD3  PRO  61           2HD      PRO  61   0.791 -15.320   0.660
  410    H    GLY  62           H        GLY  62  -2.595 -15.695  -1.110
  411    HA2  GLY  62           1HA      GLY  62  -4.123 -16.312  -3.234
  412    HA3  GLY  62           2HA      GLY  62  -4.831 -15.766  -1.721
  413    H    ASP  63           H        ASP  63  -4.806 -13.289  -1.477
  414    HA   ASP  63           HA       ASP  63  -6.028 -12.208  -3.892
  415    HB2  ASP  63           1HB      ASP  63  -6.486 -10.251  -2.205
  416    HB3  ASP  63           2HB      ASP  63  -7.416 -11.743  -2.099
  417    H    GLY  64           H        GLY  64  -3.444 -11.396  -1.594
  418    HA2  GLY  64           1HA      GLY  64  -1.345 -10.540  -2.450
  419    HA3  GLY  64           2HA      GLY  64  -2.257  -9.704  -3.699
  420    H    HIS  65           H        HIS  65  -2.909  -9.838  -0.221
  421    HA   HIS  65           HA       HIS  65  -2.419  -6.934  -0.105
  422    HB2  HIS  65           1HB      HIS  65  -4.651  -8.539   1.143
  423    HB3  HIS  65           2HB      HIS  65  -4.252  -6.901   1.653
  424    HD1  HIS  65           1HD      HIS  65  -4.369  -5.074  -0.393
  425    HD2  HIS  65           2HD      HIS  65  -6.429  -8.646  -0.898
  426    HE1  HIS  65           1HE      HIS  65  -6.034  -4.636  -2.226
  427    H    PHE  66           H        PHE  66  -2.587  -6.392   2.486
  428    HA   PHE  66           HA       PHE  66  -0.560  -8.137   3.723
  429    HB2  PHE  66           1HB      PHE  66  -0.963  -5.153   3.911
  430    HB3  PHE  66           2HB      PHE  66   0.066  -6.044   5.027
  431    HD1  PHE  66           1HD      PHE  66   1.885  -7.554   3.904
  432    HD2  PHE  66           2HD      PHE  66  -0.039  -4.269   2.000
  433    HE1  PHE  66           1HE      PHE  66   3.757  -7.381   2.317
  434    HE2  PHE  66           2HE      PHE  66   1.830  -4.092   0.410
  435    HZ   PHE  66           HZ       PHE  66   3.731  -5.650   0.567
  436    H    TYR  67           H        TYR  67  -1.120  -9.146   5.532
  437    HA   TYR  67           HA       TYR  67  -3.218  -7.984   7.226
  438    HB2  TYR  67           1HB      TYR  67  -3.087 -10.923   6.536
  439    HB3  TYR  67           2HB      TYR  67  -4.330 -10.103   7.474
  440    HD1  TYR  67           1HD      TYR  67  -6.031  -8.751   6.377
  441    HD2  TYR  67           2HD      TYR  67  -3.039 -10.761   4.115
  442    HE1  TYR  67           1HE      TYR  67  -7.344  -8.389   4.329
  443    HE2  TYR  67           2HE      TYR  67  -4.344 -10.404   2.061
  444    HH   TYR  67           HH       TYR  67  -6.326  -9.750   1.229
  445    H    CYS  68           H        CYS  68  -3.243  -8.873   9.422
  446    HA   CYS  68           HA       CYS  68  -0.584  -9.082  10.463
  447    HB2  CYS  68           1HB      CYS  68  -1.645  -9.123  12.648
  448    HB3  CYS  68           2HB      CYS  68  -2.396  -7.882  11.650
  449    H    LEU  69           H        LEU  69  -0.184 -10.802  12.234
  450    HA   LEU  69           HA       LEU  69  -0.343 -13.370  10.939
  451    HB2  LEU  69           1HB      LEU  69   0.747 -12.772  13.678
  452    HB3  LEU  69           2HB      LEU  69   1.125 -14.148  12.643
  453    HG   LEU  69           HG       LEU  69   1.963 -11.281  12.228
  454   HD11  LEU  69          1HD1      LEU  69   3.308 -12.307  13.892
  455   HD12  LEU  69          2HD1      LEU  69   4.240 -12.325  12.395
  456   HD13  LEU  69          3HD1      LEU  69   3.446 -13.796  12.957
  457   HD21  LEU  69          1HD2      LEU  69   3.006 -11.930  10.211
  458   HD22  LEU  69          2HD2      LEU  69   1.357 -12.553  10.126
  459   HD23  LEU  69          3HD2      LEU  69   2.693 -13.640  10.511
  460    H    GLN  70           H        GLN  70  -2.694 -11.873  12.329
  461    HA   GLN  70           HA       GLN  70  -3.667 -14.235  13.795
  462    HB2  GLN  70           1HB      GLN  70  -3.275 -12.498  15.412
  463    HB3  GLN  70           2HB      GLN  70  -4.125 -11.318  14.423
  464    HG2  GLN  70           1HG      GLN  70  -6.220 -12.365  14.832
  465    HG3  GLN  70           2HG      GLN  70  -5.443 -13.749  15.599
  466   HE21  GLN  70          1HE2      GLN  70  -6.853 -13.317  17.391
  467   HE22  GLN  70          2HE2      GLN  70  -6.435 -12.098  18.542
  468    H    HIS  71           H        HIS  71  -4.082 -12.171  11.188
  469    HA   HIS  71           HA       HIS  71  -6.866 -13.071  10.849
  470    HB2  HIS  71           1HB      HIS  71  -5.633 -10.389  10.299
  471    HB3  HIS  71           2HB      HIS  71  -7.044 -10.923   9.389
  472    HD2  HIS  71           2HD      HIS  71  -7.881 -12.310  12.637
  473    HE1  HIS  71           1HE      HIS  71  -9.014  -8.239  13.008
  474    HE2  HIS  71           2HE      HIS  71  -9.145 -10.536  14.032
  475    H    LEU  72           H        LEU  72  -3.704 -12.831   9.564
  476    HA   LEU  72           HA       LEU  72  -4.031 -12.913   6.841
  477    HB2  LEU  72           1HB      LEU  72  -1.867 -12.895   8.039
  478    HB3  LEU  72           2HB      LEU  72  -2.103 -14.596   8.434
  479    HG   LEU  72           HG       LEU  72  -2.269 -14.805   5.796
  480   HD11  LEU  72          1HD1      LEU  72  -0.891 -13.280   4.618
  481   HD12  LEU  72          2HD1      LEU  72  -0.370 -12.493   6.107
  482   HD13  LEU  72          3HD1      LEU  72  -2.034 -12.314   5.551
  483   HD21  LEU  72          1HD2      LEU  72  -0.665 -16.122   6.750
  484   HD22  LEU  72          2HD2      LEU  72   0.055 -14.787   7.651
  485   HD23  LEU  72          3HD2      LEU  72   0.363 -14.952   5.922
  486    HA   PRO  73           HA       PRO  73  -6.554 -16.581   6.414
  487    HB2  PRO  73           1HB      PRO  73  -6.880 -16.348   3.729
  488    HB3  PRO  73           2HB      PRO  73  -7.790 -15.379   4.895
  489    HG2  PRO  73           1HG      PRO  73  -5.362 -14.644   3.305
  490    HG3  PRO  73           2HG      PRO  73  -6.819 -13.686   3.631
  491    HD2  PRO  73           1HD      PRO  73  -4.506 -13.328   4.993
  492    HD3  PRO  73           2HD      PRO  73  -6.100 -13.074   5.733
  493    H    GLN  74           H        GLN  74  -6.503 -18.295   4.427
  494    HA   GLN  74           HA       GLN  74  -3.786 -18.916   3.622
  495    HB2  GLN  74           1HB      GLN  74  -5.251 -20.390   5.742
  496    HB3  GLN  74           2HB      GLN  74  -4.367 -21.356   4.568
  497    HG2  GLN  74           1HG      GLN  74  -3.291 -19.297   6.465
  498    HG3  GLN  74           2HG      GLN  74  -2.908 -21.015   6.379
  499   HE21  GLN  74          1HE2      GLN  74  -1.172 -18.646   6.270
  500   HE22  GLN  74          2HE2      GLN  74  -0.283 -18.787   4.796
  501    H    THR  75           H        THR  75  -4.033 -19.276   1.523
  502    HA   THR  75           HA       THR  75  -6.295 -19.792   0.103
  503    HB   THR  75           HB       THR  75  -4.124 -19.290  -0.946
  504    HG1  THR  75           1HG      THR  75  -5.938 -20.433  -2.065
  505   HG21  THR  75          1HG2      THR  75  -3.404 -22.193  -0.694
  506   HG22  THR  75          2HG2      THR  75  -2.915 -21.026   0.535
  507   HG23  THR  75          3HG2      THR  75  -2.377 -20.829  -1.133
  508    H    ASP  76           H        ASP  76  -6.931 -21.792  -1.095
  509    HA   ASP  76           HA       ASP  76  -6.276 -24.357  -0.071
  510    HB2  ASP  76           1HB      ASP  76  -7.746 -23.281   1.761
  511    HB3  ASP  76           2HB      ASP  76  -9.075 -23.505   0.628
  512    H    SER  77           H        SER  77  -6.572 -25.710  -1.707
  513    HA   SER  77           HA       SER  77  -7.243 -26.552  -3.715
  514    HB2  SER  77           1HB      SER  77  -9.287 -26.933  -2.268
  515    HB3  SER  77           2HB      SER  77  -9.971 -25.474  -2.985
  516    HG   SER  77           HG       SER  77  -9.116 -26.941  -4.983
  517    H    GLY  78           H        GLY  78  -6.087 -24.037  -3.905
  518    HA2  GLY  78           1HA      GLY  78  -7.395 -23.064  -6.334
  519    HA3  GLY  78           2HA      GLY  78  -7.127 -21.902  -5.043
  520    HA   PRO  79           HA       PRO  79  -2.831 -23.329  -6.841
  521    HB2  PRO  79           1HB      PRO  79  -2.953 -24.222  -9.402
  522    HB3  PRO  79           2HB      PRO  79  -3.061 -25.297  -8.004
  523    HG2  PRO  79           1HG      PRO  79  -5.253 -24.185  -9.712
  524    HG3  PRO  79           2HG      PRO  79  -5.052 -25.830  -9.080
  525    HD2  PRO  79           1HD      PRO  79  -6.718 -24.025  -7.940
  526    HD3  PRO  79           2HD      PRO  79  -5.865 -25.264  -6.998
  527    H    SER  80           H        SER  80  -1.978 -21.370  -7.138
  528    HA   SER  80           HA       SER  80  -3.144 -19.308  -8.653
  529    HB2  SER  80           1HB      SER  80  -0.258 -19.592  -7.779
  530    HB3  SER  80           2HB      SER  80  -1.042 -18.097  -8.290
  531    HG   SER  80           HG       SER  80  -1.484 -17.916  -6.242
  532    H    SER  81           H        SER  81  -2.863 -18.611 -10.710
  533    HA   SER  81           HA       SER  81  -2.308 -20.276 -12.776
  534    HB2  SER  81           1HB      SER  81  -2.115 -17.297 -12.515
  535    HB3  SER  81           2HB      SER  81  -1.605 -18.067 -14.017
  536    HG   SER  81           HG       SER  81  -3.619 -18.459 -14.492
  537    H    GLY  82           H        GLY  82   0.034 -18.072 -11.248
  538    HA2  GLY  82           1HA      GLY  82   2.223 -19.629 -11.128
  539    HA3  GLY  82           2HA      GLY  82   2.208 -19.166 -12.823
  Start of MODEL    6
    1    H1   GLY   1           H        GLY   1 -20.793  25.353 -36.747
    2    HA2  GLY   1           1HA      GLY   1 -18.533  24.868 -38.533
    3    HA3  GLY   1           2HA      GLY   1 -18.540  25.920 -37.125
    4    H    SER   2           H        SER   2 -16.478  24.883 -36.645
    5    HA   SER   2           HA       SER   2 -16.765  22.851 -34.691
    6    HB2  SER   2           1HB      SER   2 -16.916  21.493 -36.809
    7    HB3  SER   2           2HB      SER   2 -15.264  21.992 -37.173
    8    HG   SER   2           HG       SER   2 -15.143  20.048 -36.118
    9    H    SER   3           H        SER   3 -14.646  22.208 -33.759
   10    HA   SER   3           HA       SER   3 -12.298  23.675 -34.483
   11    HB2  SER   3           1HB      SER   3 -12.160  24.912 -32.282
   12    HB3  SER   3           2HB      SER   3 -13.379  25.521 -33.402
   13    HG   SER   3           HG       SER   3 -14.436  25.351 -31.508
   14    H    GLY   4           H        GLY   4 -10.614  23.446 -32.596
   15    HA2  GLY   4           1HA      GLY   4 -11.013  20.927 -31.147
   16    HA3  GLY   4           2HA      GLY   4  -9.661  21.038 -32.264
   17    H    SER   5           H        SER   5  -8.530  20.497 -30.179
   18    HA   SER   5           HA       SER   5  -7.274  22.851 -29.177
   19    HB2  SER   5           1HB      SER   5  -7.957  22.812 -26.904
   20    HB3  SER   5           2HB      SER   5  -9.448  22.709 -27.841
   21    HG   SER   5           HG       SER   5  -8.800  21.112 -25.966
   22    H    SER   6           H        SER   6  -5.490  22.366 -27.728
   23    HA   SER   6           HA       SER   6  -4.681  19.535 -27.791
   24    HB2  SER   6           1HB      SER   6  -2.937  21.944 -28.358
   25    HB3  SER   6           2HB      SER   6  -2.349  20.289 -28.201
   26    HG   SER   6           HG       SER   6  -2.909  21.221 -30.401
   27    H    GLY   7           H        GLY   7  -3.253  18.860 -26.109
   28    HA2  GLY   7           1HA      GLY   7  -3.110  20.712 -23.816
   29    HA3  GLY   7           2HA      GLY   7  -3.692  19.067 -23.609
   30    H    GLN   8           H        GLN   8  -1.290  20.633 -22.590
   31    HA   GLN   8           HA       GLN   8   0.591  18.450 -22.888
   32    HB2  GLN   8           1HB      GLN   8   1.179  21.245 -23.844
   33    HB3  GLN   8           2HB      GLN   8   2.456  20.122 -23.397
   34    HG2  GLN   8           1HG      GLN   8   1.420  18.522 -25.078
   35    HG3  GLN   8           2HG      GLN   8   0.490  19.907 -25.649
   36   HE21  GLN   8          1HE2      GLN   8   3.853  19.224 -24.728
   37   HE22  GLN   8          2HE2      GLN   8   4.563  19.980 -26.109
   38    H    HIS   9           H        HIS   9   0.932  17.978 -20.818
   39    HA   HIS   9           HA       HIS   9   1.710  20.163 -19.010
   40    HB2  HIS   9           1HB      HIS   9  -0.697  19.115 -18.731
   41    HB3  HIS   9           2HB      HIS   9   0.192  17.827 -17.922
   42    HD1  HIS   9           1HD      HIS   9  -0.367  18.233 -15.526
   43    HD2  HIS   9           2HD      HIS   9   0.844  21.699 -17.470
   44    HE1  HIS   9           1HE      HIS   9  -0.181  19.981 -13.728
   45    H    GLN  10           H        GLN  10   3.884  19.525 -19.493
   46    HA   GLN  10           HA       GLN  10   4.708  16.877 -18.582
   47    HB2  GLN  10           1HB      GLN  10   5.521  18.126 -20.739
   48    HB3  GLN  10           2HB      GLN  10   6.609  18.942 -19.624
   49    HG2  GLN  10           1HG      GLN  10   7.361  16.658 -18.873
   50    HG3  GLN  10           2HG      GLN  10   6.458  16.008 -20.241
   51   HE21  GLN  10          1HE2      GLN  10   9.024  18.267 -19.373
   52   HE22  GLN  10          2HE2      GLN  10   9.910  18.107 -20.847
   53    H    GLU  11           H        GLU  11   5.857  16.498 -16.765
   54    HA   GLU  11           HA       GLU  11   7.385  18.416 -15.376
   55    HB2  GLU  11           1HB      GLU  11   6.029  18.932 -13.497
   56    HB3  GLU  11           2HB      GLU  11   5.047  19.258 -14.918
   57    HG2  GLU  11           1HG      GLU  11   3.849  17.190 -14.623
   58    HG3  GLU  11           2HG      GLU  11   4.896  16.741 -13.277
   59    H    ALA  12           H        ALA  12   8.706  17.433 -13.934
   60    HA   ALA  12           HA       ALA  12   8.940  14.652 -13.902
   61    HB1  ALA  12           1HB      ALA  12  10.656  14.938 -12.270
   62    HB2  ALA  12           2HB      ALA  12  10.752  16.297 -13.391
   63    HB3  ALA  12           3HB      ALA  12  10.024  16.517 -11.800
   64    H    GLY  13           H        GLY  13   8.517  13.089 -12.317
   65    HA2  GLY  13           1HA      GLY  13   6.518  13.897 -10.295
   66    HA3  GLY  13           2HA      GLY  13   6.371  12.414 -11.225
   67    H    ALA  14           H        ALA  14   7.125  13.529  -8.277
   68    HA   ALA  14           HA       ALA  14   9.409  11.837  -7.726
   69    HB1  ALA  14           1HB      ALA  14   8.997  14.086  -6.647
   70    HB2  ALA  14           2HB      ALA  14   7.731  13.299  -5.704
   71    HB3  ALA  14           3HB      ALA  14   9.404  12.764  -5.554
   72    H    GLY  15           H        GLY  15   9.321   9.787  -7.071
   73    HA2  GLY  15           1HA      GLY  15   6.691   8.660  -6.409
   74    HA3  GLY  15           2HA      GLY  15   8.096   7.746  -6.938
   75    H    ASP  16           H        ASP  16   7.674  10.136  -4.336
   76    HA   ASP  16           HA       ASP  16   8.479   8.049  -2.420
   77    HB2  ASP  16           1HB      ASP  16   9.242  10.930  -2.041
   78    HB3  ASP  16           2HB      ASP  16   9.958   9.491  -1.319
   79    H    LEU  17           H        LEU  17   5.836   8.528  -2.914
   80    HA   LEU  17           HA       LEU  17   4.993   9.934  -0.468
   81    HB2  LEU  17           1HB      LEU  17   3.188   9.776  -2.836
   82    HB3  LEU  17           2HB      LEU  17   3.208  10.945  -1.517
   83    HG   LEU  17           HG       LEU  17   5.265  10.833  -3.720
   84   HD11  LEU  17          1HD1      LEU  17   3.850  13.149  -4.050
   85   HD12  LEU  17          2HD1      LEU  17   2.588  11.993  -3.626
   86   HD13  LEU  17          3HD1      LEU  17   3.644  11.679  -5.003
   87   HD21  LEU  17          1HD2      LEU  17   5.778  13.123  -2.893
   88   HD22  LEU  17          2HD2      LEU  17   6.143  11.846  -1.732
   89   HD23  LEU  17          3HD2      LEU  17   4.691  12.829  -1.535
   90    H    CYS  18           H        CYS  18   3.593   8.876   0.833
   91    HA   CYS  18           HA       CYS  18   3.339   6.176   0.886
   92    HB2  CYS  18           1HB      CYS  18   2.647   7.653   2.729
   93    HB3  CYS  18           2HB      CYS  18   1.235   8.148   1.801
   94    H    ALA  19           H        ALA  19   1.695   4.666   0.346
   95    HA   ALA  19           HA       ALA  19   0.322   5.344  -2.149
   96    HB1  ALA  19           1HB      ALA  19  -0.019   2.617  -1.628
   97    HB2  ALA  19           2HB      ALA  19   1.097   3.359  -2.775
   98    HB3  ALA  19           3HB      ALA  19   1.632   2.994  -1.135
   99    H    LEU  20           H        LEU  20  -0.287   4.485   1.160
  100    HA   LEU  20           HA       LEU  20  -2.951   3.611   0.925
  101    HB2  LEU  20           1HB      LEU  20  -1.209   4.608   3.096
  102    HB3  LEU  20           2HB      LEU  20  -2.947   4.703   3.376
  103    HG   LEU  20           HG       LEU  20  -1.829   2.663   4.298
  104   HD11  LEU  20          1HD1      LEU  20  -3.559   1.103   3.453
  105   HD12  LEU  20          2HD1      LEU  20  -3.995   2.301   2.235
  106   HD13  LEU  20          3HD1      LEU  20  -4.205   2.668   3.947
  107   HD21  LEU  20          1HD2      LEU  20  -1.231   2.297   1.405
  108   HD22  LEU  20          2HD2      LEU  20  -1.573   0.873   2.388
  109   HD23  LEU  20          3HD2      LEU  20  -0.237   1.943   2.818
  110    H    CYS  21           H        CYS  21  -1.667   6.820   1.802
  111    HA   CYS  21           HA       CYS  21  -4.299   7.967   1.172
  112    HB2  CYS  21           1HB      CYS  21  -3.410   9.984   2.408
  113    HB3  CYS  21           2HB      CYS  21  -3.634   8.539   3.390
  114    H    GLY  22           H        GLY  22  -0.824   8.672   0.776
  115    HA2  GLY  22           1HA      GLY  22  -0.022   9.105  -1.501
  116    HA3  GLY  22           2HA      GLY  22  -1.512   9.997  -1.774
  117    H    GLU  23           H        GLU  23   0.421  10.207   1.153
  118    HA   GLU  23           HA       GLU  23   0.881  13.044   0.549
  119    HB2  GLU  23           1HB      GLU  23   1.187  11.687   3.227
  120    HB3  GLU  23           2HB      GLU  23   1.083  13.412   2.901
  121    HG2  GLU  23           1HG      GLU  23  -1.167  11.533   2.271
  122    HG3  GLU  23           2HG      GLU  23  -0.975  12.276   3.858
  123    H    HIS  24           H        HIS  24   2.950  13.900   1.688
  124    HA   HIS  24           HA       HIS  24   5.168  12.690   0.416
  125    HB2  HIS  24           1HB      HIS  24   4.733  15.172   1.234
  126    HB3  HIS  24           2HB      HIS  24   5.567  14.601   2.677
  127    HD1  HIS  24           1HD      HIS  24   7.917  15.332   2.566
  128    HD2  HIS  24           2HD      HIS  24   6.497  14.162  -1.159
  129    HE1  HIS  24           1HE      HIS  24   9.873  15.552   1.002
  130    H    LEU  25           H        LEU  25   6.901  11.545   1.243
  131    HA   LEU  25           HA       LEU  25   6.443  10.330   3.885
  132    HB2  LEU  25           1HB      LEU  25   7.907   9.269   1.475
  133    HB3  LEU  25           2HB      LEU  25   7.855   8.466   3.043
  134    HG   LEU  25           HG       LEU  25   5.318   9.090   1.578
  135   HD11  LEU  25          1HD1      LEU  25   5.450   6.813   0.597
  136   HD12  LEU  25          2HD1      LEU  25   7.136   6.734   1.106
  137   HD13  LEU  25          3HD1      LEU  25   6.627   7.944  -0.072
  138   HD21  LEU  25          1HD2      LEU  25   5.000   8.365   3.809
  139   HD22  LEU  25          2HD2      LEU  25   6.192   7.076   3.637
  140   HD23  LEU  25          3HD2      LEU  25   4.652   6.975   2.781
  141    H    TYR  26           H        TYR  26   8.335   9.799   5.163
  142    HA   TYR  26           HA       TYR  26  10.641  11.542   4.599
  143    HB2  TYR  26           1HB      TYR  26   9.251  12.515   6.381
  144    HB3  TYR  26           2HB      TYR  26   9.386  11.022   7.303
  145    HD1  TYR  26           1HD      TYR  26  11.534  13.649   5.744
  146    HD2  TYR  26           2HD      TYR  26  11.047  10.845   8.907
  147    HE1  TYR  26           1HE      TYR  26  13.585  14.497   6.803
  148    HE2  TYR  26           2HE      TYR  26  13.095  11.687   9.976
  149    HH   TYR  26           HH       TYR  26  15.055  14.221   8.452
  150    H    VAL  27           H        VAL  27  12.594  10.896   5.928
  151    HA   VAL  27           HA       VAL  27  13.552   8.448   5.256
  152    HB   VAL  27           HB       VAL  27  14.244   9.832   7.850
  153   HG11  VAL  27          1HG1      VAL  27  15.427   7.617   6.290
  154   HG12  VAL  27          2HG1      VAL  27  16.550   8.795   6.972
  155   HG13  VAL  27          3HG1      VAL  27  15.443   7.917   8.027
  156   HG21  VAL  27          1HG2      VAL  27  14.397  11.452   6.096
  157   HG22  VAL  27          2HG2      VAL  27  16.033  10.930   6.497
  158   HG23  VAL  27          3HG2      VAL  27  15.241  10.314   5.047
  159    H    LEU  28           H        LEU  28  12.336   9.185   8.532
  160    HA   LEU  28           HA       LEU  28  12.142   6.380   9.167
  161    HB2  LEU  28           1HB      LEU  28  11.198   8.786  10.718
  162    HB3  LEU  28           2HB      LEU  28  11.323   7.140  11.334
  163    HG   LEU  28           HG       LEU  28  13.623   8.905  10.495
  164   HD11  LEU  28          1HD1      LEU  28  12.161   8.926  12.846
  165   HD12  LEU  28          2HD1      LEU  28  13.780   9.583  12.607
  166   HD13  LEU  28          3HD1      LEU  28  13.576   7.944  13.226
  167   HD21  LEU  28          1HD2      LEU  28  13.587   6.111  11.630
  168   HD22  LEU  28          2HD2      LEU  28  15.028   7.107  11.421
  169   HD23  LEU  28          3HD2      LEU  28  14.105   6.582  10.011
  170    H    GLU  29           H        GLU  29  10.007   8.925   8.118
  171    HA   GLU  29           HA       GLU  29   7.623   7.349   8.651
  172    HB2  GLU  29           1HB      GLU  29   7.701   9.941   7.127
  173    HB3  GLU  29           2HB      GLU  29   6.375   9.256   8.055
  174    HG2  GLU  29           1HG      GLU  29   7.743   9.599  10.115
  175    HG3  GLU  29           2HG      GLU  29   8.912  10.466   9.120
  176    H    ARG  30           H        ARG  30   8.961   5.788   7.075
  177    HA   ARG  30           HA       ARG  30   7.407   5.683   4.673
  178    HB2  ARG  30           1HB      ARG  30   9.042   6.019   3.048
  179    HB3  ARG  30           2HB      ARG  30   9.386   7.286   4.218
  180    HG2  ARG  30           1HG      ARG  30  11.175   5.934   5.172
  181    HG3  ARG  30           2HG      ARG  30  10.822   4.648   4.016
  182    HD2  ARG  30           1HD      ARG  30  11.608   5.884   2.211
  183    HD3  ARG  30           2HD      ARG  30  11.445   7.417   3.067
  184    HE   ARG  30           HE       ARG  30  13.551   7.122   3.901
  185   HH11  ARG  30          2HH1      ARG  30  12.362   4.063   2.740
  186   HH12  ARG  30          1HH1      ARG  30  13.869   3.241   2.972
  187   HH21  ARG  30          2HH2      ARG  30  15.541   6.051   4.211
  188   HH22  ARG  30          1HH2      ARG  30  15.677   4.373   3.810
  189    H    LEU  31           H        LEU  31   6.999   3.610   4.286
  190    HA   LEU  31           HA       LEU  31   8.831   1.597   5.403
  191    HB2  LEU  31           1HB      LEU  31   5.881   1.691   4.997
  192    HB3  LEU  31           2HB      LEU  31   6.694   0.128   4.964
  193    HG   LEU  31           HG       LEU  31   7.669   0.941   7.264
  194   HD11  LEU  31          1HD1      LEU  31   6.227   2.371   8.508
  195   HD12  LEU  31          2HD1      LEU  31   5.061   2.443   7.188
  196   HD13  LEU  31          3HD1      LEU  31   6.641   3.205   7.011
  197   HD21  LEU  31          1HD2      LEU  31   6.137  -0.426   8.300
  198   HD22  LEU  31          2HD2      LEU  31   5.966  -0.933   6.620
  199   HD23  LEU  31          3HD2      LEU  31   4.787   0.169   7.333
  200    H    CYS  32           H        CYS  32  10.243   1.212   3.760
  201    HA   CYS  32           HA       CYS  32   9.492   1.033   1.028
  202    HB2  CYS  32           1HB      CYS  32  11.781   0.071   0.725
  203    HB3  CYS  32           2HB      CYS  32  11.761   1.608   1.582
  204    HG   CYS  32           HG       CYS  32  11.697  -1.148   3.516
  205    H    VAL  33           H        VAL  33   7.883  -0.450   0.691
  206    HA   VAL  33           HA       VAL  33   8.609  -3.264   1.178
  207    HB   VAL  33           HB       VAL  33   5.815  -2.119   1.289
  208   HG11  VAL  33          1HG1      VAL  33   6.290  -4.772   2.400
  209   HG12  VAL  33          2HG1      VAL  33   5.019  -4.209   1.313
  210   HG13  VAL  33          3HG1      VAL  33   6.591  -4.679   0.666
  211   HG21  VAL  33          1HG2      VAL  33   6.626  -1.414   3.302
  212   HG22  VAL  33          2HG2      VAL  33   6.163  -3.058   3.743
  213   HG23  VAL  33          3HG2      VAL  33   7.848  -2.684   3.381
  214    H    ASN  34           H        ASN  34   8.731  -4.449  -0.607
  215    HA   ASN  34           HA       ASN  34   8.667  -5.020  -2.814
  216    HB2  ASN  34           1HB      ASN  34   5.830  -4.208  -2.223
  217    HB3  ASN  34           2HB      ASN  34   6.293  -4.798  -3.816
  218   HD21  ASN  34          1HD2      ASN  34   4.859  -5.741  -1.132
  219   HD22  ASN  34          2HD2      ASN  34   5.327  -7.403  -1.067
  220    H    GLY  35           H        GLY  35   9.503  -2.288  -2.203
  221    HA2  GLY  35           1HA      GLY  35  10.351  -0.679  -3.691
  222    HA3  GLY  35           2HA      GLY  35   9.180  -1.204  -4.892
  223    H    HIS  36           H        HIS  36   6.973  -1.048  -2.912
  224    HA   HIS  36           HA       HIS  36   6.419   1.776  -3.273
  225    HB2  HIS  36           1HB      HIS  36   4.734  -0.529  -2.287
  226    HB3  HIS  36           2HB      HIS  36   4.152   1.131  -2.362
  227    HD1  HIS  36           1HD      HIS  36   4.386   2.205  -4.913
  228    HD2  HIS  36           2HD      HIS  36   4.223  -1.930  -4.539
  229    HE1  HIS  36           1HE      HIS  36   3.726   1.350  -7.184
  230    H    PHE  37           H        PHE  37   6.146   3.272  -1.674
  231    HA   PHE  37           HA       PHE  37   7.069   2.469   0.994
  232    HB2  PHE  37           1HB      PHE  37   6.894   5.244  -0.198
  233    HB3  PHE  37           2HB      PHE  37   7.628   4.816   1.344
  234    HD1  PHE  37           1HD      PHE  37   7.890   4.083  -2.296
  235    HD2  PHE  37           2HD      PHE  37   9.894   4.396   1.446
  236    HE1  PHE  37           1HE      PHE  37  10.048   3.736  -3.426
  237    HE2  PHE  37           2HE      PHE  37  12.055   4.050   0.322
  238    HZ   PHE  37           HZ       PHE  37  12.134   3.720  -2.118
  239    H    PHE  38           H        PHE  38   5.962   3.093   2.858
  240    HA   PHE  38           HA       PHE  38   3.378   4.406   2.573
  241    HB2  PHE  38           1HB      PHE  38   3.525   1.764   4.013
  242    HB3  PHE  38           2HB      PHE  38   2.093   2.663   3.526
  243    HD1  PHE  38           1HD      PHE  38   4.934   0.667   2.264
  244    HD2  PHE  38           2HD      PHE  38   1.114   2.341   1.412
  245    HE1  PHE  38           1HE      PHE  38   4.825  -0.648   0.187
  246    HE2  PHE  38           2HE      PHE  38   0.999   1.029  -0.666
  247    HZ   PHE  38           HZ       PHE  38   2.855  -0.468  -1.281
  248    H    HIS  39           H        HIS  39   2.460   5.077   4.613
  249    HA   HIS  39           HA       HIS  39   4.449   6.004   6.432
  250    HB2  HIS  39           1HB      HIS  39   1.430   6.104   6.549
  251    HB3  HIS  39           2HB      HIS  39   2.489   6.906   7.704
  252    HD2  HIS  39           2HD      HIS  39   4.446   8.638   6.043
  253    HE1  HIS  39           1HE      HIS  39   1.176   9.761   3.585
  254    HE2  HIS  39           2HE      HIS  39   3.560  10.256   4.230
  255    H    ARG  40           H        ARG  40   4.568   5.575   8.701
  256    HA   ARG  40           HA       ARG  40   4.452   2.807   9.322
  257    HB2  ARG  40           1HB      ARG  40   4.979   5.236  11.038
  258    HB3  ARG  40           2HB      ARG  40   5.098   3.584  11.630
  259    HG2  ARG  40           1HG      ARG  40   6.627   4.242   9.186
  260    HG3  ARG  40           2HG      ARG  40   7.188   4.946  10.705
  261    HD2  ARG  40           1HD      ARG  40   7.517   2.832  11.684
  262    HD3  ARG  40           2HD      ARG  40   6.570   2.019  10.439
  263    HE   ARG  40           HE       ARG  40   8.803   3.283   9.269
  264   HH11  ARG  40          2HH1      ARG  40   7.968   0.573  11.290
  265   HH12  ARG  40          1HH1      ARG  40   9.325  -0.382  10.793
  266   HH21  ARG  40          2HH2      ARG  40  10.593   2.035   8.607
  267   HH22  ARG  40          1HH2      ARG  40  10.818   0.450   9.268
  268    H    SER  41           H        SER  41   2.219   5.396   9.641
  269    HA   SER  41           HA       SER  41   0.618   3.988  11.635
  270    HB2  SER  41           1HB      SER  41  -0.888   6.086  11.253
  271    HB3  SER  41           2HB      SER  41   0.630   6.267  12.132
  272    HG   SER  41           HG       SER  41   0.529   6.630   9.340
  273    H    CYS  42           H        CYS  42   0.465   5.034   8.265
  274    HA   CYS  42           HA       CYS  42  -2.178   4.208   7.751
  275    HB2  CYS  42           1HB      CYS  42   0.173   4.452   5.862
  276    HB3  CYS  42           2HB      CYS  42  -1.506   4.270   5.364
  277    H    PHE  43           H        PHE  43   0.916   2.581   7.057
  278    HA   PHE  43           HA       PHE  43  -0.103   0.230   5.997
  279    HB2  PHE  43           1HB      PHE  43   2.340   1.023   6.162
  280    HB3  PHE  43           2HB      PHE  43   2.340   0.279   7.758
  281    HD1  PHE  43           2HD      PHE  43   1.118  -0.674   4.358
  282    HD2  PHE  43           1HD      PHE  43   3.354  -1.767   7.811
  283    HE1  PHE  43           2HE      PHE  43   1.625  -2.854   3.335
  284    HE2  PHE  43           1HE      PHE  43   3.866  -3.948   6.794
  285    HZ   PHE  43           HZ       PHE  43   3.000  -4.495   4.553
  286    H    ARG  44           H        ARG  44  -1.847  -0.644   7.025
  287    HA   ARG  44           HA       ARG  44  -1.302  -1.917   9.606
  288    HB2  ARG  44           1HB      ARG  44  -3.831  -0.376   8.990
  289    HB3  ARG  44           2HB      ARG  44  -3.513  -1.293  10.457
  290    HG2  ARG  44           1HG      ARG  44  -1.796   0.224  11.121
  291    HG3  ARG  44           2HG      ARG  44  -1.864   1.059   9.567
  292    HD2  ARG  44           1HD      ARG  44  -3.985   1.974  10.040
  293    HD3  ARG  44           2HD      ARG  44  -4.237   0.884  11.402
  294    HE   ARG  44           HE       ARG  44  -2.072   2.271  12.176
  295   HH11  ARG  44          2HH1      ARG  44  -5.153   3.266  10.897
  296   HH12  ARG  44          1HH1      ARG  44  -5.163   4.777  11.745
  297   HH21  ARG  44          2HH2      ARG  44  -2.074   4.257  13.298
  298   HH22  ARG  44          1HH2      ARG  44  -3.412   5.340  13.110
  299    H    CYS  45           H        CYS  45  -3.188  -3.478  10.139
  300    HA   CYS  45           HA       CYS  45  -3.278  -5.467   8.206
  301    HB2  CYS  45           1HB      CYS  45  -3.754  -5.714  10.673
  302    HB3  CYS  45           2HB      CYS  45  -5.360  -5.064  10.358
  303    H    HIS  46           H        HIS  46  -5.272  -6.387   7.191
  304    HA   HIS  46           HA       HIS  46  -6.804  -4.216   5.940
  305    HB2  HIS  46           1HB      HIS  46  -5.588  -5.539   4.339
  306    HB3  HIS  46           2HB      HIS  46  -6.217  -7.035   5.023
  307    HD1  HIS  46           1HD      HIS  46  -6.945  -4.441   2.536
  308    HD2  HIS  46           2HD      HIS  46  -9.025  -7.461   4.489
  309    HE1  HIS  46           1HE      HIS  46  -9.061  -4.762   1.216
  310    H    THR  47           H        THR  47  -7.117  -6.442   8.345
  311    HA   THR  47           HA       THR  47 -10.028  -6.668   7.931
  312    HB   THR  47           HB       THR  47  -8.103  -8.612   9.191
  313    HG1  THR  47           1HG      THR  47  -8.584  -9.740   7.462
  314   HG21  THR  47          1HG2      THR  47 -10.022  -8.273  10.721
  315   HG22  THR  47          2HG2      THR  47  -9.985  -9.892  10.021
  316   HG23  THR  47          3HG2      THR  47 -11.115  -8.688   9.401
  317    H    CYS  48           H        CYS  48  -7.427  -5.975  10.171
  318    HA   CYS  48           HA       CYS  48  -9.423  -4.967  12.091
  319    HB2  CYS  48           1HB      CYS  48  -7.793  -5.465  13.888
  320    HB3  CYS  48           2HB      CYS  48  -8.310  -6.913  13.030
  321    H    GLU  49           H        GLU  49  -7.012  -4.149   9.961
  322    HA   GLU  49           HA       GLU  49  -5.709  -2.309   9.619
  323    HB2  GLU  49           1HB      GLU  49  -7.801  -0.903  11.282
  324    HB3  GLU  49           2HB      GLU  49  -6.760  -0.188  10.060
  325    HG2  GLU  49           1HG      GLU  49  -8.652  -0.399   8.839
  326    HG3  GLU  49           2HG      GLU  49  -7.942  -1.980   8.521
  327    H    ALA  50           H        ALA  50  -4.584  -3.772  11.536
  328    HA   ALA  50           HA       ALA  50  -3.960  -1.953  13.757
  329    HB1  ALA  50           1HB      ALA  50  -3.787  -4.915  13.416
  330    HB2  ALA  50           2HB      ALA  50  -2.771  -4.107  14.610
  331    HB3  ALA  50           3HB      ALA  50  -4.527  -3.974  14.712
  332    H    THR  51           H        THR  51  -1.984  -1.077  14.002
  333    HA   THR  51           HA       THR  51  -0.227  -0.645  11.994
  334    HB   THR  51           HB       THR  51   0.666  -1.018  14.857
  335    HG1  THR  51           1HG      THR  51  -1.080   0.395  14.852
  336   HG21  THR  51          1HG2      THR  51   2.209   0.891  14.170
  337   HG22  THR  51          2HG2      THR  51   1.753   0.516  12.508
  338   HG23  THR  51          3HG2      THR  51   2.566  -0.698  13.495
  339    H    LEU  52           H        LEU  52   0.471  -2.224  10.663
  340    HA   LEU  52           HA       LEU  52   1.306  -4.796  11.594
  341    HB2  LEU  52           1HB      LEU  52   1.664  -3.468   8.911
  342    HB3  LEU  52           2HB      LEU  52   1.986  -5.166   9.256
  343    HG   LEU  52           HG       LEU  52  -0.716  -3.830   9.401
  344   HD11  LEU  52          1HD1      LEU  52  -0.416  -5.953   7.473
  345   HD12  LEU  52          2HD1      LEU  52   0.718  -4.640   7.159
  346   HD13  LEU  52          3HD1      LEU  52  -1.011  -4.308   7.254
  347   HD21  LEU  52          1HD2      LEU  52  -1.611  -6.005   9.792
  348   HD22  LEU  52          2HD2      LEU  52  -0.335  -5.734  10.979
  349   HD23  LEU  52          3HD2      LEU  52  -0.032  -6.758   9.574
  350    H    TRP  53           H        TRP  53   3.037  -4.710  12.944
  351    HA   TRP  53           HA       TRP  53   5.287  -3.030  12.554
  352    HB2  TRP  53           1HB      TRP  53   5.471  -5.575  14.121
  353    HB3  TRP  53           2HB      TRP  53   6.164  -3.994  14.473
  354    HD1  TRP  53           HD       TRP  53   2.868  -5.942  14.751
  355    HE1  TRP  53           1HE      TRP  53   1.361  -4.753  16.467
  356    HE3  TRP  53           3HE      TRP  53   5.702  -1.766  15.565
  357    HZ2  TRP  53           2HZ      TRP  53   1.373  -2.362  17.966
  358    HZ3  TRP  53           3HZ      TRP  53   4.883  -0.076  17.155
  359    HH2  TRP  53           HH       TRP  53   2.763  -0.369  18.329
  360    HA   PRO  54           HA       PRO  54   7.753  -5.246   9.679
  361    HB2  PRO  54           1HB      PRO  54  10.253  -4.757  10.619
  362    HB3  PRO  54           2HB      PRO  54   9.267  -3.524   9.823
  363    HG2  PRO  54           1HG      PRO  54   9.720  -3.992  12.745
  364    HG3  PRO  54           2HG      PRO  54   9.688  -2.462  11.849
  365    HD2  PRO  54           1HD      PRO  54   7.582  -3.342  13.305
  366    HD3  PRO  54           2HD      PRO  54   7.384  -2.379  11.827
  367    H    GLY  55           H        GLY  55   7.178  -6.390  12.670
  368    HA2  GLY  55           1HA      GLY  55   8.689  -8.848  12.129
  369    HA3  GLY  55           2HA      GLY  55   8.869  -8.086  13.702
  370    H    GLY  56           H        GLY  56   5.904  -8.311  11.792
  371    HA2  GLY  56           1HA      GLY  56   4.817 -10.557  13.113
  372    HA3  GLY  56           2HA      GLY  56   4.305  -9.097  13.946
  373    H    TYR  57           H        TYR  57   4.749  -9.864  10.498
  374    HA   TYR  57           HA       TYR  57   1.914  -9.748  10.003
  375    HB2  TYR  57           1HB      TYR  57   1.812  -7.780   8.732
  376    HB3  TYR  57           2HB      TYR  57   2.778  -7.323  10.130
  377    HD1  TYR  57           2HD      TYR  57   5.384  -7.593   9.805
  378    HD2  TYR  57           1HD      TYR  57   2.583  -7.228   6.623
  379    HE1  TYR  57           2HE      TYR  57   7.185  -6.828   8.314
  380    HE2  TYR  57           1HE      TYR  57   4.376  -6.463   5.124
  381    HH   TYR  57           HH       TYR  57   6.903  -6.713   4.999
  382    H    GLU  58           H        GLU  58   1.409 -10.095   7.688
  383    HA   GLU  58           HA       GLU  58   3.560 -11.061   6.008
  384    HB2  GLU  58           1HB      GLU  58   1.598 -12.875   7.346
  385    HB3  GLU  58           2HB      GLU  58   2.124 -13.254   5.712
  386    HG2  GLU  58           1HG      GLU  58   4.453 -13.251   6.470
  387    HG3  GLU  58           2HG      GLU  58   3.909 -12.903   8.110
  388    H    GLN  59           H        GLN  59   3.008 -11.182   3.838
  389    HA   GLN  59           HA       GLN  59   0.422  -9.966   3.172
  390    HB2  GLN  59           1HB      GLN  59   2.266  -8.697   2.332
  391    HB3  GLN  59           2HB      GLN  59   3.029 -10.133   1.661
  392    HG2  GLN  59           1HG      GLN  59   0.783 -10.259   0.287
  393    HG3  GLN  59           2HG      GLN  59   0.755  -8.530   0.630
  394   HE21  GLN  59          1HE2      GLN  59   0.874  -8.669  -1.820
  395   HE22  GLN  59          2HE2      GLN  59   2.456  -8.613  -2.511
  396    H    HIS  60           H        HIS  60  -1.086 -11.445   2.748
  397    HA   HIS  60           HA       HIS  60  -0.626 -14.081   1.928
  398    HB2  HIS  60           1HB      HIS  60  -2.747 -13.030   2.951
  399    HB3  HIS  60           2HB      HIS  60  -3.163 -12.589   1.297
  400    HD1  HIS  60           1HD      HIS  60  -4.348 -14.321  -0.038
  401    HD2  HIS  60           2HD      HIS  60  -2.449 -15.933   3.287
  402    HE1  HIS  60           1HE      HIS  60  -5.054 -16.733   0.036
  403    HA   PRO  61           HA       PRO  61   0.369 -13.512  -2.347
  404    HB2  PRO  61           1HB      PRO  61   0.186 -16.119  -3.084
  405    HB3  PRO  61           2HB      PRO  61   1.551 -15.474  -2.164
  406    HG2  PRO  61           1HG      PRO  61  -0.846 -16.980  -1.191
  407    HG3  PRO  61           2HG      PRO  61   0.855 -17.164  -0.726
  408    HD2  PRO  61           1HD      PRO  61  -0.931 -15.807   0.790
  409    HD3  PRO  61           2HD      PRO  61   0.787 -15.365   0.713
  410    H    GLY  62           H        GLY  62  -2.576 -14.904  -1.153
  411    HA2  GLY  62           1HA      GLY  62  -3.917 -15.476  -3.535
  412    HA3  GLY  62           2HA      GLY  62  -4.694 -15.006  -2.030
  413    H    ASP  63           H        ASP  63  -5.466 -12.954  -1.786
  414    HA   ASP  63           HA       ASP  63  -6.160 -11.490  -4.051
  415    HB2  ASP  63           1HB      ASP  63  -6.031 -10.696  -1.141
  416    HB3  ASP  63           2HB      ASP  63  -6.679  -9.639  -2.392
  417    H    GLY  64           H        GLY  64  -3.487 -11.026  -1.773
  418    HA2  GLY  64           1HA      GLY  64  -1.360 -10.222  -2.563
  419    HA3  GLY  64           2HA      GLY  64  -2.215  -9.281  -3.776
  420    H    HIS  65           H        HIS  65  -2.817  -9.539  -0.290
  421    HA   HIS  65           HA       HIS  65  -2.158  -6.679  -0.047
  422    HB2  HIS  65           1HB      HIS  65  -4.514  -8.154   1.137
  423    HB3  HIS  65           2HB      HIS  65  -4.015  -6.546   1.652
  424    HD1  HIS  65           1HD      HIS  65  -3.713  -4.918  -0.718
  425    HD2  HIS  65           2HD      HIS  65  -6.562  -7.940  -0.594
  426    HE1  HIS  65           1HE      HIS  65  -5.403  -4.322  -2.482
  427    H    PHE  66           H        PHE  66  -2.202  -6.169   2.498
  428    HA   PHE  66           HA       PHE  66  -0.385  -8.144   3.707
  429    HB2  PHE  66           1HB      PHE  66  -0.559  -5.148   4.044
  430    HB3  PHE  66           2HB      PHE  66   0.419  -6.179   5.083
  431    HD1  PHE  66           2HD      PHE  66   0.024  -4.838   1.692
  432    HD2  PHE  66           1HD      PHE  66   2.473  -7.130   4.312
  433    HE1  PHE  66           2HE      PHE  66   1.874  -4.704   0.075
  434    HE2  PHE  66           1HE      PHE  66   4.327  -6.999   2.699
  435    HZ   PHE  66           HZ       PHE  66   4.028  -5.786   0.577
  436    H    TYR  67           H        TYR  67  -1.099  -9.212   5.421
  437    HA   TYR  67           HA       TYR  67  -3.171  -7.965   7.101
  438    HB2  TYR  67           1HB      TYR  67  -3.033 -10.913   6.456
  439    HB3  TYR  67           2HB      TYR  67  -4.306 -10.070   7.332
  440    HD1  TYR  67           2HD      TYR  67  -2.706 -10.373   3.995
  441    HD2  TYR  67           1HD      TYR  67  -6.139  -9.146   6.189
  442    HE1  TYR  67           2HE      TYR  67  -3.928 -10.041   1.887
  443    HE2  TYR  67           1HE      TYR  67  -7.371  -8.812   4.087
  444    HH   TYR  67           HH       TYR  67  -6.048  -9.800   1.006
  445    H    CYS  68           H        CYS  68  -3.306  -8.941   9.294
  446    HA   CYS  68           HA       CYS  68  -0.694  -9.062  10.457
  447    HB2  CYS  68           1HB      CYS  68  -1.850  -9.193  12.585
  448    HB3  CYS  68           2HB      CYS  68  -2.624  -7.975  11.576
  449    H    LEU  69           H        LEU  69  -0.309 -10.807  12.210
  450    HA   LEU  69           HA       LEU  69  -0.316 -13.352  10.848
  451    HB2  LEU  69           1HB      LEU  69   0.690 -12.770  13.622
  452    HB3  LEU  69           2HB      LEU  69   1.148 -14.103  12.565
  453    HG   LEU  69           HG       LEU  69   1.845 -11.194  12.167
  454   HD11  LEU  69          1HD1      LEU  69   4.194 -12.314  12.394
  455   HD12  LEU  69          2HD1      LEU  69   3.298 -13.548  13.280
  456   HD13  LEU  69          3HD1      LEU  69   3.273 -11.873  13.832
  457   HD21  LEU  69          1HD2      LEU  69   2.865 -13.532  10.581
  458   HD22  LEU  69          2HD2      LEU  69   3.011 -11.811  10.225
  459   HD23  LEU  69          3HD2      LEU  69   1.445 -12.611  10.088
  460    H    GLN  70           H        GLN  70  -2.779 -12.015  12.141
  461    HA   GLN  70           HA       GLN  70  -3.678 -14.429  13.566
  462    HB2  GLN  70           1HB      GLN  70  -3.392 -12.689  15.214
  463    HB3  GLN  70           2HB      GLN  70  -4.300 -11.549  14.230
  464    HG2  GLN  70           1HG      GLN  70  -6.333 -12.638  14.645
  465    HG3  GLN  70           2HG      GLN  70  -5.529 -14.080  15.263
  466   HE21  GLN  70          1HE2      GLN  70  -7.355 -13.335  16.872
  467   HE22  GLN  70          2HE2      GLN  70  -6.774 -12.428  18.223
  468    H    HIS  71           H        HIS  71  -4.109 -12.346  10.981
  469    HA   HIS  71           HA       HIS  71  -6.852 -13.338  10.564
  470    HB2  HIS  71           1HB      HIS  71  -5.688 -10.616  10.083
  471    HB3  HIS  71           2HB      HIS  71  -7.029 -11.183   9.092
  472    HD2  HIS  71           2HD      HIS  71  -8.009 -12.644  12.261
  473    HE1  HIS  71           1HE      HIS  71  -9.271  -8.610  12.636
  474    HE2  HIS  71           2HE      HIS  71  -9.398 -10.929  13.611
  475    H    LEU  72           H        LEU  72  -3.669 -12.946   9.338
  476    HA   LEU  72           HA       LEU  72  -3.950 -13.060   6.611
  477    HB2  LEU  72           1HB      LEU  72  -1.815 -12.935   7.903
  478    HB3  LEU  72           2HB      LEU  72  -1.953 -14.668   8.193
  479    HG   LEU  72           HG       LEU  72  -2.074 -14.684   5.524
  480   HD11  LEU  72          1HD1      LEU  72   0.048 -12.782   5.463
  481   HD12  LEU  72          2HD1      LEU  72  -1.399 -12.008   6.107
  482   HD13  LEU  72          3HD1      LEU  72  -1.451 -12.804   4.534
  483   HD21  LEU  72          1HD2      LEU  72   0.313 -14.640   7.344
  484   HD22  LEU  72          2HD2      LEU  72   0.464 -14.959   5.615
  485   HD23  LEU  72          3HD2      LEU  72  -0.506 -16.028   6.628
  486    HA   PRO  73           HA       PRO  73  -6.257 -16.868   6.175
  487    HB2  PRO  73           1HB      PRO  73  -6.564 -16.665   3.485
  488    HB3  PRO  73           2HB      PRO  73  -7.541 -15.746   4.635
  489    HG2  PRO  73           1HG      PRO  73  -5.141 -14.878   3.070
  490    HG3  PRO  73           2HG      PRO  73  -6.655 -14.004   3.375
  491    HD2  PRO  73           1HD      PRO  73  -4.382 -13.508   4.761
  492    HD3  PRO  73           2HD      PRO  73  -5.996 -13.343   5.482
  493    H    GLN  74           H        GLN  74  -6.066 -18.756   4.569
  494    HA   GLN  74           HA       GLN  74  -3.416 -19.164   3.471
  495    HB2  GLN  74           1HB      GLN  74  -4.365 -20.462   5.969
  496    HB3  GLN  74           2HB      GLN  74  -3.501 -21.474   4.820
  497    HG2  GLN  74           1HG      GLN  74  -1.647 -19.817   4.855
  498    HG3  GLN  74           2HG      GLN  74  -2.501 -18.963   6.139
  499   HE21  GLN  74          1HE2      GLN  74  -1.091 -19.279   7.773
  500   HE22  GLN  74          2HE2      GLN  74  -0.680 -20.828   8.417
  501    H    THR  75           H        THR  75  -3.444 -20.505   1.755
  502    HA   THR  75           HA       THR  75  -5.838 -21.236   0.537
  503    HB   THR  75           HB       THR  75  -4.456 -22.669  -0.958
  504    HG1  THR  75           1HG      THR  75  -2.720 -23.437  -0.007
  505   HG21  THR  75          1HG2      THR  75  -3.182 -19.987  -0.412
  506   HG22  THR  75          2HG2      THR  75  -4.690 -20.210  -1.299
  507   HG23  THR  75          3HG2      THR  75  -3.185 -20.873  -1.936
  508    H    ASP  76           H        ASP  76  -6.749 -23.317   0.104
  509    HA   ASP  76           HA       ASP  76  -6.126 -25.352   2.141
  510    HB2  ASP  76           1HB      ASP  76  -8.814 -24.320   1.252
  511    HB3  ASP  76           2HB      ASP  76  -8.633 -25.891   2.027
  512    H    SER  77           H        SER  77  -7.582 -24.722  -1.029
  513    HA   SER  77           HA       SER  77  -7.277 -27.542  -1.741
  514    HB2  SER  77           1HB      SER  77  -9.424 -26.422  -2.257
  515    HB3  SER  77           2HB      SER  77  -8.566 -25.286  -3.298
  516    HG   SER  77           HG       SER  77  -8.681 -26.721  -4.811
  517    H    GLY  78           H        GLY  78  -6.323 -28.105  -3.833
  518    HA2  GLY  78           1HA      GLY  78  -4.693 -26.264  -5.262
  519    HA3  GLY  78           2HA      GLY  78  -3.723 -27.196  -4.131
  520    HA   PRO  79           HA       PRO  79  -4.130 -29.504  -8.178
  521    HB2  PRO  79           1HB      PRO  79  -1.463 -29.783  -8.599
  522    HB3  PRO  79           2HB      PRO  79  -2.382 -28.382  -9.161
  523    HG2  PRO  79           1HG      PRO  79  -0.661 -28.667  -6.729
  524    HG3  PRO  79           2HG      PRO  79  -0.766 -27.316  -7.873
  525    HD2  PRO  79           1HD      PRO  79  -2.005 -27.286  -5.466
  526    HD3  PRO  79           2HD      PRO  79  -2.673 -26.471  -6.894
  527    H    SER  80           H        SER  80  -4.529 -31.599  -7.899
  528    HA   SER  80           HA       SER  80  -4.533 -33.697  -6.998
  529    HB2  SER  80           1HB      SER  80  -2.395 -34.840  -7.052
  530    HB3  SER  80           2HB      SER  80  -2.491 -33.743  -8.429
  531    HG   SER  80           HG       SER  80  -1.235 -33.079  -5.975
  532    H    SER  81           H        SER  81  -4.969 -31.740  -5.079
  533    HA   SER  81           HA       SER  81  -3.420 -31.618  -2.841
  534    HB2  SER  81           1HB      SER  81  -5.846 -30.693  -3.377
  535    HB3  SER  81           2HB      SER  81  -6.341 -32.094  -2.427
  536    HG   SER  81           HG       SER  81  -5.577 -29.790  -1.502
  537    H    GLY  82           H        GLY  82  -5.916 -34.102  -3.432
  538    HA2  GLY  82           1HA      GLY  82  -6.150 -36.233  -2.613
  539    HA3  GLY  82           2HA      GLY  82  -4.394 -36.264  -2.534
  Start of MODEL    7
    1    H1   GLY   1           H        GLY   1  -2.792  24.873 -40.817
    2    HA2  GLY   1           1HA      GLY   1  -3.246  24.946 -38.179
    3    HA3  GLY   1           2HA      GLY   1  -2.849  23.250 -38.409
    4    H    SER   2           H        SER   2  -0.741  22.658 -38.968
    5    HA   SER   2           HA       SER   2   1.509  22.826 -38.477
    6    HB2  SER   2           1HB      SER   2   2.674  24.018 -40.192
    7    HB3  SER   2           2HB      SER   2   1.181  23.424 -40.918
    8    HG   SER   2           HG       SER   2   0.315  25.574 -40.379
    9    H    SER   3           H        SER   3   0.129  24.124 -36.477
   10    HA   SER   3           HA       SER   3   2.099  26.070 -35.642
   11    HB2  SER   3           1HB      SER   3   0.188  27.270 -36.937
   12    HB3  SER   3           2HB      SER   3  -0.772  26.950 -35.492
   13    HG   SER   3           HG       SER   3   0.943  28.023 -34.307
   14    H    GLY   4           H        GLY   4   2.003  26.541 -33.373
   15    HA2  GLY   4           1HA      GLY   4   0.085  25.545 -31.597
   16    HA3  GLY   4           2HA      GLY   4   1.319  24.308 -31.791
   17    H    SER   5           H        SER   5   1.158  25.061 -29.334
   18    HA   SER   5           HA       SER   5   3.648  26.247 -28.736
   19    HB2  SER   5           1HB      SER   5   2.582  28.347 -29.301
   20    HB3  SER   5           2HB      SER   5   1.209  27.975 -28.258
   21    HG   SER   5           HG       SER   5   2.849  27.891 -26.521
   22    H    SER   6           H        SER   6   4.171  24.898 -27.149
   23    HA   SER   6           HA       SER   6   2.809  24.946 -24.656
   24    HB2  SER   6           1HB      SER   6   1.901  22.760 -24.547
   25    HB3  SER   6           2HB      SER   6   1.354  23.407 -26.093
   26    HG   SER   6           HG       SER   6   2.980  22.226 -27.114
   27    H    GLY   7           H        GLY   7   3.864  23.588 -23.031
   28    HA2  GLY   7           1HA      GLY   7   6.171  22.060 -23.567
   29    HA3  GLY   7           2HA      GLY   7   6.656  23.707 -23.191
   30    H    GLN   8           H        GLN   8   4.633  21.061 -21.943
   31    HA   GLN   8           HA       GLN   8   5.745  21.493 -19.295
   32    HB2  GLN   8           1HB      GLN   8   3.594  22.910 -19.659
   33    HB3  GLN   8           2HB      GLN   8   2.756  21.370 -19.525
   34    HG2  GLN   8           1HG      GLN   8   2.763  22.464 -17.392
   35    HG3  GLN   8           2HG      GLN   8   3.786  21.030 -17.317
   36   HE21  GLN   8          1HE2      GLN   8   4.405  22.412 -15.354
   37   HE22  GLN   8          2HE2      GLN   8   5.758  23.463 -15.577
   38    H    HIS   9           H        HIS   9   6.503  19.517 -18.899
   39    HA   HIS   9           HA       HIS   9   4.635  17.284 -18.893
   40    HB2  HIS   9           1HB      HIS   9   6.107  15.812 -20.149
   41    HB3  HIS   9           2HB      HIS   9   5.700  17.218 -21.128
   42    HD1  HIS   9           1HD      HIS   9   8.467  15.186 -20.437
   43    HD2  HIS   9           2HD      HIS   9   7.935  19.300 -20.665
   44    HE1  HIS   9           1HE      HIS   9  10.762  16.140 -20.824
   45    H    GLN  10           H        GLN  10   4.748  16.791 -16.790
   46    HA   GLN  10           HA       GLN  10   7.333  16.801 -15.432
   47    HB2  GLN  10           1HB      GLN  10   4.541  16.404 -14.341
   48    HB3  GLN  10           2HB      GLN  10   6.007  16.497 -13.374
   49    HG2  GLN  10           1HG      GLN  10   5.169  18.723 -15.198
   50    HG3  GLN  10           2HG      GLN  10   4.568  18.587 -13.546
   51   HE21  GLN  10          1HE2      GLN  10   6.207  20.664 -14.742
   52   HE22  GLN  10          2HE2      GLN  10   7.663  20.729 -13.814
   53    H    GLU  11           H        GLU  11   8.329  14.961 -16.230
   54    HA   GLU  11           HA       GLU  11   7.046  12.412 -15.494
   55    HB2  GLU  11           1HB      GLU  11   8.310  11.358 -17.318
   56    HB3  GLU  11           2HB      GLU  11   7.242  12.621 -17.914
   57    HG2  GLU  11           1HG      GLU  11   9.111  13.127 -19.092
   58    HG3  GLU  11           2HG      GLU  11   9.411  14.097 -17.651
   59    H    ALA  12           H        ALA  12   8.560  13.911 -13.669
   60    HA   ALA  12           HA       ALA  12  10.873  12.127 -13.315
   61    HB1  ALA  12           1HB      ALA  12  12.236  13.866 -13.566
   62    HB2  ALA  12           2HB      ALA  12  10.887  15.002 -13.597
   63    HB3  ALA  12           3HB      ALA  12  11.582  14.501 -12.056
   64    H    GLY  13           H        GLY  13   9.401  10.911 -11.956
   65    HA2  GLY  13           1HA      GLY  13   9.470  11.889  -9.216
   66    HA3  GLY  13           2HA      GLY  13   7.870  11.587  -9.878
   67    H    ALA  14           H        ALA  14  10.103  10.284  -7.950
   68    HA   ALA  14           HA       ALA  14   9.883   7.538  -8.907
   69    HB1  ALA  14           1HB      ALA  14  11.243   8.359  -6.367
   70    HB2  ALA  14           2HB      ALA  14  11.581   6.982  -7.417
   71    HB3  ALA  14           3HB      ALA  14  12.011   8.612  -7.934
   72    H    GLY  15           H        GLY  15   7.461   8.806  -8.089
   73    HA2  GLY  15           1HA      GLY  15   5.717   8.629  -6.565
   74    HA3  GLY  15           2HA      GLY  15   6.093   6.923  -6.755
   75    H    ASP  16           H        ASP  16   7.699   9.628  -5.079
   76    HA   ASP  16           HA       ASP  16   8.235   7.909  -2.810
   77    HB2  ASP  16           1HB      ASP  16   8.839  10.856  -2.961
   78    HB3  ASP  16           2HB      ASP  16   9.666   9.614  -2.024
   79    H    LEU  17           H        LEU  17   5.511   8.250  -3.177
   80    HA   LEU  17           HA       LEU  17   4.813   9.768  -0.761
   81    HB2  LEU  17           1HB      LEU  17   2.946   9.646  -3.096
   82    HB3  LEU  17           2HB      LEU  17   2.949  10.764  -1.734
   83    HG   LEU  17           HG       LEU  17   5.168  10.810  -3.748
   84   HD11  LEU  17          1HD1      LEU  17   3.727  12.748  -4.732
   85   HD12  LEU  17          2HD1      LEU  17   2.381  11.829  -4.058
   86   HD13  LEU  17          3HD1      LEU  17   3.448  11.084  -5.249
   87   HD21  LEU  17          1HD2      LEU  17   5.736  12.188  -2.002
   88   HD22  LEU  17          2HD2      LEU  17   4.061  12.613  -1.647
   89   HD23  LEU  17          3HD2      LEU  17   4.872  13.317  -3.046
   90    H    CYS  18           H        CYS  18   3.514   8.724   0.634
   91    HA   CYS  18           HA       CYS  18   3.186   6.088   0.827
   92    HB2  CYS  18           1HB      CYS  18   2.393   7.720   2.514
   93    HB3  CYS  18           2HB      CYS  18   0.987   8.052   1.508
   94    H    ALA  19           H        ALA  19   1.731   4.479   0.219
   95    HA   ALA  19           HA       ALA  19   0.425   4.958  -2.340
   96    HB1  ALA  19           1HB      ALA  19   0.296   2.567  -2.547
   97    HB2  ALA  19           2HB      ALA  19   1.923   3.006  -2.026
   98    HB3  ALA  19           3HB      ALA  19   0.770   2.354  -0.862
   99    H    LEU  20           H        LEU  20  -0.372   4.456   0.986
  100    HA   LEU  20           HA       LEU  20  -3.067   3.603   0.574
  101    HB2  LEU  20           1HB      LEU  20  -1.397   4.427   2.875
  102    HB3  LEU  20           2HB      LEU  20  -3.143   4.580   3.063
  103    HG   LEU  20           HG       LEU  20  -3.087   2.070   2.215
  104   HD11  LEU  20          1HD1      LEU  20  -0.957   1.422   1.901
  105   HD12  LEU  20          2HD1      LEU  20  -0.969   1.210   3.652
  106   HD13  LEU  20          3HD1      LEU  20  -0.306   2.684   2.947
  107   HD21  LEU  20          1HD2      LEU  20  -2.369   1.835   4.924
  108   HD22  LEU  20          2HD2      LEU  20  -3.991   1.909   4.235
  109   HD23  LEU  20          3HD2      LEU  20  -3.184   3.390   4.753
  110    H    CYS  21           H        CYS  21  -1.914   6.606   2.110
  111    HA   CYS  21           HA       CYS  21  -4.362   7.960   1.420
  112    HB2  CYS  21           1HB      CYS  21  -3.244   9.922   2.532
  113    HB3  CYS  21           2HB      CYS  21  -3.405   8.493   3.548
  114    H    GLY  22           H        GLY  22  -0.918   8.396   0.611
  115    HA2  GLY  22           1HA      GLY  22  -0.225   8.835  -1.647
  116    HA3  GLY  22           2HA      GLY  22  -1.775   9.614  -1.928
  117    H    GLU  23           H        GLU  23   0.513  10.074   0.742
  118    HA   GLU  23           HA       GLU  23   0.801  12.878  -0.119
  119    HB2  GLU  23           1HB      GLU  23   0.646  11.760   2.684
  120    HB3  GLU  23           2HB      GLU  23   1.083  13.421   2.309
  121    HG2  GLU  23           1HG      GLU  23  -1.496  12.254   1.343
  122    HG3  GLU  23           2HG      GLU  23  -1.339  12.899   2.977
  123    H    HIS  24           H        HIS  24   2.784  13.891   1.094
  124    HA   HIS  24           HA       HIS  24   5.096  12.776   0.050
  125    HB2  HIS  24           1HB      HIS  24   4.567  15.153   1.098
  126    HB3  HIS  24           2HB      HIS  24   5.302  14.432   2.526
  127    HD1  HIS  24           1HD      HIS  24   6.140  16.184  -0.514
  128    HD2  HIS  24           2HD      HIS  24   8.024  13.413   1.941
  129    HE1  HIS  24           1HE      HIS  24   8.584  16.329  -1.089
  130    H    LEU  25           H        LEU  25   7.000  11.945   1.195
  131    HA   LEU  25           HA       LEU  25   6.307  10.367   3.579
  132    HB2  LEU  25           1HB      LEU  25   7.800   9.456   1.129
  133    HB3  LEU  25           2HB      LEU  25   7.788   8.566   2.650
  134    HG   LEU  25           HG       LEU  25   5.259   9.211   1.158
  135   HD11  LEU  25          1HD1      LEU  25   7.327   7.216   0.542
  136   HD12  LEU  25          2HD1      LEU  25   6.066   7.904  -0.481
  137   HD13  LEU  25          3HD1      LEU  25   5.679   6.594   0.635
  138   HD21  LEU  25          1HD2      LEU  25   5.888   7.981   3.646
  139   HD22  LEU  25          2HD2      LEU  25   5.210   6.758   2.571
  140   HD23  LEU  25          3HD2      LEU  25   4.307   8.236   2.907
  141    H    TYR  26           H        TYR  26   7.884  10.160   5.123
  142    HA   TYR  26           HA       TYR  26  10.140  11.986   4.866
  143    HB2  TYR  26           1HB      TYR  26   8.568  11.890   6.891
  144    HB3  TYR  26           2HB      TYR  26   9.407  10.404   7.323
  145    HD1  TYR  26           1HD      TYR  26  10.725  13.603   5.926
  146    HD2  TYR  26           2HD      TYR  26  10.671  10.896   9.208
  147    HE1  TYR  26           1HE      TYR  26  12.478  14.923   7.036
  148    HE2  TYR  26           2HE      TYR  26  12.423  12.210  10.328
  149    HH   TYR  26           HH       TYR  26  14.375  14.241   8.927
  150    H    VAL  27           H        VAL  27  12.212  11.210   6.016
  151    HA   VAL  27           HA       VAL  27  13.122   8.868   4.615
  152    HB   VAL  27           HB       VAL  27  15.315   9.367   5.668
  153   HG11  VAL  27          1HG1      VAL  27  15.685  11.498   4.496
  154   HG12  VAL  27          2HG1      VAL  27  14.746  10.360   3.528
  155   HG13  VAL  27          3HG1      VAL  27  13.941  11.702   4.343
  156   HG21  VAL  27          1HG2      VAL  27  15.012  11.916   6.680
  157   HG22  VAL  27          2HG2      VAL  27  13.631  11.042   7.344
  158   HG23  VAL  27          3HG2      VAL  27  15.268  10.447   7.622
  159    H    LEU  28           H        LEU  28  11.445   9.218   7.404
  160    HA   LEU  28           HA       LEU  28  12.638   6.791   8.571
  161    HB2  LEU  28           1HB      LEU  28  11.740   9.319   9.846
  162    HB3  LEU  28           2HB      LEU  28  11.469   7.813  10.720
  163    HG   LEU  28           HG       LEU  28  14.167   8.741   9.745
  164   HD11  LEU  28          1HD1      LEU  28  12.717   9.925  11.739
  165   HD12  LEU  28          2HD1      LEU  28  14.476   9.925  11.614
  166   HD13  LEU  28          3HD1      LEU  28  13.664   8.725  12.619
  167   HD21  LEU  28          1HD2      LEU  28  15.000   7.030  11.289
  168   HD22  LEU  28          2HD2      LEU  28  13.985   6.332  10.027
  169   HD23  LEU  28          3HD2      LEU  28  13.341   6.557  11.654
  170    H    GLU  29           H        GLU  29   9.706   8.647   7.966
  171    HA   GLU  29           HA       GLU  29   7.921   6.695   9.027
  172    HB2  GLU  29           1HB      GLU  29   7.335   8.874   7.015
  173    HB3  GLU  29           2HB      GLU  29   6.159   8.014   8.000
  174    HG2  GLU  29           1HG      GLU  29   7.322   8.952  10.019
  175    HG3  GLU  29           2HG      GLU  29   8.246   9.970   8.917
  176    H    ARG  30           H        ARG  30   8.794   7.615   5.697
  177    HA   ARG  30           HA       ARG  30   7.306   5.994   4.169
  178    HB2  ARG  30           1HB      ARG  30   8.921   6.133   2.516
  179    HB3  ARG  30           2HB      ARG  30   9.366   7.474   3.563
  180    HG2  ARG  30           1HG      ARG  30  11.103   6.130   4.592
  181    HG3  ARG  30           2HG      ARG  30  10.631   4.743   3.608
  182    HD2  ARG  30           1HD      ARG  30  11.301   5.846   1.601
  183    HD3  ARG  30           2HD      ARG  30  11.535   7.372   2.452
  184    HE   ARG  30           HE       ARG  30  13.212   5.473   3.618
  185   HH11  ARG  30          2HH1      ARG  30  12.822   7.129   0.581
  186   HH12  ARG  30          1HH1      ARG  30  14.507   7.069   0.183
  187   HH21  ARG  30          2HH2      ARG  30  15.433   5.387   3.105
  188   HH22  ARG  30          1HH2      ARG  30  15.991   6.077   1.619
  189    H    LEU  31           H        LEU  31   7.002   3.875   3.779
  190    HA   LEU  31           HA       LEU  31   8.650   1.979   5.313
  191    HB2  LEU  31           1HB      LEU  31   5.770   2.137   4.684
  192    HB3  LEU  31           2HB      LEU  31   6.486   0.527   4.638
  193    HG   LEU  31           HG       LEU  31   7.014   2.177   7.046
  194   HD11  LEU  31          1HD1      LEU  31   4.322   1.345   6.158
  195   HD12  LEU  31          2HD1      LEU  31   4.813   2.663   7.221
  196   HD13  LEU  31          3HD1      LEU  31   4.742   1.013   7.839
  197   HD21  LEU  31          1HD2      LEU  31   7.993   0.082   7.153
  198   HD22  LEU  31          2HD2      LEU  31   6.635  -0.709   6.353
  199   HD23  LEU  31          3HD2      LEU  31   6.478  -0.162   8.023
  200    H    CYS  32           H        CYS  32  10.247   1.512   3.852
  201    HA   CYS  32           HA       CYS  32   9.801   1.037   1.096
  202    HB2  CYS  32           1HB      CYS  32  12.006   1.571   2.458
  203    HB3  CYS  32           2HB      CYS  32  12.133  -0.183   2.509
  204    HG   CYS  32           HG       CYS  32  13.765   0.762   0.452
  205    H    VAL  33           H        VAL  33   8.182  -0.475   0.813
  206    HA   VAL  33           HA       VAL  33   8.945  -3.240   1.461
  207    HB   VAL  33           HB       VAL  33   6.063  -2.410   1.517
  208   HG11  VAL  33          1HG1      VAL  33   5.719  -4.430   2.665
  209   HG12  VAL  33          2HG1      VAL  33   6.875  -4.824   1.391
  210   HG13  VAL  33          3HG1      VAL  33   7.431  -4.601   3.050
  211   HG21  VAL  33          1HG2      VAL  33   6.438  -2.450   4.089
  212   HG22  VAL  33          2HG2      VAL  33   8.108  -2.065   3.673
  213   HG23  VAL  33          3HG2      VAL  33   6.805  -0.983   3.181
  214    H    ASN  34           H        ASN  34   9.234  -4.281  -0.389
  215    HA   ASN  34           HA       ASN  34   8.957  -5.044  -2.513
  216    HB2  ASN  34           1HB      ASN  34   6.144  -4.065  -2.004
  217    HB3  ASN  34           2HB      ASN  34   6.616  -4.944  -3.455
  218   HD21  ASN  34          1HD2      ASN  34   4.870  -5.484  -0.999
  219   HD22  ASN  34          2HD2      ASN  34   5.349  -7.071  -0.511
  220    H    GLY  35           H        GLY  35   9.746  -2.224  -1.948
  221    HA2  GLY  35           1HA      GLY  35  10.619  -0.689  -3.513
  222    HA3  GLY  35           2HA      GLY  35   9.457  -1.270  -4.696
  223    H    HIS  36           H        HIS  36   7.226  -1.048  -2.768
  224    HA   HIS  36           HA       HIS  36   6.614   1.725  -3.278
  225    HB2  HIS  36           1HB      HIS  36   4.971  -0.384  -1.862
  226    HB3  HIS  36           2HB      HIS  36   4.389   1.180  -2.424
  227    HD1  HIS  36           1HD      HIS  36   5.794   1.043  -5.251
  228    HD2  HIS  36           2HD      HIS  36   3.441  -1.929  -3.552
  229    HE1  HIS  36           1HE      HIS  36   4.933  -0.318  -7.182
  230    H    PHE  37           H        PHE  37   5.934   3.237  -1.672
  231    HA   PHE  37           HA       PHE  37   7.128   2.729   0.974
  232    HB2  PHE  37           1HB      PHE  37   6.984   5.268  -0.650
  233    HB3  PHE  37           2HB      PHE  37   7.379   5.259   1.065
  234    HD1  PHE  37           2HD      PHE  37   9.272   3.425   1.655
  235    HD2  PHE  37           1HD      PHE  37   8.748   5.365  -2.097
  236    HE1  PHE  37           2HE      PHE  37  11.632   2.997   1.108
  237    HE2  PHE  37           1HE      PHE  37  11.108   4.940  -2.650
  238    HZ   PHE  37           HZ       PHE  37  12.553   3.756  -1.046
  239    H    PHE  38           H        PHE  38   5.879   2.970   2.727
  240    HA   PHE  38           HA       PHE  38   3.298   4.345   2.434
  241    HB2  PHE  38           1HB      PHE  38   3.597   1.805   4.028
  242    HB3  PHE  38           2HB      PHE  38   2.113   2.608   3.527
  243    HD1  PHE  38           1HD      PHE  38   5.119   0.920   2.127
  244    HD2  PHE  38           2HD      PHE  38   1.000   1.874   1.641
  245    HE1  PHE  38           1HE      PHE  38   5.025  -0.515   0.131
  246    HE2  PHE  38           2HE      PHE  38   0.899   0.441  -0.355
  247    HZ   PHE  38           HZ       PHE  38   2.913  -0.757  -1.113
  248    H    HIS  39           H        HIS  39   2.315   4.927   4.539
  249    HA   HIS  39           HA       HIS  39   4.309   6.101   6.249
  250    HB2  HIS  39           1HB      HIS  39   1.301   6.178   6.174
  251    HB3  HIS  39           2HB      HIS  39   2.198   6.872   7.521
  252    HD2  HIS  39           2HD      HIS  39   4.554   8.366   5.757
  253    HE1  HIS  39           1HE      HIS  39   1.282  10.336   3.911
  254    HE2  HIS  39           2HE      HIS  39   3.777  10.324   4.257
  255    H    ARG  40           H        ARG  40   4.757   5.617   8.370
  256    HA   ARG  40           HA       ARG  40   4.544   2.938   9.180
  257    HB2  ARG  40           1HB      ARG  40   5.328   5.470  10.593
  258    HB3  ARG  40           2HB      ARG  40   5.224   3.949  11.469
  259    HG2  ARG  40           1HG      ARG  40   6.821   4.051   8.961
  260    HG3  ARG  40           2HG      ARG  40   7.486   4.762  10.433
  261    HD2  ARG  40           1HD      ARG  40   6.914   2.549  11.560
  262    HD3  ARG  40           2HD      ARG  40   6.675   1.912   9.934
  263    HE   ARG  40           HE       ARG  40   9.122   2.965   9.741
  264   HH11  ARG  40          2HH1      ARG  40   7.688   0.908  12.156
  265   HH12  ARG  40          1HH1      ARG  40   9.181   0.135  12.572
  266   HH21  ARG  40          2HH2      ARG  40  11.095   1.955  10.280
  267   HH22  ARG  40          1HH2      ARG  40  11.119   0.732  11.505
  268    H    SER  41           H        SER  41   2.232   5.360   9.210
  269    HA   SER  41           HA       SER  41   0.772   4.171  11.465
  270    HB2  SER  41           1HB      SER  41  -0.632   6.188  11.398
  271    HB3  SER  41           2HB      SER  41   1.073   6.611  11.555
  272    HG   SER  41           HG       SER  41   0.825   6.638   9.060
  273    H    CYS  42           H        CYS  42   0.558   4.896   8.032
  274    HA   CYS  42           HA       CYS  42  -2.136   4.076   7.690
  275    HB2  CYS  42           1HB      CYS  42   0.175   4.581   5.855
  276    HB3  CYS  42           2HB      CYS  42  -1.262   3.779   5.228
  277    H    PHE  43           H        PHE  43   0.933   2.443   6.894
  278    HA   PHE  43           HA       PHE  43  -0.039   0.042   5.992
  279    HB2  PHE  43           1HB      PHE  43   2.397   0.851   6.191
  280    HB3  PHE  43           2HB      PHE  43   2.355   0.170   7.814
  281    HD1  PHE  43           2HD      PHE  43   1.087  -0.985   4.498
  282    HD2  PHE  43           1HD      PHE  43   3.513  -1.803   7.899
  283    HE1  PHE  43           2HE      PHE  43   1.627  -3.202   3.576
  284    HE2  PHE  43           1HE      PHE  43   4.057  -4.020   6.982
  285    HZ   PHE  43           HZ       PHE  43   3.113  -4.723   4.819
  286    H    ARG  44           H        ARG  44  -1.831  -0.746   7.028
  287    HA   ARG  44           HA       ARG  44  -1.345  -1.931   9.664
  288    HB2  ARG  44           1HB      ARG  44  -3.681  -0.190   8.895
  289    HB3  ARG  44           2HB      ARG  44  -3.758  -1.321  10.240
  290    HG2  ARG  44           1HG      ARG  44  -2.085  -0.159  11.438
  291    HG3  ARG  44           2HG      ARG  44  -1.655   0.813  10.028
  292    HD2  ARG  44           1HD      ARG  44  -3.886   1.852  10.094
  293    HD3  ARG  44           2HD      ARG  44  -4.265   0.911  11.536
  294    HE   ARG  44           HE       ARG  44  -1.964   2.257  12.156
  295   HH11  ARG  44          2HH1      ARG  44  -5.158   3.149  11.098
  296   HH12  ARG  44          1HH1      ARG  44  -5.141   4.680  11.910
  297   HH21  ARG  44          2HH2      ARG  44  -1.929   4.270  13.229
  298   HH22  ARG  44          1HH2      ARG  44  -3.303   5.317  13.120
  299    H    CYS  45           H        CYS  45  -3.278  -3.446  10.213
  300    HA   CYS  45           HA       CYS  45  -3.347  -5.478   8.284
  301    HB2  CYS  45           1HB      CYS  45  -3.695  -5.745  10.767
  302    HB3  CYS  45           2HB      CYS  45  -5.323  -5.115  10.541
  303    H    HIS  46           H        HIS  46  -5.385  -6.441   7.383
  304    HA   HIS  46           HA       HIS  46  -7.004  -4.298   6.196
  305    HB2  HIS  46           1HB      HIS  46  -5.914  -5.575   4.509
  306    HB3  HIS  46           2HB      HIS  46  -6.356  -7.097   5.277
  307    HD1  HIS  46           1HD      HIS  46  -7.488  -4.665   2.789
  308    HD2  HIS  46           2HD      HIS  46  -9.178  -7.726   5.034
  309    HE1  HIS  46           1HE      HIS  46  -9.686  -5.179   1.680
  310    H    THR  47           H        THR  47  -7.165  -6.521   8.625
  311    HA   THR  47           HA       THR  47 -10.094  -6.758   8.377
  312    HB   THR  47           HB       THR  47  -8.097  -8.706   9.511
  313    HG1  THR  47           1HG      THR  47  -8.660  -8.950   7.314
  314   HG21  THR  47          1HG2      THR  47  -9.927  -8.388  11.148
  315   HG22  THR  47          2HG2      THR  47  -9.931  -9.998  10.429
  316   HG23  THR  47          3HG2      THR  47 -11.092  -8.788   9.887
  317    H    CYS  48           H        CYS  48  -7.379  -5.961  10.406
  318    HA   CYS  48           HA       CYS  48  -9.256  -4.990  12.457
  319    HB2  CYS  48           1HB      CYS  48  -7.559  -5.522  14.173
  320    HB3  CYS  48           2HB      CYS  48  -8.122  -6.960  13.327
  321    H    GLU  49           H        GLU  49  -7.069  -4.139  10.165
  322    HA   GLU  49           HA       GLU  49  -5.696  -2.346   9.788
  323    HB2  GLU  49           1HB      GLU  49  -6.708  -0.174  10.464
  324    HB3  GLU  49           2HB      GLU  49  -7.831  -1.247   9.641
  325    HG2  GLU  49           1HG      GLU  49  -8.819  -1.877  11.768
  326    HG3  GLU  49           2HG      GLU  49  -7.668  -0.849  12.620
  327    H    ALA  50           H        ALA  50  -4.521  -3.797  11.686
  328    HA   ALA  50           HA       ALA  50  -3.827  -1.971  13.877
  329    HB1  ALA  50           1HB      ALA  50  -3.392  -4.930  13.525
  330    HB2  ALA  50           2HB      ALA  50  -2.715  -3.993  14.858
  331    HB3  ALA  50           3HB      ALA  50  -4.464  -4.122  14.671
  332    H    THR  51           H        THR  51  -1.901  -0.996  13.973
  333    HA   THR  51           HA       THR  51  -0.206  -0.586  11.926
  334    HB   THR  51           HB       THR  51   0.735  -0.882  14.785
  335    HG1  THR  51           1HG      THR  51  -0.716   0.674  15.009
  336   HG21  THR  51          1HG2      THR  51   2.683  -0.607  13.575
  337   HG22  THR  51          2HG2      THR  51   2.241   1.069  13.901
  338   HG23  THR  51          3HG2      THR  51   1.895   0.356  12.326
  339    H    LEU  52           H        LEU  52   0.440  -2.197  10.597
  340    HA   LEU  52           HA       LEU  52   1.347  -4.736  11.519
  341    HB2  LEU  52           1HB      LEU  52   1.629  -3.400   8.832
  342    HB3  LEU  52           2HB      LEU  52   2.017  -5.087   9.165
  343    HG   LEU  52           HG       LEU  52  -0.723  -3.831   9.335
  344   HD11  LEU  52          1HD1      LEU  52   0.403  -5.806   7.355
  345   HD12  LEU  52          2HD1      LEU  52   0.125  -4.093   7.041
  346   HD13  LEU  52          3HD1      LEU  52  -1.238  -5.159   7.380
  347   HD21  LEU  52          1HD2      LEU  52  -1.317  -5.578  10.564
  348   HD22  LEU  52          2HD2      LEU  52   0.336  -6.194  10.528
  349   HD23  LEU  52          3HD2      LEU  52  -0.805  -6.655   9.264
  350    H    TRP  53           H        TRP  53   3.157  -4.872  12.687
  351    HA   TRP  53           HA       TRP  53   5.388  -3.102  12.259
  352    HB2  TRP  53           1HB      TRP  53   5.602  -5.554  13.955
  353    HB3  TRP  53           2HB      TRP  53   6.262  -3.943  14.226
  354    HD1  TRP  53           HD       TRP  53   2.954  -5.894  14.530
  355    HE1  TRP  53           1HE      TRP  53   1.454  -4.678  16.232
  356    HE3  TRP  53           3HE      TRP  53   5.836  -1.749  15.337
  357    HZ2  TRP  53           2HZ      TRP  53   1.487  -2.278  17.719
  358    HZ3  TRP  53           3HZ      TRP  53   5.029  -0.040  16.913
  359    HH2  TRP  53           HH       TRP  53   2.900  -0.301  18.078
  360    HA   PRO  54           HA       PRO  54   7.773  -5.507   9.468
  361    HB2  PRO  54           1HB      PRO  54  10.295  -4.992  10.331
  362    HB3  PRO  54           2HB      PRO  54   9.307  -3.797   9.484
  363    HG2  PRO  54           1HG      PRO  54   9.811  -4.100  12.419
  364    HG3  PRO  54           2HG      PRO  54   9.776  -2.624  11.437
  365    HD2  PRO  54           1HD      PRO  54   7.690  -3.396  12.980
  366    HD3  PRO  54           2HD      PRO  54   7.474  -2.517  11.453
  367    H    GLY  55           H        GLY  55   7.251  -6.466  12.537
  368    HA2  GLY  55           1HA      GLY  55   8.793  -8.940  12.131
  369    HA3  GLY  55           2HA      GLY  55   8.880  -8.110  13.677
  370    H    GLY  56           H        GLY  56   5.937  -8.252  11.793
  371    HA2  GLY  56           1HA      GLY  56   4.844 -10.558  13.048
  372    HA3  GLY  56           2HA      GLY  56   4.320  -9.099  13.877
  373    H    TYR  57           H        TYR  57   4.820  -9.861  10.434
  374    HA   TYR  57           HA       TYR  57   1.994  -9.739   9.891
  375    HB2  TYR  57           1HB      TYR  57   1.844  -7.726   8.799
  376    HB3  TYR  57           2HB      TYR  57   3.049  -7.309  10.013
  377    HD1  TYR  57           2HD      TYR  57   5.512  -7.447   9.334
  378    HD2  TYR  57           1HD      TYR  57   2.322  -7.492   6.520
  379    HE1  TYR  57           2HE      TYR  57   7.078  -6.784   7.558
  380    HE2  TYR  57           1HE      TYR  57   3.879  -6.830   4.735
  381    HH   TYR  57           HH       TYR  57   6.013  -6.479   4.190
  382    H    GLU  58           H        GLU  58   1.564  -9.982   7.512
  383    HA   GLU  58           HA       GLU  58   3.703 -10.913   5.842
  384    HB2  GLU  58           1HB      GLU  58   1.929 -12.837   7.269
  385    HB3  GLU  58           2HB      GLU  58   2.360 -13.193   5.602
  386    HG2  GLU  58           1HG      GLU  58   4.148 -12.956   7.990
  387    HG3  GLU  58           2HG      GLU  58   3.953 -14.312   6.881
  388    H    GLN  59           H        GLN  59   3.017 -11.377   3.681
  389    HA   GLN  59           HA       GLN  59   0.470 -10.079   3.035
  390    HB2  GLN  59           1HB      GLN  59   2.500  -9.160   1.989
  391    HB3  GLN  59           2HB      GLN  59   2.827 -10.724   1.255
  392    HG2  GLN  59           1HG      GLN  59   0.627 -10.526   0.076
  393    HG3  GLN  59           2HG      GLN  59   0.534  -8.871   0.675
  394   HE21  GLN  59          1HE2      GLN  59   0.431  -9.165  -1.954
  395   HE22  GLN  59          2HE2      GLN  59   1.914  -8.695  -2.706
  396    H    HIS  60           H        HIS  60  -1.213 -11.240   2.390
  397    HA   HIS  60           HA       HIS  60  -0.979 -14.077   2.017
  398    HB2  HIS  60           1HB      HIS  60  -2.930 -12.821   3.108
  399    HB3  HIS  60           2HB      HIS  60  -3.442 -12.429   1.469
  400    HD1  HIS  60           1HD      HIS  60  -4.956 -14.077   0.409
  401    HD2  HIS  60           2HD      HIS  60  -2.749 -15.762   3.500
  402    HE1  HIS  60           1HE      HIS  60  -5.822 -16.426   0.651
  403    HA   PRO  61           HA       PRO  61  -0.250 -13.858  -2.358
  404    HB2  PRO  61           1HB      PRO  61  -0.419 -16.527  -2.826
  405    HB3  PRO  61           2HB      PRO  61   0.995 -15.769  -2.084
  406    HG2  PRO  61           1HG      PRO  61  -1.278 -17.220  -0.783
  407    HG3  PRO  61           2HG      PRO  61   0.459 -17.324  -0.440
  408    HD2  PRO  61           1HD      PRO  61  -1.241 -15.861   1.077
  409    HD3  PRO  61           2HD      PRO  61   0.453 -15.395   0.822
  410    H    GLY  62           H        GLY  62  -3.082 -14.997  -0.783
  411    HA2  GLY  62           1HA      GLY  62  -4.597 -15.917  -2.959
  412    HA3  GLY  62           2HA      GLY  62  -5.256 -15.240  -1.477
  413    H    ASP  63           H        ASP  63  -5.515 -12.923  -1.344
  414    HA   ASP  63           HA       ASP  63  -6.471 -11.833  -3.827
  415    HB2  ASP  63           1HB      ASP  63  -7.506 -11.540  -1.483
  416    HB3  ASP  63           2HB      ASP  63  -6.265 -10.315  -1.237
  417    H    GLY  64           H        GLY  64  -3.834 -11.121  -1.571
  418    HA2  GLY  64           1HA      GLY  64  -1.704 -10.412  -2.524
  419    HA3  GLY  64           2HA      GLY  64  -2.615  -9.466  -3.691
  420    H    HIS  65           H        HIS  65  -3.288  -9.650  -0.240
  421    HA   HIS  65           HA       HIS  65  -2.512  -6.815  -0.017
  422    HB2  HIS  65           1HB      HIS  65  -4.868  -8.302   1.115
  423    HB3  HIS  65           2HB      HIS  65  -4.286  -6.822   1.872
  424    HD1  HIS  65           1HD      HIS  65  -4.393  -4.631   0.360
  425    HD2  HIS  65           2HD      HIS  65  -6.435  -7.939  -1.106
  426    HE1  HIS  65           1HE      HIS  65  -5.941  -3.736  -1.409
  427    H    PHE  66           H        PHE  66  -2.498  -6.323   2.558
  428    HA   PHE  66           HA       PHE  66  -0.606  -8.280   3.683
  429    HB2  PHE  66           1HB      PHE  66  -0.751  -5.279   3.966
  430    HB3  PHE  66           2HB      PHE  66   0.231  -6.285   5.026
  431    HD1  PHE  66           1HD      PHE  66   2.134  -7.562   4.101
  432    HD2  PHE  66           2HD      PHE  66  -0.062  -4.768   1.758
  433    HE1  PHE  66           1HE      PHE  66   3.968  -7.500   2.462
  434    HE2  PHE  66           2HE      PHE  66   1.769  -4.702   0.115
  435    HZ   PHE  66           HZ       PHE  66   3.786  -6.070   0.465
  436    H    TYR  67           H        TYR  67  -1.241  -9.331   5.437
  437    HA   TYR  67           HA       TYR  67  -3.215  -8.062   7.213
  438    HB2  TYR  67           1HB      TYR  67  -3.178 -11.007   6.543
  439    HB3  TYR  67           2HB      TYR  67  -4.386 -10.142   7.486
  440    HD1  TYR  67           2HD      TYR  67  -2.930 -10.372   4.070
  441    HD2  TYR  67           1HD      TYR  67  -6.279  -9.252   6.443
  442    HE1  TYR  67           2HE      TYR  67  -4.245  -9.996   2.026
  443    HE2  TYR  67           1HE      TYR  67  -7.604  -8.874   4.405
  444    HH   TYR  67           HH       TYR  67  -7.489  -9.807   1.936
  445    H    CYS  68           H        CYS  68  -3.214  -8.907   9.416
  446    HA   CYS  68           HA       CYS  68  -0.573  -9.133  10.443
  447    HB2  CYS  68           1HB      CYS  68  -1.626  -9.270  12.625
  448    HB3  CYS  68           2HB      CYS  68  -2.431  -8.033  11.664
  449    H    LEU  69           H        LEU  69  -0.048 -10.889  12.103
  450    HA   LEU  69           HA       LEU  69  -0.185 -13.425  10.747
  451    HB2  LEU  69           1HB      LEU  69   0.997 -12.863  13.455
  452    HB3  LEU  69           2HB      LEU  69   1.371 -14.203  12.373
  453    HG   LEU  69           HG       LEU  69   2.116 -11.304  12.004
  454   HD11  LEU  69          1HD1      LEU  69   3.724 -13.799  12.524
  455   HD12  LEU  69          2HD1      LEU  69   3.533 -12.408  13.590
  456   HD13  LEU  69          3HD1      LEU  69   4.416 -12.240  12.073
  457   HD21  LEU  69          1HD2      LEU  69   2.649 -13.642  10.174
  458   HD22  LEU  69          2HD2      LEU  69   3.211 -11.985   9.952
  459   HD23  LEU  69          3HD2      LEU  69   1.487 -12.352   9.867
  460    H    GLN  70           H        GLN  70  -2.543 -12.065  12.220
  461    HA   GLN  70           HA       GLN  70  -3.367 -14.478  13.693
  462    HB2  GLN  70           1HB      GLN  70  -2.975 -12.678  15.281
  463    HB3  GLN  70           2HB      GLN  70  -4.009 -11.599  14.354
  464    HG2  GLN  70           1HG      GLN  70  -5.939 -12.982  14.854
  465    HG3  GLN  70           2HG      GLN  70  -4.915 -14.115  15.735
  466   HE21  GLN  70          1HE2      GLN  70  -6.733 -13.452  17.295
  467   HE22  GLN  70          2HE2      GLN  70  -6.350 -12.157  18.373
  468    H    HIS  71           H        HIS  71  -3.963 -12.373  11.140
  469    HA   HIS  71           HA       HIS  71  -6.716 -13.392  10.874
  470    HB2  HIS  71           1HB      HIS  71  -5.587 -10.672  10.309
  471    HB3  HIS  71           2HB      HIS  71  -6.980 -11.248   9.399
  472    HD2  HIS  71           2HD      HIS  71  -7.712 -12.671  12.675
  473    HE1  HIS  71           1HE      HIS  71  -9.070  -8.666  13.013
  474    HE2  HIS  71           2HE      HIS  71  -9.060 -10.955  14.064
  475    H    LEU  72           H        LEU  72  -3.607 -13.000   9.467
  476    HA   LEU  72           HA       LEU  72  -4.020 -13.123   6.765
  477    HB2  LEU  72           1HB      LEU  72  -1.828 -13.067   8.018
  478    HB3  LEU  72           2HB      LEU  72  -1.980 -14.814   8.191
  479    HG   LEU  72           HG       LEU  72  -2.199 -14.683   5.550
  480   HD11  LEU  72          1HD1      LEU  72  -0.944 -12.107   6.366
  481   HD12  LEU  72          2HD1      LEU  72  -2.058 -12.451   5.044
  482   HD13  LEU  72          3HD1      LEU  72  -0.365 -12.926   4.916
  483   HD21  LEU  72          1HD2      LEU  72   0.468 -14.432   6.931
  484   HD22  LEU  72          2HD2      LEU  72   0.121 -15.250   5.407
  485   HD23  LEU  72          3HD2      LEU  72  -0.508 -15.901   6.922
  486    HA   PRO  73           HA       PRO  73  -6.427 -16.897   6.497
  487    HB2  PRO  73           1HB      PRO  73  -6.991 -16.630   3.855
  488    HB3  PRO  73           2HB      PRO  73  -7.847 -15.734   5.115
  489    HG2  PRO  73           1HG      PRO  73  -5.604 -14.839   3.346
  490    HG3  PRO  73           2HG      PRO  73  -7.075 -13.967   3.815
  491    HD2  PRO  73           1HD      PRO  73  -4.677 -13.513   4.986
  492    HD3  PRO  73           2HD      PRO  73  -6.213 -13.358   5.863
  493    H    GLN  74           H        GLN  74  -6.400 -18.755   4.855
  494    HA   GLN  74           HA       GLN  74  -3.861 -19.145   3.505
  495    HB2  GLN  74           1HB      GLN  74  -4.619 -20.521   6.029
  496    HB3  GLN  74           2HB      GLN  74  -3.857 -21.496   4.780
  497    HG2  GLN  74           1HG      GLN  74  -2.732 -19.028   6.080
  498    HG3  GLN  74           2HG      GLN  74  -2.188 -20.690   6.303
  499   HE21  GLN  74          1HE2      GLN  74  -1.879 -17.853   4.489
  500   HE22  GLN  74          2HE2      GLN  74  -0.802 -18.452   3.278
  501    H    THR  75           H        THR  75  -4.551 -19.737   1.558
  502    HA   THR  75           HA       THR  75  -6.914 -20.650   0.687
  503    HB   THR  75           HB       THR  75  -5.778 -21.821  -1.162
  504    HG1  THR  75           1HG      THR  75  -3.354 -21.230   0.210
  505   HG21  THR  75          1HG2      THR  75  -5.137 -19.885  -2.138
  506   HG22  THR  75          2HG2      THR  75  -4.030 -19.471  -0.829
  507   HG23  THR  75          3HG2      THR  75  -5.757 -19.164  -0.653
  508    H    ASP  76           H        ASP  76  -8.212 -22.228   1.330
  509    HA   ASP  76           HA       ASP  76  -7.085 -24.626   2.559
  510    HB2  ASP  76           1HB      ASP  76  -9.769 -23.312   2.568
  511    HB3  ASP  76           2HB      ASP  76  -9.676 -25.043   2.884
  512    H    SER  77           H        SER  77  -6.598 -24.487  -0.149
  513    HA   SER  77           HA       SER  77  -8.551 -25.762  -1.746
  514    HB2  SER  77           1HB      SER  77  -6.697 -26.150  -3.334
  515    HB3  SER  77           2HB      SER  77  -6.709 -24.491  -2.736
  516    HG   SER  77           HG       SER  77  -4.729 -24.866  -2.168
  517    H    GLY  78           H        GLY  78  -8.702 -27.910  -2.456
  518    HA2  GLY  78           1HA      GLY  78  -7.255 -30.100  -2.144
  519    HA3  GLY  78           2HA      GLY  78  -7.765 -29.848  -0.481
  520    HA   PRO  79           HA       PRO  79 -11.791 -30.738  -3.021
  521    HB2  PRO  79           1HB      PRO  79 -11.440 -31.606  -5.569
  522    HB3  PRO  79           2HB      PRO  79 -11.620 -29.898  -5.152
  523    HG2  PRO  79           1HG      PRO  79  -9.127 -31.460  -5.709
  524    HG3  PRO  79           2HG      PRO  79  -9.574 -29.833  -6.256
  525    HD2  PRO  79           1HD      PRO  79  -7.889 -30.260  -4.180
  526    HD3  PRO  79           2HD      PRO  79  -8.977 -28.859  -4.254
  527    H    SER  80           H        SER  80  -9.066 -32.720  -4.192
  528    HA   SER  80           HA       SER  80 -10.058 -35.012  -2.739
  529    HB2  SER  80           1HB      SER  80 -10.031 -36.453  -4.827
  530    HB3  SER  80           2HB      SER  80 -11.379 -35.322  -4.705
  531    HG   SER  80           HG       SER  80 -10.618 -34.217  -6.350
  532    H    SER  81           H        SER  81  -8.475 -36.489  -2.283
  533    HA   SER  81           HA       SER  81  -5.834 -35.718  -2.237
  534    HB2  SER  81           1HB      SER  81  -5.290 -37.978  -1.614
  535    HB3  SER  81           2HB      SER  81  -6.869 -37.599  -0.925
  536    HG   SER  81           HG       SER  81  -7.600 -38.588  -3.080
  537    H    GLY  82           H        GLY  82  -4.446 -35.337  -3.823
  538    HA2  GLY  82           1HA      GLY  82  -3.363 -36.963  -5.633
  539    HA3  GLY  82           2HA      GLY  82  -4.863 -36.537  -6.444
  Start of MODEL    8
    1    H1   GLY   1           H        GLY   1   8.822  13.701 -42.134
    2    HA2  GLY   1           1HA      GLY   1   9.047  11.736 -40.169
    3    HA3  GLY   1           2HA      GLY   1  10.174  13.016 -39.745
    4    H    SER   2           H        SER   2   6.802  12.191 -40.205
    5    HA   SER   2           HA       SER   2   6.039  14.219 -38.288
    6    HB2  SER   2           1HB      SER   2   4.965  14.277 -41.118
    7    HB3  SER   2           2HB      SER   2   4.319  15.220 -39.775
    8    HG   SER   2           HG       SER   2   5.884  16.592 -40.026
    9    H    SER   3           H        SER   3   4.970  12.958 -36.909
   10    HA   SER   3           HA       SER   3   2.473  11.829 -37.560
   11    HB2  SER   3           1HB      SER   3   3.786  10.096 -38.667
   12    HB3  SER   3           2HB      SER   3   4.734   9.847 -37.201
   13    HG   SER   3           HG       SER   3   2.722   9.253 -36.174
   14    H    GLY   4           H        GLY   4   1.323  11.180 -35.735
   15    HA2  GLY   4           1HA      GLY   4   0.760  11.343 -33.510
   16    HA3  GLY   4           2HA      GLY   4   2.260  10.462 -33.256
   17    H    SER   5           H        SER   5   0.782  13.640 -33.390
   18    HA   SER   5           HA       SER   5   3.066  14.681 -31.849
   19    HB2  SER   5           1HB      SER   5   2.680  15.492 -34.342
   20    HB3  SER   5           2HB      SER   5   1.475  16.528 -33.578
   21    HG   SER   5           HG       SER   5   3.201  17.744 -33.323
   22    H    SER   6           H        SER   6   0.817  13.541 -30.672
   23    HA   SER   6           HA       SER   6  -0.304  15.882 -29.314
   24    HB2  SER   6           1HB      SER   6  -1.839  13.723 -30.708
   25    HB3  SER   6           2HB      SER   6  -2.507  14.431 -29.237
   26    HG   SER   6           HG       SER   6  -1.562  16.104 -31.287
   27    H    GLY   7           H        GLY   7  -1.559  15.129 -27.294
   28    HA2  GLY   7           1HA      GLY   7  -1.681  13.866 -25.354
   29    HA3  GLY   7           2HA      GLY   7  -0.718  12.624 -26.142
   30    H    GLN   8           H        GLN   8  -0.441  13.580 -23.444
   31    HA   GLN   8           HA       GLN   8   2.389  14.055 -23.457
   32    HB2  GLN   8           1HB      GLN   8   2.340  16.145 -22.184
   33    HB3  GLN   8           2HB      GLN   8   1.587  16.347 -23.760
   34    HG2  GLN   8           1HG      GLN   8  -0.596  16.315 -22.806
   35    HG3  GLN   8           2HG      GLN   8   0.043  15.852 -21.229
   36   HE21  GLN   8          1HE2      GLN   8  -0.856  17.621 -20.202
   37   HE22  GLN   8          2HE2      GLN   8  -0.251  19.225 -20.415
   38    H    HIS   9           H        HIS   9   3.364  13.654 -21.451
   39    HA   HIS   9           HA       HIS   9   1.559  12.707 -19.328
   40    HB2  HIS   9           1HB      HIS   9   4.176  11.354 -19.948
   41    HB3  HIS   9           2HB      HIS   9   2.838  10.756 -18.971
   42    HD1  HIS   9           1HD      HIS   9   0.787   9.780 -20.243
   43    HD2  HIS   9           2HD      HIS   9   3.955  10.903 -22.685
   44    HE1  HIS   9           1HE      HIS   9   0.309   8.744 -22.484
   45    H    GLN  10           H        GLN  10   1.960  13.545 -17.386
   46    HA   GLN  10           HA       GLN  10   4.545  14.895 -16.971
   47    HB2  GLN  10           1HB      GLN  10   2.724  16.482 -16.987
   48    HB3  GLN  10           2HB      GLN  10   1.820  15.518 -15.827
   49    HG2  GLN  10           1HG      GLN  10   3.225  16.095 -14.065
   50    HG3  GLN  10           2HG      GLN  10   4.512  16.629 -15.144
   51   HE21  GLN  10          1HE2      GLN  10   4.597  18.709 -15.737
   52   HE22  GLN  10          2HE2      GLN  10   3.423  19.904 -15.316
   53    H    GLU  11           H        GLU  11   5.649  14.603 -15.052
   54    HA   GLU  11           HA       GLU  11   4.997  12.164 -13.623
   55    HB2  GLU  11           1HB      GLU  11   7.341  12.921 -14.438
   56    HB3  GLU  11           2HB      GLU  11   7.338  13.942 -13.007
   57    HG2  GLU  11           1HG      GLU  11   7.283  12.105 -11.556
   58    HG3  GLU  11           2HG      GLU  11   6.819  10.995 -12.845
   59    H    ALA  12           H        ALA  12   5.411  12.202 -11.180
   60    HA   ALA  12           HA       ALA  12   3.795  14.374 -10.056
   61    HB1  ALA  12           1HB      ALA  12   4.209  12.436  -8.085
   62    HB2  ALA  12           2HB      ALA  12   2.751  12.696  -9.042
   63    HB3  ALA  12           3HB      ALA  12   3.967  11.541  -9.586
   64    H    GLY  13           H        GLY  13   6.534  14.883 -10.687
   65    HA2  GLY  13           1HA      GLY  13   8.463  15.723  -9.759
   66    HA3  GLY  13           2HA      GLY  13   7.403  16.251  -8.460
   67    H    ALA  14           H        ALA  14   7.488  15.246  -6.511
   68    HA   ALA  14           HA       ALA  14   9.723  13.479  -6.056
   69    HB1  ALA  14           1HB      ALA  14   8.008  13.834  -3.762
   70    HB2  ALA  14           2HB      ALA  14   9.685  14.328  -4.002
   71    HB3  ALA  14           3HB      ALA  14   8.371  15.378  -4.535
   72    H    GLY  15           H        GLY  15   9.499  11.387  -6.543
   73    HA2  GLY  15           1HA      GLY  15   6.922  10.075  -6.382
   74    HA3  GLY  15           2HA      GLY  15   8.429   9.357  -6.931
   75    H    ASP  16           H        ASP  16   7.873  10.998  -3.856
   76    HA   ASP  16           HA       ASP  16   8.233   8.412  -2.491
   77    HB2  ASP  16           1HB      ASP  16  10.194  10.176  -2.498
   78    HB3  ASP  16           2HB      ASP  16   9.226  10.940  -1.240
   79    H    LEU  17           H        LEU  17   5.755   8.818  -2.782
   80    HA   LEU  17           HA       LEU  17   4.808  10.108  -0.310
   81    HB2  LEU  17           1HB      LEU  17   3.054   9.948  -2.716
   82    HB3  LEU  17           2HB      LEU  17   2.998  11.073  -1.360
   83    HG   LEU  17           HG       LEU  17   5.132  11.132  -3.488
   84   HD11  LEU  17          1HD1      LEU  17   3.856  13.140  -4.307
   85   HD12  LEU  17          2HD1      LEU  17   2.507  12.591  -3.314
   86   HD13  LEU  17          3HD1      LEU  17   3.103  11.577  -4.627
   87   HD21  LEU  17          1HD2      LEU  17   5.485  13.412  -2.621
   88   HD22  LEU  17          2HD2      LEU  17   5.789  12.172  -1.405
   89   HD23  LEU  17          3HD2      LEU  17   4.289  13.100  -1.363
   90    H    CYS  18           H        CYS  18   3.498   8.918   0.952
   91    HA   CYS  18           HA       CYS  18   3.346   6.230   0.934
   92    HB2  CYS  18           1HB      CYS  18   2.515   7.461   2.818
   93    HB3  CYS  18           2HB      CYS  18   1.229   8.178   1.853
   94    H    ALA  19           H        ALA  19   1.628   4.692   0.439
   95    HA   ALA  19           HA       ALA  19   0.495   5.232  -2.200
   96    HB1  ALA  19           1HB      ALA  19   1.023   3.123  -2.636
   97    HB2  ALA  19           2HB      ALA  19   1.690   2.976  -1.010
   98    HB3  ALA  19           3HB      ALA  19   0.003   2.561  -1.311
   99    H    LEU  20           H        LEU  20  -0.483   4.303   1.060
  100    HA   LEU  20           HA       LEU  20  -3.170   3.741   0.579
  101    HB2  LEU  20           1HB      LEU  20  -1.554   4.549   2.914
  102    HB3  LEU  20           2HB      LEU  20  -3.291   4.815   3.042
  103    HG   LEU  20           HG       LEU  20  -3.361   2.281   2.260
  104   HD11  LEU  20          1HD1      LEU  20  -0.740   2.450   2.217
  105   HD12  LEU  20          2HD1      LEU  20  -1.547   0.988   2.784
  106   HD13  LEU  20          3HD1      LEU  20  -0.912   2.151   3.947
  107   HD21  LEU  20          1HD2      LEU  20  -2.680   2.268   5.054
  108   HD22  LEU  20          2HD2      LEU  20  -4.252   2.058   4.281
  109   HD23  LEU  20          3HD2      LEU  20  -3.666   3.677   4.663
  110    H    CYS  21           H        CYS  21  -2.105   6.725   2.197
  111    HA   CYS  21           HA       CYS  21  -4.452   8.120   1.287
  112    HB2  CYS  21           1HB      CYS  21  -3.414  10.062   2.497
  113    HB3  CYS  21           2HB      CYS  21  -3.662   8.631   3.493
  114    H    GLY  22           H        GLY  22  -0.944   8.523   0.787
  115    HA2  GLY  22           1HA      GLY  22  -0.064   8.938  -1.418
  116    HA3  GLY  22           2HA      GLY  22  -1.567   9.759  -1.814
  117    H    GLU  23           H        GLU  23   0.317  10.208   1.131
  118    HA   GLU  23           HA       GLU  23   0.723  13.011   0.335
  119    HB2  GLU  23           1HB      GLU  23   0.601  11.754   3.081
  120    HB3  GLU  23           2HB      GLU  23   0.979  13.444   2.779
  121    HG2  GLU  23           1HG      GLU  23  -1.240  13.669   1.671
  122    HG3  GLU  23           2HG      GLU  23  -1.607  12.026   2.194
  123    H    HIS  24           H        HIS  24   2.693  13.990   1.577
  124    HA   HIS  24           HA       HIS  24   5.018  12.886   0.504
  125    HB2  HIS  24           1HB      HIS  24   4.471  15.280   1.499
  126    HB3  HIS  24           2HB      HIS  24   5.206  14.595   2.945
  127    HD1  HIS  24           1HD      HIS  24   7.737  13.822   2.705
  128    HD2  HIS  24           2HD      HIS  24   6.235  16.059  -0.457
  129    HE1  HIS  24           1HE      HIS  24   9.751  14.598   1.415
  130    H    LEU  25           H        LEU  25   6.843  11.910   1.513
  131    HA   LEU  25           HA       LEU  25   6.162  10.376   3.936
  132    HB2  LEU  25           1HB      LEU  25   7.702   9.603   1.480
  133    HB3  LEU  25           2HB      LEU  25   7.889   8.729   2.999
  134    HG   LEU  25           HG       LEU  25   5.164   9.069   1.820
  135   HD11  LEU  25          1HD1      LEU  25   5.723   6.709   0.814
  136   HD12  LEU  25          2HD1      LEU  25   7.364   7.353   0.783
  137   HD13  LEU  25          3HD1      LEU  25   6.074   8.185  -0.085
  138   HD21  LEU  25          1HD2      LEU  25   5.739   6.503   2.906
  139   HD22  LEU  25          2HD2      LEU  25   4.626   7.733   3.506
  140   HD23  LEU  25          3HD2      LEU  25   6.309   7.732   4.036
  141    H    TYR  26           H        TYR  26   8.307   9.461   4.941
  142    HA   TYR  26           HA       TYR  26  10.366  11.557   4.944
  143    HB2  TYR  26           1HB      TYR  26   8.668  11.702   6.887
  144    HB3  TYR  26           2HB      TYR  26   9.461  10.255   7.502
  145    HD1  TYR  26           1HD      TYR  26  10.354  13.658   6.231
  146    HD2  TYR  26           2HD      TYR  26  11.197  10.535   8.996
  147    HE1  TYR  26           1HE      TYR  26  12.083  15.060   7.278
  148    HE2  TYR  26           2HE      TYR  26  12.927  11.929  10.051
  149    HH   TYR  26           HH       TYR  26  13.205  14.813  10.075
  150    H    VAL  27           H        VAL  27  12.235  10.699   6.507
  151    HA   VAL  27           HA       VAL  27  13.221   8.325   5.235
  152    HB   VAL  27           HB       VAL  27  14.431   9.876   7.528
  153   HG11  VAL  27          1HG1      VAL  27  15.183   7.453   6.919
  154   HG12  VAL  27          2HG1      VAL  27  15.975   8.249   5.557
  155   HG13  VAL  27          3HG1      VAL  27  16.390   8.705   7.210
  156   HG21  VAL  27          1HG2      VAL  27  15.152  10.117   4.620
  157   HG22  VAL  27          2HG2      VAL  27  13.954  11.161   5.386
  158   HG23  VAL  27          3HG2      VAL  27  15.623  11.166   5.957
  159    H    LEU  28           H        LEU  28  12.570   9.181   8.637
  160    HA   LEU  28           HA       LEU  28  12.697   6.378   9.393
  161    HB2  LEU  28           1HB      LEU  28  12.247   8.885  11.001
  162    HB3  LEU  28           2HB      LEU  28  12.308   7.264  11.689
  163    HG   LEU  28           HG       LEU  28  14.605   8.498  10.182
  164   HD11  LEU  28          1HD1      LEU  28  14.690   8.291  13.127
  165   HD12  LEU  28          2HD1      LEU  28  13.698   9.582  12.452
  166   HD13  LEU  28          3HD1      LEU  28  15.412   9.484  12.048
  167   HD21  LEU  28          1HD2      LEU  28  14.853   6.164  10.257
  168   HD22  LEU  28          2HD2      LEU  28  14.251   6.067  11.912
  169   HD23  LEU  28          3HD2      LEU  28  15.837   6.769  11.589
  170    H    GLU  29           H        GLU  29  10.530   7.423   7.660
  171    HA   GLU  29           HA       GLU  29   8.281   6.475   9.296
  172    HB2  GLU  29           1HB      GLU  29   8.134   8.781   7.346
  173    HB3  GLU  29           2HB      GLU  29   6.799   8.128   8.285
  174    HG2  GLU  29           1HG      GLU  29   8.022   8.774  10.352
  175    HG3  GLU  29           2HG      GLU  29   9.223   9.566   9.334
  176    H    ARG  30           H        ARG  30   9.300   7.268   5.976
  177    HA   ARG  30           HA       ARG  30   7.456   5.889   4.515
  178    HB2  ARG  30           1HB      ARG  30   9.023   5.807   2.739
  179    HB3  ARG  30           2HB      ARG  30   9.412   7.253   3.661
  180    HG2  ARG  30           1HG      ARG  30  11.115   5.732   4.874
  181    HG3  ARG  30           2HG      ARG  30  10.905   4.673   3.479
  182    HD2  ARG  30           1HD      ARG  30  11.751   6.265   1.995
  183    HD3  ARG  30           2HD      ARG  30  11.509   7.588   3.134
  184    HE   ARG  30           HE       ARG  30  13.320   6.088   4.413
  185   HH11  ARG  30          2HH1      ARG  30  13.166   7.232   1.128
  186   HH12  ARG  30          1HH1      ARG  30  14.886   7.315   0.938
  187   HH21  ARG  30          2HH2      ARG  30  15.587   6.193   4.175
  188   HH22  ARG  30          1HH2      ARG  30  16.262   6.723   2.672
  189    H    LEU  31           H        LEU  31   7.162   3.795   3.793
  190    HA   LEU  31           HA       LEU  31   8.651   1.732   5.278
  191    HB2  LEU  31           1HB      LEU  31   5.789   2.063   4.612
  192    HB3  LEU  31           2HB      LEU  31   6.435   0.425   4.526
  193    HG   LEU  31           HG       LEU  31   6.973   1.981   6.997
  194   HD11  LEU  31          1HD1      LEU  31   4.721   2.554   6.883
  195   HD12  LEU  31          2HD1      LEU  31   4.722   1.077   7.845
  196   HD13  LEU  31          3HD1      LEU  31   4.266   1.019   6.142
  197   HD21  LEU  31          1HD2      LEU  31   7.692  -0.429   6.391
  198   HD22  LEU  31          2HD2      LEU  31   6.019  -0.847   6.762
  199   HD23  LEU  31          3HD2      LEU  31   7.039  -0.109   7.998
  200    H    CYS  32           H        CYS  32  10.225   1.194   3.838
  201    HA   CYS  32           HA       CYS  32   9.807   0.938   1.043
  202    HB2  CYS  32           1HB      CYS  32  12.042  -0.202   1.078
  203    HB3  CYS  32           2HB      CYS  32  12.026   1.382   1.843
  204    HG   CYS  32           HG       CYS  32  11.405  -0.921   4.106
  205    H    VAL  33           H        VAL  33   8.039  -0.424   0.724
  206    HA   VAL  33           HA       VAL  33   8.628  -3.276   1.128
  207    HB   VAL  33           HB       VAL  33   5.814  -2.262   1.360
  208   HG11  VAL  33          1HG1      VAL  33   6.235  -4.453   3.012
  209   HG12  VAL  33          2HG1      VAL  33   5.463  -4.460   1.426
  210   HG13  VAL  33          3HG1      VAL  33   7.188  -4.799   1.570
  211   HG21  VAL  33          1HG2      VAL  33   7.971  -2.133   3.400
  212   HG22  VAL  33          2HG2      VAL  33   6.595  -1.061   3.138
  213   HG23  VAL  33          3HG2      VAL  33   6.359  -2.621   3.925
  214    H    ASN  34           H        ASN  34   8.361  -4.492  -0.640
  215    HA   ASN  34           HA       ASN  34   8.069  -4.987  -2.850
  216    HB2  ASN  34           1HB      ASN  34   5.412  -3.815  -2.049
  217    HB3  ASN  34           2HB      ASN  34   5.683  -4.467  -3.662
  218   HD21  ASN  34          1HD2      ASN  34   3.793  -5.458  -1.852
  219   HD22  ASN  34          2HD2      ASN  34   4.247  -7.068  -1.419
  220    H    GLY  35           H        GLY  35   9.545  -2.682  -2.550
  221    HA2  GLY  35           1HA      GLY  35  10.325  -0.906  -3.778
  222    HA3  GLY  35           2HA      GLY  35   9.328  -1.505  -5.096
  223    H    HIS  36           H        HIS  36   7.779  -0.731  -2.113
  224    HA   HIS  36           HA       HIS  36   6.887   1.847  -3.217
  225    HB2  HIS  36           1HB      HIS  36   5.148  -0.234  -1.876
  226    HB3  HIS  36           2HB      HIS  36   4.616   1.374  -2.357
  227    HD1  HIS  36           1HD      HIS  36   5.568   1.641  -5.165
  228    HD2  HIS  36           2HD      HIS  36   4.068  -1.934  -3.671
  229    HE1  HIS  36           1HE      HIS  36   4.808   0.338  -7.177
  230    H    PHE  37           H        PHE  37   6.020   3.337  -1.599
  231    HA   PHE  37           HA       PHE  37   7.235   2.893   1.049
  232    HB2  PHE  37           1HB      PHE  37   6.946   5.453  -0.532
  233    HB3  PHE  37           2HB      PHE  37   7.439   5.399   1.157
  234    HD1  PHE  37           2HD      PHE  37   9.479   3.831   1.667
  235    HD2  PHE  37           1HD      PHE  37   8.563   5.445  -2.163
  236    HE1  PHE  37           2HE      PHE  37  11.818   3.506   0.975
  237    HE2  PHE  37           1HE      PHE  37  10.900   5.122  -2.862
  238    HZ   PHE  37           HZ       PHE  37  12.531   4.153  -1.292
  239    H    PHE  38           H        PHE  38   5.935   2.997   2.766
  240    HA   PHE  38           HA       PHE  38   3.318   4.307   2.477
  241    HB2  PHE  38           1HB      PHE  38   3.747   1.703   3.948
  242    HB3  PHE  38           2HB      PHE  38   2.214   2.504   3.622
  243    HD1  PHE  38           1HD      PHE  38   4.994   0.620   2.121
  244    HD2  PHE  38           2HD      PHE  38   1.106   2.249   1.536
  245    HE1  PHE  38           1HE      PHE  38   4.769  -0.673   0.039
  246    HE2  PHE  38           2HE      PHE  38   0.874   0.958  -0.545
  247    HZ   PHE  38           HZ       PHE  38   2.707  -0.506  -1.296
  248    H    HIS  39           H        HIS  39   2.304   4.858   4.557
  249    HA   HIS  39           HA       HIS  39   4.265   5.989   6.347
  250    HB2  HIS  39           1HB      HIS  39   1.248   6.116   6.270
  251    HB3  HIS  39           2HB      HIS  39   2.216   6.909   7.510
  252    HD2  HIS  39           2HD      HIS  39   4.427   8.444   5.813
  253    HE1  HIS  39           1HE      HIS  39   1.221   9.893   3.442
  254    HE2  HIS  39           2HE      HIS  39   3.655  10.156   4.034
  255    H    ARG  40           H        ARG  40   4.853   5.249   8.295
  256    HA   ARG  40           HA       ARG  40   4.455   2.653   9.112
  257    HB2  ARG  40           1HB      ARG  40   5.251   5.141  10.584
  258    HB3  ARG  40           2HB      ARG  40   5.034   3.633  11.462
  259    HG2  ARG  40           1HG      ARG  40   6.809   3.780   9.056
  260    HG3  ARG  40           2HG      ARG  40   7.385   4.250  10.656
  261    HD2  ARG  40           1HD      ARG  40   6.237   1.568   9.889
  262    HD3  ARG  40           2HD      ARG  40   7.939   1.927  10.176
  263    HE   ARG  40           HE       ARG  40   5.966   1.369  12.140
  264   HH11  ARG  40          2HH1      ARG  40   8.810   3.284  11.537
  265   HH12  ARG  40          1HH1      ARG  40   9.253   3.390  13.208
  266   HH21  ARG  40          2HH2      ARG  40   6.538   1.501  14.344
  267   HH22  ARG  40          1HH2      ARG  40   7.960   2.374  14.804
  268    H    SER  41           H        SER  41   2.271   5.260   9.304
  269    HA   SER  41           HA       SER  41   0.692   4.034  11.432
  270    HB2  SER  41           1HB      SER  41   1.044   6.507  11.390
  271    HB3  SER  41           2HB      SER  41   0.137   6.573   9.880
  272    HG   SER  41           HG       SER  41  -0.932   5.431  12.236
  273    H    CYS  42           H        CYS  42   0.381   4.944   8.016
  274    HA   CYS  42           HA       CYS  42  -2.234   4.032   7.620
  275    HB2  CYS  42           1HB      CYS  42   0.104   4.564   5.843
  276    HB3  CYS  42           2HB      CYS  42  -1.264   3.681   5.174
  277    H    PHE  43           H        PHE  43   0.836   2.374   6.880
  278    HA   PHE  43           HA       PHE  43  -0.148  -0.031   5.993
  279    HB2  PHE  43           1HB      PHE  43   2.293   0.774   6.200
  280    HB3  PHE  43           2HB      PHE  43   2.240   0.091   7.821
  281    HD1  PHE  43           2HD      PHE  43   0.916  -1.084   4.538
  282    HD2  PHE  43           1HD      PHE  43   3.451  -1.857   7.869
  283    HE1  PHE  43           2HE      PHE  43   1.447  -3.302   3.615
  284    HE2  PHE  43           1HE      PHE  43   3.986  -4.076   6.951
  285    HZ   PHE  43           HZ       PHE  43   2.983  -4.802   4.822
  286    H    ARG  44           H        ARG  44  -1.972  -0.745   7.053
  287    HA   ARG  44           HA       ARG  44  -1.490  -1.926   9.694
  288    HB2  ARG  44           1HB      ARG  44  -3.960  -0.357   8.932
  289    HB3  ARG  44           2HB      ARG  44  -3.736  -1.240  10.436
  290    HG2  ARG  44           1HG      ARG  44  -1.958   0.238  11.099
  291    HG3  ARG  44           2HG      ARG  44  -2.021   1.065   9.541
  292    HD2  ARG  44           1HD      ARG  44  -4.174   1.957  10.008
  293    HD3  ARG  44           2HD      ARG  44  -4.362   0.926  11.427
  294    HE   ARG  44           HE       ARG  44  -2.118   2.723  11.571
  295   HH11  ARG  44          2HH1      ARG  44  -5.523   2.322  12.173
  296   HH12  ARG  44          1HH1      ARG  44  -5.588   3.561  13.382
  297   HH21  ARG  44          2HH2      ARG  44  -2.190   4.356  13.161
  298   HH22  ARG  44          1HH2      ARG  44  -3.691   4.718  13.943
  299    H    CYS  45           H        CYS  45  -3.321  -3.486  10.264
  300    HA   CYS  45           HA       CYS  45  -3.450  -5.501   8.338
  301    HB2  CYS  45           1HB      CYS  45  -3.760  -5.756  10.831
  302    HB3  CYS  45           2HB      CYS  45  -5.397  -5.144  10.619
  303    H    HIS  46           H        HIS  46  -5.506  -6.472   7.480
  304    HA   HIS  46           HA       HIS  46  -7.140  -4.335   6.303
  305    HB2  HIS  46           1HB      HIS  46  -6.064  -5.653   4.623
  306    HB3  HIS  46           2HB      HIS  46  -6.549  -7.156   5.402
  307    HD1  HIS  46           1HD      HIS  46  -7.642  -4.667   2.937
  308    HD2  HIS  46           2HD      HIS  46  -9.365  -7.741   5.139
  309    HE1  HIS  46           1HE      HIS  46  -9.852  -5.131   1.829
  310    H    THR  47           H        THR  47  -7.263  -6.567   8.741
  311    HA   THR  47           HA       THR  47 -10.201  -6.762   8.563
  312    HB   THR  47           HB       THR  47  -8.207  -8.749   9.638
  313    HG1  THR  47           1HG      THR  47 -10.335  -8.868   7.745
  314   HG21  THR  47          1HG2      THR  47 -11.197  -8.796  10.063
  315   HG22  THR  47          2HG2      THR  47 -10.006  -8.420  11.308
  316   HG23  THR  47          3HG2      THR  47 -10.041 -10.024  10.576
  317    H    CYS  48           H        CYS  48  -7.423  -6.026  10.531
  318    HA   CYS  48           HA       CYS  48  -9.235  -5.076  12.652
  319    HB2  CYS  48           1HB      CYS  48  -7.515  -5.625  14.307
  320    HB3  CYS  48           2HB      CYS  48  -8.002  -7.060  13.412
  321    H    GLU  49           H        GLU  49  -7.179  -4.159  10.275
  322    HA   GLU  49           HA       GLU  49  -5.835  -2.348   9.866
  323    HB2  GLU  49           1HB      GLU  49  -6.861  -0.198  10.576
  324    HB3  GLU  49           2HB      GLU  49  -8.001  -1.292   9.805
  325    HG2  GLU  49           1HG      GLU  49  -8.842  -1.954  12.010
  326    HG3  GLU  49           2HG      GLU  49  -7.720  -0.823  12.765
  327    H    ALA  50           H        ALA  50  -4.709  -3.853  11.854
  328    HA   ALA  50           HA       ALA  50  -3.931  -2.006  13.984
  329    HB1  ALA  50           1HB      ALA  50  -3.011  -4.851  13.724
  330    HB2  ALA  50           2HB      ALA  50  -3.127  -3.854  15.174
  331    HB3  ALA  50           3HB      ALA  50  -4.592  -4.443  14.390
  332    H    THR  51           H        THR  51  -2.002  -1.028  14.070
  333    HA   THR  51           HA       THR  51  -0.368  -0.573  11.970
  334    HB   THR  51           HB       THR  51   0.645  -0.849  14.805
  335    HG1  THR  51           1HG      THR  51  -0.972   1.041  13.544
  336   HG21  THR  51          1HG2      THR  51   2.282  -0.564  12.835
  337   HG22  THR  51          2HG2      THR  51   2.425   0.543  14.201
  338   HG23  THR  51          3HG2      THR  51   1.630   1.070  12.717
  339    H    LEU  52           H        LEU  52   0.325  -2.142  10.627
  340    HA   LEU  52           HA       LEU  52   1.272  -4.679  11.523
  341    HB2  LEU  52           1HB      LEU  52   1.517  -3.317   8.845
  342    HB3  LEU  52           2HB      LEU  52   1.931  -5.000   9.163
  343    HG   LEU  52           HG       LEU  52  -0.827  -3.794   9.376
  344   HD11  LEU  52          1HD1      LEU  52   0.189  -5.783   7.362
  345   HD12  LEU  52          2HD1      LEU  52   0.140  -4.046   7.064
  346   HD13  LEU  52          3HD1      LEU  52  -1.355  -4.931   7.369
  347   HD21  LEU  52          1HD2      LEU  52  -0.771  -6.644   9.233
  348   HD22  LEU  52          2HD2      LEU  52  -1.432  -5.608  10.499
  349   HD23  LEU  52          3HD2      LEU  52   0.257  -6.112  10.564
  350    H    TRP  53           H        TRP  53   3.046  -4.629  12.794
  351    HA   TRP  53           HA       TRP  53   5.239  -2.863  12.388
  352    HB2  TRP  53           1HB      TRP  53   5.476  -5.426  13.931
  353    HB3  TRP  53           2HB      TRP  53   6.209  -3.858  14.261
  354    HD1  TRP  53           HD       TRP  53   2.883  -5.741  14.641
  355    HE1  TRP  53           1HE      TRP  53   1.462  -4.533  16.415
  356    HE3  TRP  53           3HE      TRP  53   5.836  -1.635  15.389
  357    HZ2  TRP  53           2HZ      TRP  53   1.578  -2.155  17.931
  358    HZ3  TRP  53           3HZ      TRP  53   5.109   0.059  17.018
  359    HH2  TRP  53           HH       TRP  53   3.024  -0.197  18.262
  360    HA   PRO  54           HA       PRO  54   7.684  -4.992   9.430
  361    HB2  PRO  54           1HB      PRO  54  10.193  -4.438  10.306
  362    HB3  PRO  54           2HB      PRO  54   9.153  -3.229   9.544
  363    HG2  PRO  54           1HG      PRO  54   9.696  -3.700  12.450
  364    HG3  PRO  54           2HG      PRO  54   9.597  -2.167  11.564
  365    HD2  PRO  54           1HD      PRO  54   7.556  -3.114  13.071
  366    HD3  PRO  54           2HD      PRO  54   7.292  -2.148  11.605
  367    H    GLY  55           H        GLY  55   7.219  -6.170  12.425
  368    HA2  GLY  55           1HA      GLY  55   8.782  -8.582  11.828
  369    HA3  GLY  55           2HA      GLY  55   8.986  -7.823  13.400
  370    H    GLY  56           H        GLY  56   5.941  -8.018  11.646
  371    HA2  GLY  56           1HA      GLY  56   4.969 -10.330  12.991
  372    HA3  GLY  56           2HA      GLY  56   4.425  -8.868  13.801
  373    H    TYR  57           H        TYR  57   4.843  -9.675  10.359
  374    HA   TYR  57           HA       TYR  57   1.999  -9.682   9.906
  375    HB2  TYR  57           1HB      TYR  57   1.772  -7.724   8.664
  376    HB3  TYR  57           2HB      TYR  57   2.813  -7.216   9.989
  377    HD1  TYR  57           2HD      TYR  57   5.382  -7.338   9.520
  378    HD2  TYR  57           1HD      TYR  57   2.405  -7.264   6.481
  379    HE1  TYR  57           2HE      TYR  57   7.059  -6.547   7.904
  380    HE2  TYR  57           1HE      TYR  57   4.074  -6.474   4.856
  381    HH   TYR  57           HH       TYR  57   6.303  -5.200   4.980
  382    H    GLU  58           H        GLU  58   1.486 -10.034   7.578
  383    HA   GLU  58           HA       GLU  58   3.643 -10.928   5.877
  384    HB2  GLU  58           1HB      GLU  58   1.649 -12.871   7.042
  385    HB3  GLU  58           2HB      GLU  58   2.605 -13.217   5.608
  386    HG2  GLU  58           1HG      GLU  58   4.653 -12.990   6.895
  387    HG3  GLU  58           2HG      GLU  58   3.717 -12.589   8.334
  388    H    GLN  59           H        GLN  59   3.047 -11.122   3.720
  389    HA   GLN  59           HA       GLN  59   0.416  -9.997   3.090
  390    HB2  GLN  59           1HB      GLN  59   2.171  -8.732   2.112
  391    HB3  GLN  59           2HB      GLN  59   2.992 -10.177   1.538
  392    HG2  GLN  59           1HG      GLN  59   1.097 -10.585  -0.001
  393    HG3  GLN  59           2HG      GLN  59   0.395  -9.054   0.518
  394   HE21  GLN  59          1HE2      GLN  59   0.545  -8.606  -1.808
  395   HE22  GLN  59          2HE2      GLN  59   2.020  -7.955  -2.427
  396    H    HIS  60           H        HIS  60  -1.123 -11.416   2.631
  397    HA   HIS  60           HA       HIS  60  -0.614 -14.112   1.902
  398    HB2  HIS  60           1HB      HIS  60  -2.683 -13.087   3.084
  399    HB3  HIS  60           2HB      HIS  60  -3.251 -12.741   1.453
  400    HD1  HIS  60           1HD      HIS  60  -4.183 -14.672   0.103
  401    HD2  HIS  60           2HD      HIS  60  -2.501 -15.866   3.710
  402    HE1  HIS  60           1HE      HIS  60  -4.838 -17.084   0.385
  403    HA   PRO  61           HA       PRO  61   0.039 -13.435  -2.440
  404    HB2  PRO  61           1HB      PRO  61   0.168 -16.056  -3.133
  405    HB3  PRO  61           2HB      PRO  61   1.496 -15.208  -2.333
  406    HG2  PRO  61           1HG      PRO  61  -0.581 -17.013  -1.155
  407    HG3  PRO  61           2HG      PRO  61   1.161 -16.947  -0.827
  408    HD2  PRO  61           1HD      PRO  61  -0.674 -15.821   0.815
  409    HD3  PRO  61           2HD      PRO  61   0.953 -15.145   0.595
  410    H    GLY  62           H        GLY  62  -2.312 -15.864  -1.314
  411    HA2  GLY  62           1HA      GLY  62  -3.805 -16.451  -3.447
  412    HA3  GLY  62           2HA      GLY  62  -4.555 -16.046  -1.910
  413    H    ASP  63           H        ASP  63  -4.500 -13.494  -1.575
  414    HA   ASP  63           HA       ASP  63  -5.932 -12.426  -3.888
  415    HB2  ASP  63           1HB      ASP  63  -5.705 -11.100  -1.194
  416    HB3  ASP  63           2HB      ASP  63  -6.956 -10.891  -2.416
  417    H    GLY  64           H        GLY  64  -3.473 -11.313  -1.550
  418    HA2  GLY  64           1HA      GLY  64  -1.389 -10.411  -2.546
  419    HA3  GLY  64           2HA      GLY  64  -2.422  -9.559  -3.685
  420    H    HIS  65           H        HIS  65  -3.156  -9.878  -0.273
  421    HA   HIS  65           HA       HIS  65  -2.667  -6.987   0.031
  422    HB2  HIS  65           1HB      HIS  65  -4.906  -8.735   0.960
  423    HB3  HIS  65           2HB      HIS  65  -4.453  -7.349   1.947
  424    HD1  HIS  65           1HD      HIS  65  -4.194  -5.057   0.241
  425    HD2  HIS  65           2HD      HIS  65  -6.893  -8.064  -0.725
  426    HE1  HIS  65           1HE      HIS  65  -5.862  -3.991  -1.310
  427    H    PHE  66           H        PHE  66  -2.635  -6.479   2.550
  428    HA   PHE  66           HA       PHE  66  -0.667  -8.327   3.730
  429    HB2  PHE  66           1HB      PHE  66  -0.917  -5.326   3.975
  430    HB3  PHE  66           2HB      PHE  66   0.158  -6.297   4.976
  431    HD1  PHE  66           2HD      PHE  66  -0.563  -5.277   1.497
  432    HD2  PHE  66           1HD      PHE  66   2.257  -6.991   4.185
  433    HE1  PHE  66           2HE      PHE  66   1.175  -5.131  -0.238
  434    HE2  PHE  66           1HE      PHE  66   4.000  -6.847   2.454
  435    HZ   PHE  66           HZ       PHE  66   3.459  -5.918   0.238
  436    H    TYR  67           H        TYR  67  -1.301  -9.360   5.494
  437    HA   TYR  67           HA       TYR  67  -3.282  -8.076   7.253
  438    HB2  TYR  67           1HB      TYR  67  -3.220 -11.035   6.650
  439    HB3  TYR  67           2HB      TYR  67  -4.438 -10.154   7.565
  440    HD1  TYR  67           2HD      TYR  67  -3.012 -10.596   4.170
  441    HD2  TYR  67           1HD      TYR  67  -6.289  -9.175   6.483
  442    HE1  TYR  67           2HE      TYR  67  -4.322 -10.285   2.112
  443    HE2  TYR  67           1HE      TYR  67  -7.609  -8.861   4.431
  444    HH   TYR  67           HH       TYR  67  -6.913  -8.442   1.841
  445    H    CYS  68           H        CYS  68  -3.288  -8.951   9.467
  446    HA   CYS  68           HA       CYS  68  -0.631  -9.111  10.490
  447    HB2  CYS  68           1HB      CYS  68  -1.678  -9.225  12.679
  448    HB3  CYS  68           2HB      CYS  68  -2.483  -8.001  11.702
  449    H    LEU  69           H        LEU  69  -0.068 -10.834  12.158
  450    HA   LEU  69           HA       LEU  69  -0.179 -13.389  10.851
  451    HB2  LEU  69           1HB      LEU  69   0.940 -12.838  13.583
  452    HB3  LEU  69           2HB      LEU  69   1.387 -14.121  12.461
  453    HG   LEU  69           HG       LEU  69   2.043 -11.187  12.240
  454   HD11  LEU  69          1HD1      LEU  69   4.373 -12.091  12.257
  455   HD12  LEU  69          2HD1      LEU  69   3.697 -13.667  12.667
  456   HD13  LEU  69          3HD1      LEU  69   3.490 -12.306  13.769
  457   HD21  LEU  69          1HD2      LEU  69   2.818 -13.350  10.297
  458   HD22  LEU  69          2HD2      LEU  69   3.050 -11.608  10.141
  459   HD23  LEU  69          3HD2      LEU  69   1.427 -12.294  10.054
  460    H    GLN  70           H        GLN  70  -2.574 -12.035  12.271
  461    HA   GLN  70           HA       GLN  70  -3.390 -14.431  13.776
  462    HB2  GLN  70           1HB      GLN  70  -3.081 -12.609  15.338
  463    HB3  GLN  70           2HB      GLN  70  -4.070 -11.544  14.348
  464    HG2  GLN  70           1HG      GLN  70  -5.429 -12.212  16.141
  465    HG3  GLN  70           2HG      GLN  70  -5.978 -13.139  14.746
  466   HE21  GLN  70          1HE2      GLN  70  -3.664 -13.371  17.425
  467   HE22  GLN  70          2HE2      GLN  70  -3.947 -15.043  17.751
  468    H    HIS  71           H        HIS  71  -4.054 -12.224  11.260
  469    HA   HIS  71           HA       HIS  71  -6.737 -13.393  10.907
  470    HB2  HIS  71           1HB      HIS  71  -5.701 -10.630  10.350
  471    HB3  HIS  71           2HB      HIS  71  -7.088 -11.257   9.465
  472    HD2  HIS  71           2HD      HIS  71  -7.878 -12.735  12.643
  473    HE1  HIS  71           1HE      HIS  71  -9.087  -8.706  13.190
  474    HE2  HIS  71           2HE      HIS  71  -9.175 -11.048  14.112
  475    H    LEU  72           H        LEU  72  -3.615 -12.958   9.594
  476    HA   LEU  72           HA       LEU  72  -3.985 -13.048   6.867
  477    HB2  LEU  72           1HB      LEU  72  -1.810 -12.857   8.045
  478    HB3  LEU  72           2HB      LEU  72  -1.896 -14.579   8.411
  479    HG   LEU  72           HG       LEU  72  -2.104 -14.724   5.758
  480   HD11  LEU  72          1HD1      LEU  72  -1.136 -12.014   6.317
  481   HD12  LEU  72          2HD1      LEU  72  -1.870 -12.683   4.861
  482   HD13  LEU  72          3HD1      LEU  72  -0.153 -12.931   5.176
  483   HD21  LEU  72          1HD2      LEU  72  -0.272 -15.901   6.177
  484   HD22  LEU  72          2HD2      LEU  72  -0.046 -15.050   7.705
  485   HD23  LEU  72          3HD2      LEU  72   0.664 -14.407   6.224
  486    HA   PRO  73           HA       PRO  73  -6.210 -16.915   6.508
  487    HB2  PRO  73           1HB      PRO  73  -6.641 -16.703   3.835
  488    HB3  PRO  73           2HB      PRO  73  -7.592 -15.819   5.035
  489    HG2  PRO  73           1HG      PRO  73  -5.289 -14.873   3.374
  490    HG3  PRO  73           2HG      PRO  73  -6.811 -14.045   3.751
  491    HD2  PRO  73           1HD      PRO  73  -4.495 -13.494   5.041
  492    HD3  PRO  73           2HD      PRO  73  -6.080 -13.380   5.833
  493    H    GLN  74           H        GLN  74  -6.074 -18.639   4.560
  494    HA   GLN  74           HA       GLN  74  -3.330 -19.018   3.672
  495    HB2  GLN  74           1HB      GLN  74  -4.655 -20.638   5.780
  496    HB3  GLN  74           2HB      GLN  74  -3.709 -21.509   4.580
  497    HG2  GLN  74           1HG      GLN  74  -2.555 -19.155   6.016
  498    HG3  GLN  74           2HG      GLN  74  -2.579 -20.751   6.765
  499   HE21  GLN  74          1HE2      GLN  74  -0.656 -18.725   5.179
  500   HE22  GLN  74          2HE2      GLN  74   0.372 -19.836   4.346
  501    H    THR  75           H        THR  75  -3.313 -21.402   2.594
  502    HA   THR  75           HA       THR  75  -5.382 -21.243   0.552
  503    HB   THR  75           HB       THR  75  -4.029 -22.813  -0.722
  504    HG1  THR  75           1HG      THR  75  -1.826 -22.958   0.775
  505   HG21  THR  75          1HG2      THR  75  -1.956 -20.975   0.364
  506   HG22  THR  75          2HG2      THR  75  -3.408 -20.264  -0.341
  507   HG23  THR  75          3HG2      THR  75  -2.388 -21.328  -1.308
  508    H    ASP  76           H        ASP  76  -6.521 -22.046   2.868
  509    HA   ASP  76           HA       ASP  76  -6.554 -24.763   3.459
  510    HB2  ASP  76           1HB      ASP  76  -7.694 -23.506   5.024
  511    HB3  ASP  76           2HB      ASP  76  -8.506 -22.529   3.803
  512    H    SER  77           H        SER  77  -8.418 -22.946   1.064
  513    HA   SER  77           HA       SER  77  -9.358 -25.510  -0.044
  514    HB2  SER  77           1HB      SER  77 -10.645 -22.778  -0.054
  515    HB3  SER  77           2HB      SER  77 -11.189 -24.092  -1.096
  516    HG   SER  77           HG       SER  77 -12.127 -23.722   1.179
  517    H    GLY  78           H        GLY  78  -9.366 -25.775  -2.311
  518    HA2  GLY  78           1HA      GLY  78  -8.455 -25.612  -4.412
  519    HA3  GLY  78           2HA      GLY  78  -8.550 -23.871  -4.188
  520    HA   PRO  79           HA       PRO  79  -4.161 -25.449  -2.781
  521    HB2  PRO  79           1HB      PRO  79  -3.388 -27.755  -3.987
  522    HB3  PRO  79           2HB      PRO  79  -4.202 -27.718  -2.419
  523    HG2  PRO  79           1HG      PRO  79  -5.343 -28.262  -5.132
  524    HG3  PRO  79           2HG      PRO  79  -5.659 -29.094  -3.599
  525    HD2  PRO  79           1HD      PRO  79  -7.349 -27.245  -4.627
  526    HD3  PRO  79           2HD      PRO  79  -7.136 -27.477  -2.880
  527    H    SER  80           H        SER  80  -5.240 -26.382  -6.041
  528    HA   SER  80           HA       SER  80  -3.019 -24.784  -7.138
  529    HB2  SER  80           1HB      SER  80  -2.905 -27.290  -7.537
  530    HB3  SER  80           2HB      SER  80  -4.345 -27.111  -8.538
  531    HG   SER  80           HG       SER  80  -3.145 -26.340 -10.075
  532    H    SER  81           H        SER  81  -4.277 -22.896  -7.211
  533    HA   SER  81           HA       SER  81  -6.624 -22.952  -8.971
  534    HB2  SER  81           1HB      SER  81  -7.113 -21.902  -6.881
  535    HB3  SER  81           2HB      SER  81  -5.650 -20.920  -6.957
  536    HG   SER  81           HG       SER  81  -6.558 -19.820  -8.728
  537    H    GLY  82           H        GLY  82  -6.815 -21.548 -10.735
  538    HA2  GLY  82           1HA      GLY  82  -5.984 -19.769 -12.123
  539    HA3  GLY  82           2HA      GLY  82  -4.368 -20.113 -11.524
  Start of MODEL    9
    1    H1   GLY   1           H        GLY   1 -16.675  24.450 -38.112
    2    HA2  GLY   1           1HA      GLY   1 -14.269  23.108 -37.193
    3    HA3  GLY   1           2HA      GLY   1 -14.670  24.805 -36.969
    4    H    SER   2           H        SER   2 -14.526  21.752 -35.523
    5    HA   SER   2           HA       SER   2 -16.486  22.083 -33.496
    6    HB2  SER   2           1HB      SER   2 -15.208  19.936 -34.294
    7    HB3  SER   2           2HB      SER   2 -14.026  20.420 -33.078
    8    HG   SER   2           HG       SER   2 -15.315  19.503 -31.707
    9    H    SER   3           H        SER   3 -13.004  22.713 -33.635
   10    HA   SER   3           HA       SER   3 -11.634  24.003 -32.357
   11    HB2  SER   3           1HB      SER   3 -13.507  25.674 -32.789
   12    HB3  SER   3           2HB      SER   3 -14.121  25.259 -31.188
   13    HG   SER   3           HG       SER   3 -12.723  27.090 -31.167
   14    H    GLY   4           H        GLY   4 -12.233  21.470 -31.391
   15    HA2  GLY   4           1HA      GLY   4 -13.150  21.235 -28.794
   16    HA3  GLY   4           2HA      GLY   4 -11.899  20.218 -29.494
   17    H    SER   5           H        SER   5 -11.828  20.756 -26.829
   18    HA   SER   5           HA       SER   5  -9.290  22.110 -26.596
   19    HB2  SER   5           1HB      SER   5 -10.016  23.696 -24.871
   20    HB3  SER   5           2HB      SER   5 -10.871  23.991 -26.385
   21    HG   SER   5           HG       SER   5 -12.003  23.726 -24.128
   22    H    SER   6           H        SER   6  -8.232  20.496 -25.630
   23    HA   SER   6           HA       SER   6  -9.526  19.056 -23.425
   24    HB2  SER   6           1HB      SER   6  -7.209  18.408 -25.234
   25    HB3  SER   6           2HB      SER   6  -7.451  17.537 -23.720
   26    HG   SER   6           HG       SER   6  -8.461  16.678 -25.741
   27    H    GLY   7           H        GLY   7  -6.414  20.588 -24.243
   28    HA2  GLY   7           1HA      GLY   7  -5.306  22.100 -22.771
   29    HA3  GLY   7           2HA      GLY   7  -6.149  21.355 -21.420
   30    H    GLN   8           H        GLN   8  -3.226  21.869 -22.116
   31    HA   GLN   8           HA       GLN   8  -2.014  19.309 -22.422
   32    HB2  GLN   8           1HB      GLN   8  -1.009  22.033 -21.659
   33    HB3  GLN   8           2HB      GLN   8   0.041  20.628 -21.534
   34    HG2  GLN   8           1HG      GLN   8  -0.053  20.226 -23.854
   35    HG3  GLN   8           2HG      GLN   8  -1.396  21.347 -24.068
   36   HE21  GLN   8          1HE2      GLN   8   1.957  20.956 -24.091
   37   HE22  GLN   8          2HE2      GLN   8   2.398  22.615 -24.282
   38    H    HIS   9           H        HIS   9  -1.786  17.769 -20.952
   39    HA   HIS   9           HA       HIS   9  -2.175  18.446 -18.124
   40    HB2  HIS   9           1HB      HIS   9  -2.533  15.934 -19.724
   41    HB3  HIS   9           2HB      HIS   9  -2.307  15.840 -17.980
   42    HD1  HIS   9           1HD      HIS   9  -4.960  15.195 -19.735
   43    HD2  HIS   9           2HD      HIS   9  -4.261  18.485 -17.295
   44    HE1  HIS   9           1HE      HIS   9  -7.236  16.054 -19.096
   45    H    GLN  10           H        GLN  10  -0.662  18.016 -16.582
   46    HA   GLN  10           HA       GLN  10   1.800  16.647 -17.375
   47    HB2  GLN  10           1HB      GLN  10   2.303  18.979 -17.744
   48    HB3  GLN  10           2HB      GLN  10   1.669  19.409 -16.160
   49    HG2  GLN  10           1HG      GLN  10   3.509  17.771 -15.300
   50    HG3  GLN  10           2HG      GLN  10   4.234  18.077 -16.878
   51   HE21  GLN  10          1HE2      GLN  10   5.595  19.704 -16.967
   52   HE22  GLN  10          2HE2      GLN  10   5.631  21.065 -15.904
   53    H    GLU  11           H        GLU  11   2.226  15.121 -15.935
   54    HA   GLU  11           HA       GLU  11   2.216  15.614 -13.127
   55    HB2  GLU  11           1HB      GLU  11  -0.216  15.280 -13.552
   56    HB3  GLU  11           2HB      GLU  11   0.146  13.672 -14.163
   57    HG2  GLU  11           1HG      GLU  11   0.794  12.892 -12.054
   58    HG3  GLU  11           2HG      GLU  11   0.934  14.523 -11.400
   59    H    ALA  12           H        ALA  12   4.158  14.723 -12.798
   60    HA   ALA  12           HA       ALA  12   4.481  11.913 -12.829
   61    HB1  ALA  12           1HB      ALA  12   5.947  13.424 -14.988
   62    HB2  ALA  12           2HB      ALA  12   6.269  11.754 -14.520
   63    HB3  ALA  12           3HB      ALA  12   4.710  12.188 -15.220
   64    H    GLY  13           H        GLY  13   6.780  11.284 -12.276
   65    HA2  GLY  13           1HA      GLY  13   8.885  12.773 -11.580
   66    HA3  GLY  13           2HA      GLY  13   7.760  13.169 -10.290
   67    H    ALA  14           H        ALA  14   8.941  12.240  -8.647
   68    HA   ALA  14           HA       ALA  14   9.534   9.375  -8.852
   69    HB1  ALA  14           1HB      ALA  14  10.929   9.704  -6.869
   70    HB2  ALA  14           2HB      ALA  14  11.384  10.804  -8.171
   71    HB3  ALA  14           3HB      ALA  14  10.438  11.397  -6.806
   72    H    GLY  15           H        GLY  15   8.352   7.900  -7.812
   73    HA2  GLY  15           1HA      GLY  15   6.052   8.729  -6.293
   74    HA3  GLY  15           2HA      GLY  15   6.519   7.075  -6.664
   75    H    ASP  16           H        ASP  16   7.249   9.820  -4.553
   76    HA   ASP  16           HA       ASP  16   8.157   7.891  -2.518
   77    HB2  ASP  16           1HB      ASP  16   9.355  10.098  -1.642
   78    HB3  ASP  16           2HB      ASP  16  10.109   9.049  -2.839
   79    H    LEU  17           H        LEU  17   5.482   8.454  -2.746
   80    HA   LEU  17           HA       LEU  17   5.007  10.023  -0.307
   81    HB2  LEU  17           1HB      LEU  17   3.027  10.029  -2.549
   82    HB3  LEU  17           2HB      LEU  17   3.186  11.155  -1.202
   83    HG   LEU  17           HG       LEU  17   5.194  10.986  -3.439
   84   HD11  LEU  17          1HD1      LEU  17   2.618  12.487  -3.251
   85   HD12  LEU  17          2HD1      LEU  17   3.320  11.629  -4.623
   86   HD13  LEU  17          3HD1      LEU  17   3.989  13.180  -4.116
   87   HD21  LEU  17          1HD2      LEU  17   6.186  12.808  -2.516
   88   HD22  LEU  17          2HD2      LEU  17   5.518  12.103  -1.044
   89   HD23  LEU  17          3HD2      LEU  17   4.677  13.430  -1.846
   90    H    CYS  18           H        CYS  18   3.696   9.083   1.151
   91    HA   CYS  18           HA       CYS  18   3.181   6.465   1.344
   92    HB2  CYS  18           1HB      CYS  18   2.653   8.114   3.107
   93    HB3  CYS  18           2HB      CYS  18   1.226   8.608   2.203
   94    H    ALA  19           H        ALA  19   1.621   4.978   0.758
   95    HA   ALA  19           HA       ALA  19   0.116   5.660  -1.645
   96    HB1  ALA  19           1HB      ALA  19   0.064   2.905  -0.564
   97    HB2  ALA  19           2HB      ALA  19   0.229   3.471  -2.226
   98    HB3  ALA  19           3HB      ALA  19   1.616   3.515  -1.138
   99    H    LEU  20           H        LEU  20  -0.386   5.028   1.709
  100    HA   LEU  20           HA       LEU  20  -3.138   4.275   1.519
  101    HB2  LEU  20           1HB      LEU  20  -1.209   4.881   3.666
  102    HB3  LEU  20           2HB      LEU  20  -2.903   5.178   4.049
  103    HG   LEU  20           HG       LEU  20  -2.004   2.938   4.746
  104   HD11  LEU  20          1HD1      LEU  20  -3.991   1.695   3.858
  105   HD12  LEU  20          2HD1      LEU  20  -4.354   3.111   2.873
  106   HD13  LEU  20          3HD1      LEU  20  -4.360   3.236   4.632
  107   HD21  LEU  20          1HD2      LEU  20  -2.366   1.749   2.129
  108   HD22  LEU  20          2HD2      LEU  20  -1.062   1.534   3.297
  109   HD23  LEU  20          3HD2      LEU  20  -1.013   2.881   2.159
  110    H    CYS  21           H        CYS  21  -1.551   7.241   2.714
  111    HA   CYS  21           HA       CYS  21  -4.068   8.689   2.411
  112    HB2  CYS  21           1HB      CYS  21  -2.793  10.553   3.522
  113    HB3  CYS  21           2HB      CYS  21  -2.952   9.091   4.490
  114    H    GLY  22           H        GLY  22  -0.660   9.055   1.419
  115    HA2  GLY  22           1HA      GLY  22   0.010   9.612  -0.788
  116    HA3  GLY  22           2HA      GLY  22  -1.595  10.264  -1.083
  117    H    GLU  23           H        GLU  23   0.498  10.965   1.674
  118    HA   GLU  23           HA       GLU  23   0.395  13.798   0.929
  119    HB2  GLU  23           1HB      GLU  23   0.780  12.333   3.510
  120    HB3  GLU  23           2HB      GLU  23   1.390  13.974   3.353
  121    HG2  GLU  23           1HG      GLU  23  -1.450  13.027   3.146
  122    HG3  GLU  23           2HG      GLU  23  -0.751  14.136   4.324
  123    H    HIS  24           H        HIS  24   2.811  11.944   2.759
  124    HA   HIS  24           HA       HIS  24   4.859  12.316   0.794
  125    HB2  HIS  24           1HB      HIS  24   4.516  14.572   2.123
  126    HB3  HIS  24           2HB      HIS  24   5.459  13.739   3.355
  127    HD1  HIS  24           1HD      HIS  24   5.723  15.023  -0.176
  128    HD2  HIS  24           2HD      HIS  24   8.166  13.560   2.849
  129    HE1  HIS  24           1HE      HIS  24   8.078  15.443  -0.952
  130    H    LEU  25           H        LEU  25   7.112  11.872   2.013
  131    HA   LEU  25           HA       LEU  25   6.791   9.904   4.131
  132    HB2  LEU  25           1HB      LEU  25   7.891   9.262   1.406
  133    HB3  LEU  25           2HB      LEU  25   8.198   8.267   2.828
  134    HG   LEU  25           HG       LEU  25   5.399   8.852   1.918
  135   HD11  LEU  25          1HD1      LEU  25   5.852   7.783   0.008
  136   HD12  LEU  25          2HD1      LEU  25   5.922   6.330   1.006
  137   HD13  LEU  25          3HD1      LEU  25   7.406   7.190   0.596
  138   HD21  LEU  25          1HD2      LEU  25   4.861   6.876   3.142
  139   HD22  LEU  25          2HD2      LEU  25   5.865   7.890   4.179
  140   HD23  LEU  25          3HD2      LEU  25   6.565   6.485   3.373
  141    H    TYR  26           H        TYR  26   8.901   9.161   4.980
  142    HA   TYR  26           HA       TYR  26  10.979  11.214   4.590
  143    HB2  TYR  26           1HB      TYR  26   9.672  11.080   6.842
  144    HB3  TYR  26           2HB      TYR  26  10.683   9.672   7.148
  145    HD1  TYR  26           1HD      TYR  26  11.143  13.165   5.878
  146    HD2  TYR  26           2HD      TYR  26  12.559  10.060   8.419
  147    HE1  TYR  26           1HE      TYR  26  12.947  14.639   6.665
  148    HE2  TYR  26           2HE      TYR  26  14.366  11.526   9.214
  149    HH   TYR  26           HH       TYR  26  15.593  13.492   8.492
  150    H    VAL  27           H        VAL  27  13.100  10.225   5.803
  151    HA   VAL  27           HA       VAL  27  13.829   7.974   4.135
  152    HB   VAL  27           HB       VAL  27  15.478   9.570   6.102
  153   HG11  VAL  27          1HG1      VAL  27  17.399   8.529   4.838
  154   HG12  VAL  27          2HG1      VAL  27  16.500   7.441   5.898
  155   HG13  VAL  27          3HG1      VAL  27  16.229   7.401   4.155
  156   HG21  VAL  27          1HG2      VAL  27  14.552  10.707   4.006
  157   HG22  VAL  27          2HG2      VAL  27  16.290  10.809   4.286
  158   HG23  VAL  27          3HG2      VAL  27  15.653   9.663   3.106
  159    H    LEU  28           H        LEU  28  13.640   8.697   7.604
  160    HA   LEU  28           HA       LEU  28  14.075   5.858   8.198
  161    HB2  LEU  28           1HB      LEU  28  14.135   8.319   9.930
  162    HB3  LEU  28           2HB      LEU  28  14.238   6.680  10.570
  163    HG   LEU  28           HG       LEU  28  16.266   6.562   8.844
  164   HD11  LEU  28          1HD1      LEU  28  17.492   8.657   8.803
  165   HD12  LEU  28          2HD1      LEU  28  16.177   9.464   9.656
  166   HD13  LEU  28          3HD1      LEU  28  15.920   8.845   8.025
  167   HD21  LEU  28          1HD2      LEU  28  16.240   6.196  11.331
  168   HD22  LEU  28          2HD2      LEU  28  16.562   7.921  11.515
  169   HD23  LEU  28          3HD2      LEU  28  17.729   6.888  10.687
  170    H    GLU  29           H        GLU  29  11.563   7.053   7.120
  171    HA   GLU  29           HA       GLU  29   9.773   6.012   9.203
  172    HB2  GLU  29           1HB      GLU  29   9.166   8.441   7.512
  173    HB3  GLU  29           2HB      GLU  29   8.146   7.753   8.767
  174    HG2  GLU  29           1HG      GLU  29  10.066   8.231  10.365
  175    HG3  GLU  29           2HG      GLU  29  10.741   9.220   9.072
  176    H    ARG  30           H        ARG  30  10.327   6.715   5.800
  177    HA   ARG  30           HA       ARG  30   8.009   5.597   4.722
  178    HB2  ARG  30           1HB      ARG  30   9.185   5.491   2.636
  179    HB3  ARG  30           2HB      ARG  30   9.712   6.943   3.477
  180    HG2  ARG  30           1HG      ARG  30  11.734   5.738   4.221
  181    HG3  ARG  30           2HG      ARG  30  11.214   4.342   3.274
  182    HD2  ARG  30           1HD      ARG  30  11.199   5.828   1.258
  183    HD3  ARG  30           2HD      ARG  30  11.935   7.084   2.254
  184    HE   ARG  30           HE       ARG  30  13.457   4.724   2.443
  185   HH11  ARG  30          2HH1      ARG  30  12.676   7.260   0.189
  186   HH12  ARG  30          1HH1      ARG  30  14.174   7.134  -0.673
  187   HH21  ARG  30          2HH2      ARG  30  15.432   4.548   1.316
  188   HH22  ARG  30          1HH2      ARG  30  15.740   5.590  -0.032
  189    H    LEU  31           H        LEU  31   7.353   3.564   4.274
  190    HA   LEU  31           HA       LEU  31   9.038   1.380   5.269
  191    HB2  LEU  31           1HB      LEU  31   6.115   1.814   4.999
  192    HB3  LEU  31           2HB      LEU  31   6.712   0.163   4.843
  193    HG   LEU  31           HG       LEU  31   7.755   0.391   7.090
  194   HD11  LEU  31          1HD1      LEU  31   7.260   3.103   6.702
  195   HD12  LEU  31          2HD1      LEU  31   7.859   2.328   8.168
  196   HD13  LEU  31          3HD1      LEU  31   6.129   2.606   7.961
  197   HD21  LEU  31          1HD2      LEU  31   5.677  -0.742   6.976
  198   HD22  LEU  31          2HD2      LEU  31   4.782   0.768   6.802
  199   HD23  LEU  31          3HD2      LEU  31   5.565   0.377   8.335
  200    H    CYS  32           H        CYS  32  10.353   0.806   3.610
  201    HA   CYS  32           HA       CYS  32   9.557   0.717   0.892
  202    HB2  CYS  32           1HB      CYS  32  11.686  -0.519   0.549
  203    HB3  CYS  32           2HB      CYS  32  11.894   0.966   1.469
  204    HG   CYS  32           HG       CYS  32  13.142  -0.137   3.411
  205    H    VAL  33           H        VAL  33   7.773  -0.530   0.532
  206    HA   VAL  33           HA       VAL  33   8.089  -3.416   1.037
  207    HB   VAL  33           HB       VAL  33   5.526  -1.826   1.210
  208   HG11  VAL  33          1HG1      VAL  33   4.493  -3.968   1.856
  209   HG12  VAL  33          2HG1      VAL  33   5.112  -3.991   0.204
  210   HG13  VAL  33          3HG1      VAL  33   6.010  -4.790   1.495
  211   HG21  VAL  33          1HG2      VAL  33   5.520  -2.442   3.550
  212   HG22  VAL  33          2HG2      VAL  33   7.013  -3.358   3.343
  213   HG23  VAL  33          3HG2      VAL  33   7.022  -1.603   3.161
  214    H    ASN  34           H        ASN  34   8.533  -4.246  -0.911
  215    HA   ASN  34           HA       ASN  34   8.309  -4.856  -3.090
  216    HB2  ASN  34           1HB      ASN  34   5.496  -3.795  -2.738
  217    HB3  ASN  34           2HB      ASN  34   6.049  -4.798  -4.077
  218   HD21  ASN  34          1HD2      ASN  34   3.935  -5.588  -2.567
  219   HD22  ASN  34          2HD2      ASN  34   4.373  -6.955  -1.605
  220    H    GLY  35           H        GLY  35   9.242  -2.171  -2.382
  221    HA2  GLY  35           1HA      GLY  35  10.167  -0.570  -3.844
  222    HA3  GLY  35           2HA      GLY  35   8.942  -0.983  -5.035
  223    H    HIS  36           H        HIS  36   6.794  -0.785  -2.990
  224    HA   HIS  36           HA       HIS  36   6.370   2.069  -3.249
  225    HB2  HIS  36           1HB      HIS  36   4.565  -0.048  -2.060
  226    HB3  HIS  36           2HB      HIS  36   4.105   1.603  -2.465
  227    HD1  HIS  36           1HD      HIS  36   4.934   2.015  -5.246
  228    HD2  HIS  36           2HD      HIS  36   3.534  -1.673  -3.941
  229    HE1  HIS  36           1HE      HIS  36   4.144   0.824  -7.316
  230    H    PHE  37           H        PHE  37   5.957   3.493  -1.536
  231    HA   PHE  37           HA       PHE  37   7.015   2.591   1.061
  232    HB2  PHE  37           1HB      PHE  37   7.112   5.308  -0.258
  233    HB3  PHE  37           2HB      PHE  37   7.559   5.027   1.422
  234    HD1  PHE  37           2HD      PHE  37   9.528   3.637   1.959
  235    HD2  PHE  37           1HD      PHE  37   8.565   4.732  -2.040
  236    HE1  PHE  37           2HE      PHE  37  11.811   3.052   1.252
  237    HE2  PHE  37           1HE      PHE  37  10.846   4.148  -2.753
  238    HZ   PHE  37           HZ       PHE  37  12.473   3.308  -1.106
  239    H    PHE  38           H        PHE  38   5.967   3.187   2.950
  240    HA   PHE  38           HA       PHE  38   3.487   4.708   2.756
  241    HB2  PHE  38           1HB      PHE  38   3.447   2.028   4.126
  242    HB3  PHE  38           2HB      PHE  38   2.085   3.034   3.644
  243    HD1  PHE  38           1HD      PHE  38   5.021   1.381   2.034
  244    HD2  PHE  38           2HD      PHE  38   0.869   2.301   1.852
  245    HE1  PHE  38           1HE      PHE  38   4.835   0.114  -0.068
  246    HE2  PHE  38           2HE      PHE  38   0.677   1.035  -0.249
  247    HZ   PHE  38           HZ       PHE  38   2.661  -0.061  -1.211
  248    H    HIS  39           H        HIS  39   2.566   5.184   4.920
  249    HA   HIS  39           HA       HIS  39   4.677   5.953   6.717
  250    HB2  HIS  39           1HB      HIS  39   1.705   6.388   6.648
  251    HB3  HIS  39           2HB      HIS  39   2.640   6.802   8.082
  252    HD2  HIS  39           2HD      HIS  39   5.209   8.156   6.444
  253    HE1  HIS  39           1HE      HIS  39   2.225  10.799   4.992
  254    HE2  HIS  39           2HE      HIS  39   4.698  10.388   5.241
  255    H    ARG  40           H        ARG  40   5.042   5.236   8.795
  256    HA   ARG  40           HA       ARG  40   4.535   2.523   9.335
  257    HB2  ARG  40           1HB      ARG  40   5.651   4.805  10.922
  258    HB3  ARG  40           2HB      ARG  40   5.294   3.283  11.727
  259    HG2  ARG  40           1HG      ARG  40   6.741   2.150  10.022
  260    HG3  ARG  40           2HG      ARG  40   7.221   3.756   9.469
  261    HD2  ARG  40           1HD      ARG  40   7.906   4.234  11.852
  262    HD3  ARG  40           2HD      ARG  40   7.672   2.516  12.175
  263    HE   ARG  40           HE       ARG  40   9.382   2.907   9.945
  264   HH11  ARG  40          2HH1      ARG  40   9.297   3.062  13.422
  265   HH12  ARG  40          1HH1      ARG  40  10.991   2.746  13.608
  266   HH21  ARG  40          2HH2      ARG  40  11.612   2.490  10.176
  267   HH22  ARG  40          1HH2      ARG  40  12.307   2.421  11.761
  268    H    SER  41           H        SER  41   2.611   5.287   9.794
  269    HA   SER  41           HA       SER  41   1.025   4.081  11.926
  270    HB2  SER  41           1HB      SER  41   1.685   6.625  11.648
  271    HB3  SER  41           2HB      SER  41   0.266   6.655  10.603
  272    HG   SER  41           HG       SER  41  -0.868   5.675  12.432
  273    H    CYS  42           H        CYS  42   0.693   5.125   8.558
  274    HA   CYS  42           HA       CYS  42  -2.032   4.387   8.293
  275    HB2  CYS  42           1HB      CYS  42   0.133   4.769   6.217
  276    HB3  CYS  42           2HB      CYS  42  -1.569   4.530   5.838
  277    H    PHE  43           H        PHE  43   0.976   2.774   7.280
  278    HA   PHE  43           HA       PHE  43  -0.112   0.503   6.140
  279    HB2  PHE  43           1HB      PHE  43   2.354   1.258   6.299
  280    HB3  PHE  43           2HB      PHE  43   2.377   0.381   7.825
  281    HD1  PHE  43           1HD      PHE  43   1.910  -2.071   7.833
  282    HD2  PHE  43           2HD      PHE  43   2.491   0.132   4.238
  283    HE1  PHE  43           1HE      PHE  43   2.348  -4.168   6.623
  284    HE2  PHE  43           2HE      PHE  43   2.929  -1.961   3.022
  285    HZ   PHE  43           HZ       PHE  43   2.857  -4.115   4.214
  286    H    ARG  44           H        ARG  44  -1.805  -0.471   7.134
  287    HA   ARG  44           HA       ARG  44  -1.221  -1.853   9.649
  288    HB2  ARG  44           1HB      ARG  44  -3.793  -0.346   9.141
  289    HB3  ARG  44           2HB      ARG  44  -3.399  -1.282  10.577
  290    HG2  ARG  44           1HG      ARG  44  -1.801   0.280  11.292
  291    HG3  ARG  44           2HG      ARG  44  -1.755   1.074   9.716
  292    HD2  ARG  44           1HD      ARG  44  -3.887   2.036  10.030
  293    HD3  ARG  44           2HD      ARG  44  -4.238   0.992  11.406
  294    HE   ARG  44           HE       ARG  44  -1.964   2.658  11.861
  295   HH11  ARG  44          2HH1      ARG  44  -5.445   2.579  11.882
  296   HH12  ARG  44          1HH1      ARG  44  -5.597   3.857  13.042
  297   HH21  ARG  44          2HH2      ARG  44  -2.152   4.341  13.389
  298   HH22  ARG  44          1HH2      ARG  44  -3.723   4.859  13.898
  299    H    CYS  45           H        CYS  45  -3.196  -3.391  10.128
  300    HA   CYS  45           HA       CYS  45  -3.244  -5.338   8.146
  301    HB2  CYS  45           1HB      CYS  45  -3.780  -5.671  10.577
  302    HB3  CYS  45           2HB      CYS  45  -5.356  -4.947  10.273
  303    H    HIS  46           H        HIS  46  -5.215  -6.210   7.051
  304    HA   HIS  46           HA       HIS  46  -6.663  -3.995   5.784
  305    HB2  HIS  46           1HB      HIS  46  -5.484  -5.347   4.197
  306    HB3  HIS  46           2HB      HIS  46  -6.125  -6.831   4.895
  307    HD1  HIS  46           1HD      HIS  46  -6.886  -4.173   2.450
  308    HD2  HIS  46           2HD      HIS  46  -8.873  -7.331   4.277
  309    HE1  HIS  46           1HE      HIS  46  -8.983  -4.517   1.105
  310    H    THR  47           H        THR  47  -7.118  -6.124   8.225
  311    HA   THR  47           HA       THR  47 -10.020  -6.290   7.729
  312    HB   THR  47           HB       THR  47  -8.197  -8.253   9.107
  313    HG1  THR  47           1HG      THR  47  -8.710  -8.359   6.777
  314   HG21  THR  47          1HG2      THR  47 -10.123  -7.891  10.570
  315   HG22  THR  47          2HG2      THR  47 -10.201  -9.481   9.810
  316   HG23  THR  47          3HG2      THR  47 -11.215  -8.167   9.213
  317    H    CYS  48           H        CYS  48  -7.490  -5.883  10.167
  318    HA   CYS  48           HA       CYS  48  -9.499  -4.690  11.962
  319    HB2  CYS  48           1HB      CYS  48  -7.926  -5.204  13.804
  320    HB3  CYS  48           2HB      CYS  48  -8.452  -6.650  12.948
  321    H    GLU  49           H        GLU  49  -7.108  -3.902   9.841
  322    HA   GLU  49           HA       GLU  49  -5.735  -2.104   9.520
  323    HB2  GLU  49           1HB      GLU  49  -7.935  -0.749  11.090
  324    HB3  GLU  49           2HB      GLU  49  -6.746   0.070  10.085
  325    HG2  GLU  49           1HG      GLU  49  -7.618  -1.189   8.130
  326    HG3  GLU  49           2HG      GLU  49  -8.886  -1.836   9.171
  327    H    ALA  50           H        ALA  50  -4.657  -3.569  11.456
  328    HA   ALA  50           HA       ALA  50  -4.050  -1.764  13.690
  329    HB1  ALA  50           1HB      ALA  50  -3.153  -3.708  14.829
  330    HB2  ALA  50           2HB      ALA  50  -4.793  -4.034  14.265
  331    HB3  ALA  50           3HB      ALA  50  -3.411  -4.696  13.391
  332    H    THR  51           H        THR  51  -1.973  -1.116  14.160
  333    HA   THR  51           HA       THR  51  -0.212  -0.604  12.100
  334    HB   THR  51           HB       THR  51   0.596  -0.945  14.992
  335    HG1  THR  51           1HG      THR  51  -0.255   1.006  15.365
  336   HG21  THR  51          1HG2      THR  51   2.060   1.100  14.141
  337   HG22  THR  51          2HG2      THR  51   1.838   0.291  12.589
  338   HG23  THR  51          3HG2      THR  51   2.589  -0.569  13.933
  339    H    LEU  52           H        LEU  52   0.364  -2.302  10.811
  340    HA   LEU  52           HA       LEU  52   1.229  -4.821  11.814
  341    HB2  LEU  52           1HB      LEU  52   1.659  -3.601   9.091
  342    HB3  LEU  52           2HB      LEU  52   1.856  -5.302   9.509
  343    HG   LEU  52           HG       LEU  52  -0.757  -3.796   9.598
  344   HD11  LEU  52          1HD1      LEU  52  -0.306  -3.939   7.332
  345   HD12  LEU  52          2HD1      LEU  52  -1.216  -5.418   7.637
  346   HD13  LEU  52          3HD1      LEU  52   0.540  -5.478   7.492
  347   HD21  LEU  52          1HD2      LEU  52  -1.753  -5.688  10.340
  348   HD22  LEU  52          2HD2      LEU  52  -0.155  -5.972  11.032
  349   HD23  LEU  52          3HD2      LEU  52  -0.610  -6.748   9.514
  350    H    TRP  53           H        TRP  53   2.926  -4.559  13.230
  351    HA   TRP  53           HA       TRP  53   5.174  -2.939  12.830
  352    HB2  TRP  53           1HB      TRP  53   5.301  -5.537  14.341
  353    HB3  TRP  53           2HB      TRP  53   6.127  -4.019  14.685
  354    HD1  TRP  53           HD       TRP  53   2.826  -5.825  15.244
  355    HE1  TRP  53           1HE      TRP  53   1.422  -4.495  16.942
  356    HE3  TRP  53           3HE      TRP  53   5.699  -1.607  15.543
  357    HZ2  TRP  53           2HZ      TRP  53   1.520  -1.988  18.237
  358    HZ3  TRP  53           3HZ      TRP  53   4.973   0.211  17.035
  359    HH2  TRP  53           HH       TRP  53   2.927   0.022  18.352
  360    HA   PRO  54           HA       PRO  54   7.669  -5.038   9.893
  361    HB2  PRO  54           1HB      PRO  54  10.163  -4.539  10.843
  362    HB3  PRO  54           2HB      PRO  54   9.159  -3.299  10.083
  363    HG2  PRO  54           1HG      PRO  54   9.622  -3.841  12.990
  364    HG3  PRO  54           2HG      PRO  54   9.566  -2.288  12.137
  365    HD2  PRO  54           1HD      PRO  54   7.475  -3.239  13.570
  366    HD3  PRO  54           2HD      PRO  54   7.262  -2.238  12.120
  367    H    GLY  55           H        GLY  55   6.965  -6.378  12.693
  368    HA2  GLY  55           1HA      GLY  55   8.536  -8.768  12.125
  369    HA3  GLY  55           2HA      GLY  55   8.754  -8.053  13.715
  370    H    GLY  56           H        GLY  56   5.687  -8.013  12.028
  371    HA2  GLY  56           1HA      GLY  56   4.661 -10.353  13.346
  372    HA3  GLY  56           2HA      GLY  56   4.116  -8.859  14.094
  373    H    TYR  57           H        TYR  57   4.639  -9.723  10.684
  374    HA   TYR  57           HA       TYR  57   1.811  -9.743  10.138
  375    HB2  TYR  57           1HB      TYR  57   1.643  -7.809   8.825
  376    HB3  TYR  57           2HB      TYR  57   2.570  -7.279  10.224
  377    HD1  TYR  57           2HD      TYR  57   5.173  -7.376   9.955
  378    HD2  TYR  57           1HD      TYR  57   2.436  -7.339   6.698
  379    HE1  TYR  57           2HE      TYR  57   6.959  -6.568   8.471
  380    HE2  TYR  57           1HE      TYR  57   4.216  -6.532   5.204
  381    HH   TYR  57           HH       TYR  57   6.433  -5.210   5.530
  382    H    GLU  58           H        GLU  58   1.425  -9.985   7.720
  383    HA   GLU  58           HA       GLU  58   3.645 -10.990   6.173
  384    HB2  GLU  58           1HB      GLU  58   1.453 -12.837   7.127
  385    HB3  GLU  58           2HB      GLU  58   2.553 -13.221   5.810
  386    HG2  GLU  58           1HG      GLU  58   4.449 -13.009   7.369
  387    HG3  GLU  58           2HG      GLU  58   3.306 -12.717   8.680
  388    H    GLN  59           H        GLN  59   3.139 -11.294   3.966
  389    HA   GLN  59           HA       GLN  59   0.640  -9.975   3.163
  390    HB2  GLN  59           1HB      GLN  59   2.643  -8.849   2.387
  391    HB3  GLN  59           2HB      GLN  59   3.245 -10.340   1.677
  392    HG2  GLN  59           1HG      GLN  59   0.988 -10.225   0.336
  393    HG3  GLN  59           2HG      GLN  59   1.109  -8.509   0.725
  394   HE21  GLN  59          1HE2      GLN  59   1.149  -8.832  -1.796
  395   HE22  GLN  59          2HE2      GLN  59   2.732  -8.795  -2.486
  396    H    HIS  60           H        HIS  60  -0.921 -11.352   2.640
  397    HA   HIS  60           HA       HIS  60  -0.444 -14.048   1.864
  398    HB2  HIS  60           1HB      HIS  60  -2.528 -12.968   3.018
  399    HB3  HIS  60           2HB      HIS  60  -3.053 -12.654   1.366
  400    HD1  HIS  60           1HD      HIS  60  -3.971 -14.606   0.041
  401    HD2  HIS  60           2HD      HIS  60  -2.357 -15.738   3.698
  402    HE1  HIS  60           1HE      HIS  60  -4.638 -17.010   0.355
  403    HA   PRO  61           HA       PRO  61   0.334 -13.183  -2.435
  404    HB2  PRO  61           1HB      PRO  61   0.606 -15.776  -3.194
  405    HB3  PRO  61           2HB      PRO  61   1.873 -14.887  -2.339
  406    HG2  PRO  61           1HG      PRO  61  -0.142 -16.821  -1.260
  407    HG3  PRO  61           2HG      PRO  61   1.586 -16.681  -0.887
  408    HD2  PRO  61           1HD      PRO  61  -0.340 -15.689   0.737
  409    HD3  PRO  61           2HD      PRO  61   1.257 -14.931   0.576
  410    H    GLY  62           H        GLY  62  -2.096 -15.433  -1.230
  411    HA2  GLY  62           1HA      GLY  62  -3.479 -16.208  -3.423
  412    HA3  GLY  62           2HA      GLY  62  -4.279 -15.722  -1.936
  413    H    ASP  63           H        ASP  63  -4.026 -13.086  -1.789
  414    HA   ASP  63           HA       ASP  63  -5.411 -12.153  -4.206
  415    HB2  ASP  63           1HB      ASP  63  -5.982 -10.200  -2.525
  416    HB3  ASP  63           2HB      ASP  63  -6.875 -11.717  -2.481
  417    H    GLY  64           H        GLY  64  -3.010 -11.083  -1.802
  418    HA2  GLY  64           1HA      GLY  64  -0.904 -10.180  -2.708
  419    HA3  GLY  64           2HA      GLY  64  -1.881  -9.325  -3.893
  420    H    HIS  65           H        HIS  65  -2.481  -9.660  -0.422
  421    HA   HIS  65           HA       HIS  65  -2.008  -6.769  -0.129
  422    HB2  HIS  65           1HB      HIS  65  -4.352  -8.394   0.848
  423    HB3  HIS  65           2HB      HIS  65  -3.936  -6.833   1.551
  424    HD1  HIS  65           1HD      HIS  65  -4.290  -4.731   0.057
  425    HD2  HIS  65           2HD      HIS  65  -5.566  -8.295  -1.653
  426    HE1  HIS  65           1HE      HIS  65  -5.709  -4.063  -1.908
  427    H    PHE  66           H        PHE  66  -2.253  -6.334   2.449
  428    HA   PHE  66           HA       PHE  66  -0.403  -8.243   3.721
  429    HB2  PHE  66           1HB      PHE  66  -0.604  -5.242   4.000
  430    HB3  PHE  66           2HB      PHE  66   0.334  -6.249   5.098
  431    HD1  PHE  66           2HD      PHE  66   0.084  -4.947   1.683
  432    HD2  PHE  66           1HD      PHE  66   2.413  -7.230   4.418
  433    HE1  PHE  66           2HE      PHE  66   1.999  -4.833   0.142
  434    HE2  PHE  66           1HE      PHE  66   4.332  -7.119   2.882
  435    HZ   PHE  66           HZ       PHE  66   4.126  -5.921   0.740
  436    H    TYR  67           H        TYR  67  -1.108  -9.241   5.485
  437    HA   TYR  67           HA       TYR  67  -3.239  -7.986   7.074
  438    HB2  TYR  67           1HB      TYR  67  -3.159 -10.935   6.425
  439    HB3  TYR  67           2HB      TYR  67  -4.435 -10.059   7.262
  440    HD1  TYR  67           2HD      TYR  67  -2.869 -10.693   3.995
  441    HD2  TYR  67           1HD      TYR  67  -6.081  -8.800   6.045
  442    HE1  TYR  67           2HE      TYR  67  -4.017 -10.331   1.850
  443    HE2  TYR  67           1HE      TYR  67  -7.238  -8.434   3.905
  444    HH   TYR  67           HH       TYR  67  -5.898  -9.656   0.859
  445    H    CYS  68           H        CYS  68  -3.408  -8.836   9.272
  446    HA   CYS  68           HA       CYS  68  -0.835  -9.092  10.477
  447    HB2  CYS  68           1HB      CYS  68  -2.040  -9.158  12.590
  448    HB3  CYS  68           2HB      CYS  68  -2.713  -7.899  11.559
  449    H    LEU  69           H        LEU  69  -0.522 -10.826  12.235
  450    HA   LEU  69           HA       LEU  69  -0.601 -13.382  10.918
  451    HB2  LEU  69           1HB      LEU  69   0.297 -12.806  13.730
  452    HB3  LEU  69           2HB      LEU  69   0.745 -14.175  12.714
  453    HG   LEU  69           HG       LEU  69   1.615 -11.307  12.390
  454   HD11  LEU  69          1HD1      LEU  69   3.264 -13.776  12.876
  455   HD12  LEU  69          2HD1      LEU  69   2.704 -12.708  14.163
  456   HD13  LEU  69          3HD1      LEU  69   3.792 -12.094  12.918
  457   HD21  LEU  69          1HD2      LEU  69   1.127 -12.580  10.239
  458   HD22  LEU  69          2HD2      LEU  69   2.478 -13.624  10.683
  459   HD23  LEU  69          3HD2      LEU  69   2.744 -11.900  10.419
  460    H    GLN  70           H        GLN  70  -3.042 -11.897  12.169
  461    HA   GLN  70           HA       GLN  70  -4.108 -14.275  13.541
  462    HB2  GLN  70           1HB      GLN  70  -3.782 -12.446  15.138
  463    HB3  GLN  70           2HB      GLN  70  -4.746 -11.378  14.126
  464    HG2  GLN  70           1HG      GLN  70  -6.727 -12.550  14.591
  465    HG3  GLN  70           2HG      GLN  70  -5.850 -13.921  15.269
  466   HE21  GLN  70          1HE2      GLN  70  -6.087 -14.047  17.371
  467   HE22  GLN  70          2HE2      GLN  70  -6.170 -12.721  18.475
  468    H    HIS  71           H        HIS  71  -4.372 -12.138  10.952
  469    HA   HIS  71           HA       HIS  71  -7.109 -13.080  10.396
  470    HB2  HIS  71           1HB      HIS  71  -5.873 -10.376   9.984
  471    HB3  HIS  71           2HB      HIS  71  -7.200 -10.908   8.957
  472    HD2  HIS  71           2HD      HIS  71  -8.341 -12.380  12.045
  473    HE1  HIS  71           1HE      HIS  71  -9.434  -8.306  12.499
  474    HE2  HIS  71           2HE      HIS  71  -9.698 -10.643  13.398
  475    H    LEU  72           H        LEU  72  -3.869 -12.851   9.364
  476    HA   LEU  72           HA       LEU  72  -4.045 -12.897   6.602
  477    HB2  LEU  72           1HB      LEU  72  -1.950 -12.756   7.895
  478    HB3  LEU  72           2HB      LEU  72  -2.121 -14.457   8.323
  479    HG   LEU  72           HG       LEU  72  -2.159 -14.686   5.657
  480   HD11  LEU  72          1HD1      LEU  72  -0.466 -12.252   6.200
  481   HD12  LEU  72          2HD1      LEU  72  -1.939 -12.309   5.233
  482   HD13  LEU  72          3HD1      LEU  72  -0.496 -13.164   4.691
  483   HD21  LEU  72          1HD2      LEU  72  -0.671 -15.888   7.136
  484   HD22  LEU  72          2HD2      LEU  72   0.293 -14.435   7.395
  485   HD23  LEU  72          3HD2      LEU  72   0.249 -15.192   5.802
  486    HA   PRO  73           HA       PRO  73  -6.356 -16.696   6.088
  487    HB2  PRO  73           1HB      PRO  73  -6.587 -16.479   3.391
  488    HB3  PRO  73           2HB      PRO  73  -7.595 -15.563   4.519
  489    HG2  PRO  73           1HG      PRO  73  -5.150 -14.692   3.026
  490    HG3  PRO  73           2HG      PRO  73  -6.670 -13.817   3.292
  491    HD2  PRO  73           1HD      PRO  73  -4.436 -13.333   4.744
  492    HD3  PRO  73           2HD      PRO  73  -6.069 -13.168   5.420
  493    H    GLN  74           H        GLN  74  -6.129 -18.392   4.089
  494    HA   GLN  74           HA       GLN  74  -3.370 -18.858   3.358
  495    HB2  GLN  74           1HB      GLN  74  -4.747 -20.384   5.502
  496    HB3  GLN  74           2HB      GLN  74  -3.783 -21.310   4.359
  497    HG2  GLN  74           1HG      GLN  74  -2.763 -18.967   5.948
  498    HG3  GLN  74           2HG      GLN  74  -2.557 -20.657   6.402
  499   HE21  GLN  74          1HE2      GLN  74  -0.396 -19.008   6.066
  500   HE22  GLN  74          2HE2      GLN  74   0.490 -19.491   4.664
  501    H    THR  75           H        THR  75  -3.173 -20.092   1.549
  502    HA   THR  75           HA       THR  75  -5.173 -20.340  -0.271
  503    HB   THR  75           HB       THR  75  -3.855 -22.126  -1.378
  504    HG1  THR  75           1HG      THR  75  -3.162 -23.035   0.746
  505   HG21  THR  75          1HG2      THR  75  -2.197 -20.701  -2.051
  506   HG22  THR  75          2HG2      THR  75  -1.812 -20.197  -0.405
  507   HG23  THR  75          3HG2      THR  75  -3.239 -19.551  -1.214
  508    H    ASP  76           H        ASP  76  -4.653 -22.330   2.499
  509    HA   ASP  76           HA       ASP  76  -6.354 -24.479   1.559
  510    HB2  ASP  76           1HB      ASP  76  -4.316 -24.641   3.183
  511    HB3  ASP  76           2HB      ASP  76  -5.480 -24.152   4.412
  512    H    SER  77           H        SER  77  -8.226 -23.116   1.155
  513    HA   SER  77           HA       SER  77  -9.858 -22.843   3.571
  514    HB2  SER  77           1HB      SER  77  -8.983 -20.596   3.112
  515    HB3  SER  77           2HB      SER  77  -9.587 -20.689   1.458
  516    HG   SER  77           HG       SER  77 -10.877 -19.830   3.571
  517    H    GLY  78           H        GLY  78 -12.064 -23.151   3.262
  518    HA2  GLY  78           1HA      GLY  78 -14.000 -23.383   1.863
  519    HA3  GLY  78           2HA      GLY  78 -12.936 -23.803   0.528
  520    HA   PRO  79           HA       PRO  79 -14.677 -27.600   2.832
  521    HB2  PRO  79           1HB      PRO  79 -16.611 -28.305   1.062
  522    HB3  PRO  79           2HB      PRO  79 -16.911 -27.235   2.437
  523    HG2  PRO  79           1HG      PRO  79 -16.425 -26.538  -0.433
  524    HG3  PRO  79           2HG      PRO  79 -17.613 -25.863   0.697
  525    HD2  PRO  79           1HD      PRO  79 -15.290 -24.605   0.102
  526    HD3  PRO  79           2HD      PRO  79 -16.065 -24.477   1.694
  527    H    SER  80           H        SER  80 -13.533 -29.380   2.424
  528    HA   SER  80           HA       SER  80 -11.735 -29.851   0.516
  529    HB2  SER  80           1HB      SER  80 -13.501 -31.709   2.038
  530    HB3  SER  80           2HB      SER  80 -12.538 -32.386   0.725
  531    HG   SER  80           HG       SER  80 -11.688 -31.142   3.100
  532    H    SER  81           H        SER  81 -11.640 -30.149  -1.614
  533    HA   SER  81           HA       SER  81 -14.165 -30.594  -3.057
  534    HB2  SER  81           1HB      SER  81 -13.032 -28.478  -3.591
  535    HB3  SER  81           2HB      SER  81 -11.578 -29.366  -4.044
  536    HG   SER  81           HG       SER  81 -12.471 -29.907  -5.884
  537    H    GLY  82           H        GLY  82 -14.428 -32.346  -4.312
  538    HA2  GLY  82           1HA      GLY  82 -13.922 -34.251  -5.515
  539    HA3  GLY  82           2HA      GLY  82 -12.227 -33.794  -5.441
  Start of MODEL   10
    1    H1   GLY   1           H        GLY   1 -33.106   8.722 -29.466
    2    HA2  GLY   1           1HA      GLY   1 -30.612   8.492 -30.724
    3    HA3  GLY   1           2HA      GLY   1 -30.965  10.203 -30.537
    4    H    SER   2           H        SER   2 -28.806   8.814 -29.309
    5    HA   SER   2           HA       SER   2 -29.098   9.732 -26.644
    6    HB2  SER   2           1HB      SER   2 -30.337   7.415 -26.767
    7    HB3  SER   2           2HB      SER   2 -28.700   6.762 -26.710
    8    HG   SER   2           HG       SER   2 -28.596   7.262 -24.674
    9    H    SER   3           H        SER   3 -27.140  10.094 -25.742
   10    HA   SER   3           HA       SER   3 -24.802   8.599 -26.311
   11    HB2  SER   3           1HB      SER   3 -25.250  10.004 -28.460
   12    HB3  SER   3           2HB      SER   3 -24.664  11.358 -27.493
   13    HG   SER   3           HG       SER   3 -22.698  10.577 -27.575
   14    H    GLY   4           H        GLY   4 -22.974   9.319 -25.119
   15    HA2  GLY   4           1HA      GLY   4 -22.634  11.680 -23.756
   16    HA3  GLY   4           2HA      GLY   4 -23.673  10.714 -22.719
   17    H    SER   5           H        SER   5 -20.637  11.635 -22.974
   18    HA   SER   5           HA       SER   5 -19.634   9.445 -21.428
   19    HB2  SER   5           1HB      SER   5 -19.390   8.549 -23.739
   20    HB3  SER   5           2HB      SER   5 -18.360   9.926 -24.132
   21    HG   SER   5           HG       SER   5 -16.847   8.615 -23.458
   22    H    SER   6           H        SER   6 -17.278   9.803 -20.867
   23    HA   SER   6           HA       SER   6 -16.171  12.412 -21.262
   24    HB2  SER   6           1HB      SER   6 -18.057  12.599 -19.449
   25    HB3  SER   6           2HB      SER   6 -16.856  11.852 -18.396
   26    HG   SER   6           HG       SER   6 -17.040  14.392 -19.101
   27    H    GLY   7           H        GLY   7 -14.287  12.702 -19.538
   28    HA2  GLY   7           1HA      GLY   7 -13.105  10.321 -18.511
   29    HA3  GLY   7           2HA      GLY   7 -12.379  10.770 -20.047
   30    H    GLN   8           H        GLN   8 -11.037  10.659 -17.533
   31    HA   GLN   8           HA       GLN   8  -9.794  13.234 -17.576
   32    HB2  GLN   8           1HB      GLN   8 -11.931  13.362 -16.050
   33    HB3  GLN   8           2HB      GLN   8 -10.905  12.530 -14.889
   34    HG2  GLN   8           1HG      GLN   8  -9.314  14.321 -14.922
   35    HG3  GLN   8           2HG      GLN   8 -10.183  15.125 -16.228
   36   HE21  GLN   8          1HE2      GLN   8  -9.483  15.800 -13.345
   37   HE22  GLN   8          2HE2      GLN   8 -10.976  16.360 -12.680
   38    H    HIS   9           H        HIS   9  -7.704  12.844 -17.324
   39    HA   HIS   9           HA       HIS   9  -6.845  10.807 -15.400
   40    HB2  HIS   9           1HB      HIS   9  -5.210   9.908 -16.988
   41    HB3  HIS   9           2HB      HIS   9  -6.849   9.730 -17.609
   42    HD1  HIS   9           1HD      HIS   9  -6.305   9.750 -20.072
   43    HD2  HIS   9           2HD      HIS   9  -4.753  13.030 -18.048
   44    HE1  HIS   9           1HE      HIS   9  -5.456  11.302 -21.859
   45    H    GLN  10           H        GLN  10  -4.297  10.903 -15.302
   46    HA   GLN  10           HA       GLN  10  -3.325  13.641 -15.567
   47    HB2  GLN  10           1HB      GLN  10  -3.797  12.215 -12.995
   48    HB3  GLN  10           2HB      GLN  10  -2.356  13.214 -13.128
   49    HG2  GLN  10           1HG      GLN  10  -5.028  14.314 -13.882
   50    HG3  GLN  10           2HG      GLN  10  -4.535  14.233 -12.191
   51   HE21  GLN  10          1HE2      GLN  10  -5.014  16.651 -12.957
   52   HE22  GLN  10          2HE2      GLN  10  -3.580  17.553 -13.294
   53    H    GLU  11           H        GLU  11  -1.027  13.830 -15.451
   54    HA   GLU  11           HA       GLU  11   0.317  11.407 -16.332
   55    HB2  GLU  11           1HB      GLU  11   0.512  13.760 -17.404
   56    HB3  GLU  11           2HB      GLU  11   1.616  14.104 -16.080
   57    HG2  GLU  11           1HG      GLU  11   2.890  12.031 -16.811
   58    HG3  GLU  11           2HG      GLU  11   1.916  12.089 -18.279
   59    H    ALA  12           H        ALA  12   1.968  10.394 -15.282
   60    HA   ALA  12           HA       ALA  12   2.152  10.772 -12.452
   61    HB1  ALA  12           1HB      ALA  12   4.118   9.018 -12.935
   62    HB2  ALA  12           2HB      ALA  12   2.415   8.563 -12.863
   63    HB3  ALA  12           3HB      ALA  12   3.190   8.833 -14.424
   64    H    GLY  13           H        GLY  13   3.482  12.081 -11.388
   65    HA2  GLY  13           1HA      GLY  13   5.687  13.337 -12.854
   66    HA3  GLY  13           2HA      GLY  13   4.988  13.912 -11.348
   67    H    ALA  14           H        ALA  14   5.085  11.557  -9.848
   68    HA   ALA  14           HA       ALA  14   7.840  10.633  -9.871
   69    HB1  ALA  14           1HB      ALA  14   7.203  12.844  -8.334
   70    HB2  ALA  14           2HB      ALA  14   7.164  11.503  -7.190
   71    HB3  ALA  14           3HB      ALA  14   8.616  11.806  -8.144
   72    H    GLY  15           H        GLY  15   8.183   9.103  -7.912
   73    HA2  GLY  15           1HA      GLY  15   5.681   7.634  -7.370
   74    HA3  GLY  15           2HA      GLY  15   7.119   6.794  -7.932
   75    H    ASP  16           H        ASP  16   6.633   9.344  -5.496
   76    HA   ASP  16           HA       ASP  16   7.662   7.495  -3.459
   77    HB2  ASP  16           1HB      ASP  16   8.568  10.355  -3.850
   78    HB3  ASP  16           2HB      ASP  16   9.035   9.314  -2.508
   79    H    LEU  17           H        LEU  17   5.053   7.774  -3.596
   80    HA   LEU  17           HA       LEU  17   4.417   9.495  -1.309
   81    HB2  LEU  17           1HB      LEU  17   2.490   9.219  -3.584
   82    HB3  LEU  17           2HB      LEU  17   2.511  10.414  -2.289
   83    HG   LEU  17           HG       LEU  17   4.651  10.342  -4.395
   84   HD11  LEU  17          1HD1      LEU  17   3.002  12.396  -5.120
   85   HD12  LEU  17          2HD1      LEU  17   1.853  11.133  -4.678
   86   HD13  LEU  17          3HD1      LEU  17   3.077  10.820  -5.908
   87   HD21  LEU  17          1HD2      LEU  17   5.320  11.719  -2.652
   88   HD22  LEU  17          2HD2      LEU  17   3.681  12.293  -2.341
   89   HD23  LEU  17          3HD2      LEU  17   4.553  12.847  -3.770
   90    H    CYS  18           H        CYS  18   3.162   8.550   0.194
   91    HA   CYS  18           HA       CYS  18   2.833   5.911   0.525
   92    HB2  CYS  18           1HB      CYS  18   2.204   7.584   2.216
   93    HB3  CYS  18           2HB      CYS  18   0.763   7.982   1.287
   94    H    ALA  19           H        ALA  19   1.392   4.292   0.005
   95    HA   ALA  19           HA       ALA  19  -0.178   4.763  -2.407
   96    HB1  ALA  19           1HB      ALA  19   1.351   2.590  -1.404
   97    HB2  ALA  19           2HB      ALA  19  -0.317   2.050  -1.600
   98    HB3  ALA  19           3HB      ALA  19   0.550   2.747  -2.968
   99    H    LEU  20           H        LEU  20  -0.603   4.248   0.972
  100    HA   LEU  20           HA       LEU  20  -3.261   3.229   0.884
  101    HB2  LEU  20           1HB      LEU  20  -1.407   4.242   2.944
  102    HB3  LEU  20           2HB      LEU  20  -3.124   4.372   3.318
  103    HG   LEU  20           HG       LEU  20  -2.007   2.330   4.218
  104   HD11  LEU  20          1HD1      LEU  20  -3.781   0.758   3.083
  105   HD12  LEU  20          2HD1      LEU  20  -4.377   2.279   2.419
  106   HD13  LEU  20          3HD1      LEU  20  -4.277   2.059   4.166
  107   HD21  LEU  20          1HD2      LEU  20  -0.469   1.843   2.441
  108   HD22  LEU  20          2HD2      LEU  20  -1.790   1.652   1.288
  109   HD23  LEU  20          3HD2      LEU  20  -1.590   0.491   2.601
  110    H    CYS  21           H        CYS  21  -1.964   6.457   1.669
  111    HA   CYS  21           HA       CYS  21  -4.639   7.583   1.266
  112    HB2  CYS  21           1HB      CYS  21  -3.613   9.657   2.253
  113    HB3  CYS  21           2HB      CYS  21  -3.640   8.266   3.332
  114    H    GLY  22           H        GLY  22  -1.260   8.198   0.309
  115    HA2  GLY  22           1HA      GLY  22  -0.741   8.537  -2.037
  116    HA3  GLY  22           2HA      GLY  22  -2.302   9.326  -2.211
  117    H    GLU  23           H        GLU  23   0.124   9.821   0.320
  118    HA   GLU  23           HA       GLU  23   0.417  12.594  -0.634
  119    HB2  GLU  23           1HB      GLU  23   0.354  11.554   2.202
  120    HB3  GLU  23           2HB      GLU  23   0.817  13.194   1.768
  121    HG2  GLU  23           1HG      GLU  23  -1.842  12.002   1.044
  122    HG3  GLU  23           2HG      GLU  23  -1.553  12.874   2.548
  123    H    HIS  24           H        HIS  24   2.463  13.603   0.499
  124    HA   HIS  24           HA       HIS  24   4.713  12.379  -0.606
  125    HB2  HIS  24           1HB      HIS  24   4.231  14.837   0.351
  126    HB3  HIS  24           2HB      HIS  24   5.123  14.182   1.720
  127    HD1  HIS  24           1HD      HIS  24   5.632  15.864  -1.404
  128    HD2  HIS  24           2HD      HIS  24   7.744  13.057   0.814
  129    HE1  HIS  24           1HE      HIS  24   7.990  15.958  -2.272
  130    H    LEU  25           H        LEU  25   6.578  11.452   0.411
  131    HA   LEU  25           HA       LEU  25   5.964  10.082   2.947
  132    HB2  LEU  25           1HB      LEU  25   7.211   9.076   0.425
  133    HB3  LEU  25           2HB      LEU  25   7.636   8.339   1.968
  134    HG   LEU  25           HG       LEU  25   4.768   8.573   1.134
  135   HD11  LEU  25          1HD1      LEU  25   5.451   7.440  -0.734
  136   HD12  LEU  25          2HD1      LEU  25   5.213   6.098   0.384
  137   HD13  LEU  25          3HD1      LEU  25   6.837   6.712   0.077
  138   HD21  LEU  25          1HD2      LEU  25   6.136   6.424   2.727
  139   HD22  LEU  25          2HD2      LEU  25   4.419   6.821   2.660
  140   HD23  LEU  25          3HD2      LEU  25   5.546   7.912   3.467
  141    H    TYR  26           H        TYR  26   7.732   9.656   4.351
  142    HA   TYR  26           HA       TYR  26   9.948  11.553   3.994
  143    HB2  TYR  26           1HB      TYR  26   8.293  11.441   6.076
  144    HB3  TYR  26           2HB      TYR  26   9.442  10.220   6.612
  145    HD1  TYR  26           1HD      TYR  26   9.253  13.741   5.411
  146    HD2  TYR  26           2HD      TYR  26  11.413  10.862   7.680
  147    HE1  TYR  26           1HE      TYR  26  10.744  15.516   6.231
  148    HE2  TYR  26           2HE      TYR  26  12.910  12.630   8.507
  149    HH   TYR  26           HH       TYR  26  13.616  15.079   7.465
  150    H    VAL  27           H        VAL  27  12.040  10.901   4.018
  151    HA   VAL  27           HA       VAL  27  12.828   8.438   3.169
  152    HB   VAL  27           HB       VAL  27  15.079   8.933   4.168
  153   HG11  VAL  27          1HG1      VAL  27  14.605   9.702   1.958
  154   HG12  VAL  27          2HG1      VAL  27  13.680  11.073   2.574
  155   HG13  VAL  27          3HG1      VAL  27  15.426  11.006   2.814
  156   HG21  VAL  27          1HG2      VAL  27  14.031  10.175   6.139
  157   HG22  VAL  27          2HG2      VAL  27  15.478  10.879   5.417
  158   HG23  VAL  27          3HG2      VAL  27  13.890  11.549   5.041
  159    H    LEU  28           H        LEU  28  11.877   9.321   6.367
  160    HA   LEU  28           HA       LEU  28  12.865   6.772   7.439
  161    HB2  LEU  28           1HB      LEU  28  11.902   9.284   8.789
  162    HB3  LEU  28           2HB      LEU  28  12.241   7.787   9.655
  163    HG   LEU  28           HG       LEU  28  14.306   9.242   8.015
  164   HD11  LEU  28          1HD1      LEU  28  14.910   9.574  10.704
  165   HD12  LEU  28          2HD1      LEU  28  13.187   9.933  10.588
  166   HD13  LEU  28          3HD1      LEU  28  14.340  10.813   9.585
  167   HD21  LEU  28          1HD2      LEU  28  15.747   7.655   8.665
  168   HD22  LEU  28          2HD2      LEU  28  14.304   6.694   8.991
  169   HD23  LEU  28          3HD2      LEU  28  15.085   7.585  10.299
  170    H    GLU  29           H        GLU  29   9.984   8.832   7.895
  171    HA   GLU  29           HA       GLU  29   8.261   7.021   8.962
  172    HB2  GLU  29           1HB      GLU  29   7.533   9.042   6.835
  173    HB3  GLU  29           2HB      GLU  29   6.427   8.309   7.988
  174    HG2  GLU  29           1HG      GLU  29   8.781   9.764   9.053
  175    HG3  GLU  29           2HG      GLU  29   7.460  10.707   8.364
  176    H    ARG  30           H        ARG  30   8.831   7.517   5.486
  177    HA   ARG  30           HA       ARG  30   7.047   5.752   4.403
  178    HB2  ARG  30           1HB      ARG  30   8.393   5.692   2.472
  179    HB3  ARG  30           2HB      ARG  30   8.739   7.248   3.214
  180    HG2  ARG  30           1HG      ARG  30  10.711   5.977   4.332
  181    HG3  ARG  30           2HG      ARG  30  10.456   4.818   3.026
  182    HD2  ARG  30           1HD      ARG  30  10.981   7.770   2.699
  183    HD3  ARG  30           2HD      ARG  30  12.151   6.478   2.434
  184    HE   ARG  30           HE       ARG  30  10.200   5.780   0.751
  185   HH11  ARG  30          2HH1      ARG  30  11.743   8.847   1.326
  186   HH12  ARG  30          1HH1      ARG  30  11.525   9.409  -0.298
  187   HH21  ARG  30          2HH2      ARG  30   9.907   6.508  -1.390
  188   HH22  ARG  30          1HH2      ARG  30  10.480   8.078  -1.842
  189    H    LEU  31           H        LEU  31   7.101   3.558   3.790
  190    HA   LEU  31           HA       LEU  31   9.025   1.899   5.282
  191    HB2  LEU  31           1HB      LEU  31   6.071   1.816   5.198
  192    HB3  LEU  31           2HB      LEU  31   6.903   0.263   5.146
  193    HG   LEU  31           HG       LEU  31   8.134   1.108   7.254
  194   HD11  LEU  31          1HD1      LEU  31   6.513   3.350   6.715
  195   HD12  LEU  31          2HD1      LEU  31   7.576   3.079   8.095
  196   HD13  LEU  31          3HD1      LEU  31   5.883   2.595   8.179
  197   HD21  LEU  31          1HD2      LEU  31   5.526  -0.123   6.871
  198   HD22  LEU  31          2HD2      LEU  31   5.694   0.652   8.446
  199   HD23  LEU  31          3HD2      LEU  31   6.850  -0.581   7.943
  200    H    CYS  32           H        CYS  32  10.346   1.190   3.710
  201    HA   CYS  32           HA       CYS  32   9.536   0.649   1.051
  202    HB2  CYS  32           1HB      CYS  32  11.783  -0.430   0.848
  203    HB3  CYS  32           2HB      CYS  32  11.835   1.205   1.496
  204    HG   CYS  32           HG       CYS  32  11.648  -1.124   3.875
  205    H    VAL  33           H        VAL  33   7.837  -0.789   0.997
  206    HA   VAL  33           HA       VAL  33   8.459  -3.535   1.874
  207    HB   VAL  33           HB       VAL  33   5.739  -2.223   1.764
  208   HG11  VAL  33          1HG1      VAL  33   5.826  -4.714   3.181
  209   HG12  VAL  33          2HG1      VAL  33   4.829  -4.248   1.802
  210   HG13  VAL  33          3HG1      VAL  33   6.432  -4.935   1.541
  211   HG21  VAL  33          1HG2      VAL  33   7.601  -1.888   3.699
  212   HG22  VAL  33          2HG2      VAL  33   5.861  -1.842   3.982
  213   HG23  VAL  33          3HG2      VAL  33   6.766  -3.324   4.291
  214    H    ASN  34           H        ASN  34   9.094  -4.515   0.037
  215    HA   ASN  34           HA       ASN  34   8.972  -5.479  -2.019
  216    HB2  ASN  34           1HB      ASN  34   6.047  -4.752  -1.760
  217    HB3  ASN  34           2HB      ASN  34   6.710  -5.779  -3.027
  218   HD21  ASN  34          1HD2      ASN  34   6.263  -7.816  -2.651
  219   HD22  ASN  34          2HD2      ASN  34   6.298  -8.604  -1.114
  220    H    GLY  35           H        GLY  35   9.450  -2.565  -1.658
  221    HA2  GLY  35           1HA      GLY  35  10.252  -1.139  -3.391
  222    HA3  GLY  35           2HA      GLY  35   9.049  -1.826  -4.472
  223    H    HIS  36           H        HIS  36   6.874  -1.576  -2.549
  224    HA   HIS  36           HA       HIS  36   6.218   1.188  -3.089
  225    HB2  HIS  36           1HB      HIS  36   4.566  -0.906  -1.665
  226    HB3  HIS  36           2HB      HIS  36   3.987   0.618  -2.330
  227    HD1  HIS  36           1HD      HIS  36   4.804   0.698  -5.118
  228    HD2  HIS  36           2HD      HIS  36   3.816  -2.906  -3.301
  229    HE1  HIS  36           1HE      HIS  36   4.209  -0.862  -6.998
  230    H    PHE  37           H        PHE  37   5.669   2.747  -1.546
  231    HA   PHE  37           HA       PHE  37   6.793   2.239   1.126
  232    HB2  PHE  37           1HB      PHE  37   6.527   4.801  -0.454
  233    HB3  PHE  37           2HB      PHE  37   7.010   4.750   1.238
  234    HD1  PHE  37           2HD      PHE  37   9.128   3.590   1.869
  235    HD2  PHE  37           1HD      PHE  37   8.060   4.349  -2.180
  236    HE1  PHE  37           2HE      PHE  37  11.467   3.244   1.191
  237    HE2  PHE  37           1HE      PHE  37  10.398   4.003  -2.865
  238    HZ   PHE  37           HZ       PHE  37  12.105   3.451  -1.179
  239    H    PHE  38           H        PHE  38   5.650   2.774   2.952
  240    HA   PHE  38           HA       PHE  38   2.966   3.901   2.617
  241    HB2  PHE  38           1HB      PHE  38   3.505   1.421   4.260
  242    HB3  PHE  38           2HB      PHE  38   1.944   2.181   3.970
  243    HD1  PHE  38           2HD      PHE  38   1.199   2.334   1.486
  244    HD2  PHE  38           1HD      PHE  38   4.186  -0.333   2.929
  245    HE1  PHE  38           2HE      PHE  38   0.869   0.903  -0.488
  246    HE2  PHE  38           1HE      PHE  38   3.862  -1.768   0.957
  247    HZ   PHE  38           HZ       PHE  38   2.201  -1.152  -0.754
  248    H    HIS  39           H        HIS  39   2.188   5.041   4.380
  249    HA   HIS  39           HA       HIS  39   4.128   6.181   6.098
  250    HB2  HIS  39           1HB      HIS  39   1.134   6.354   5.922
  251    HB3  HIS  39           2HB      HIS  39   1.999   7.112   7.256
  252    HD2  HIS  39           2HD      HIS  39   4.505   8.252   5.309
  253    HE1  HIS  39           1HE      HIS  39   1.346  10.439   3.511
  254    HE2  HIS  39           2HE      HIS  39   3.843  10.198   3.739
  255    H    ARG  40           H        ARG  40   4.621   5.815   8.208
  256    HA   ARG  40           HA       ARG  40   4.403   3.300   9.303
  257    HB2  ARG  40           1HB      ARG  40   5.051   5.991  10.377
  258    HB3  ARG  40           2HB      ARG  40   4.669   4.740  11.553
  259    HG2  ARG  40           1HG      ARG  40   6.730   4.369   9.399
  260    HG3  ARG  40           2HG      ARG  40   7.106   5.042  10.986
  261    HD2  ARG  40           1HD      ARG  40   5.607   2.479  10.873
  262    HD3  ARG  40           2HD      ARG  40   7.323   2.452  10.471
  263    HE   ARG  40           HE       ARG  40   7.338   3.784  12.786
  264   HH11  ARG  40          2HH1      ARG  40   5.739   0.840  11.840
  265   HH12  ARG  40          1HH1      ARG  40   5.783   0.152  13.429
  266   HH21  ARG  40          2HH2      ARG  40   7.402   2.889  14.883
  267   HH22  ARG  40          1HH2      ARG  40   6.728   1.318  15.159
  268    H    SER  41           H        SER  41   2.109   5.905   9.372
  269    HA   SER  41           HA       SER  41   0.506   4.724  11.470
  270    HB2  SER  41           1HB      SER  41   0.068   7.108   9.662
  271    HB3  SER  41           2HB      SER  41  -1.092   6.587  10.884
  272    HG   SER  41           HG       SER  41   0.072   7.597  12.295
  273    H    CYS  42           H        CYS  42   0.019   5.435   8.010
  274    HA   CYS  42           HA       CYS  42  -2.422   4.160   7.689
  275    HB2  CYS  42           1HB      CYS  42  -0.156   4.448   5.706
  276    HB3  CYS  42           2HB      CYS  42  -1.795   3.963   5.285
  277    H    PHE  43           H        PHE  43   0.822   2.818   7.069
  278    HA   PHE  43           HA       PHE  43   0.214   0.291   6.274
  279    HB2  PHE  43           1HB      PHE  43   2.517   1.338   6.660
  280    HB3  PHE  43           2HB      PHE  43   2.364   0.791   8.327
  281    HD1  PHE  43           2HD      PHE  43   1.498  -0.812   5.074
  282    HD2  PHE  43           1HD      PHE  43   3.786  -0.982   8.659
  283    HE1  PHE  43           2HE      PHE  43   2.351  -3.025   4.421
  284    HE2  PHE  43           1HE      PHE  43   4.643  -3.195   8.011
  285    HZ   PHE  43           HZ       PHE  43   3.925  -4.220   5.890
  286    H    ARG  44           H        ARG  44  -1.650  -0.548   7.180
  287    HA   ARG  44           HA       ARG  44  -1.300  -1.716   9.833
  288    HB2  ARG  44           1HB      ARG  44  -3.661  -0.018   9.018
  289    HB3  ARG  44           2HB      ARG  44  -3.670  -1.091  10.411
  290    HG2  ARG  44           1HG      ARG  44  -2.036   0.184  11.532
  291    HG3  ARG  44           2HG      ARG  44  -1.637   1.091  10.072
  292    HD2  ARG  44           1HD      ARG  44  -3.936   2.035  10.101
  293    HD3  ARG  44           2HD      ARG  44  -4.210   1.217  11.639
  294    HE   ARG  44           HE       ARG  44  -1.890   2.890  11.676
  295   HH11  ARG  44          2HH1      ARG  44  -5.357   2.856  11.987
  296   HH12  ARG  44          1HH1      ARG  44  -5.414   4.287  12.962
  297   HH21  ARG  44          2HH2      ARG  44  -1.951   4.775  12.959
  298   HH22  ARG  44          1HH2      ARG  44  -3.476   5.379  13.513
  299    H    CYS  45           H        CYS  45  -3.160  -3.288  10.291
  300    HA   CYS  45           HA       CYS  45  -3.207  -5.252   8.308
  301    HB2  CYS  45           1HB      CYS  45  -3.609  -5.593  10.770
  302    HB3  CYS  45           2HB      CYS  45  -5.230  -4.949  10.532
  303    H    HIS  46           H        HIS  46  -5.203  -6.194   7.316
  304    HA   HIS  46           HA       HIS  46  -6.805  -4.029   6.149
  305    HB2  HIS  46           1HB      HIS  46  -5.634  -5.304   4.487
  306    HB3  HIS  46           2HB      HIS  46  -6.188  -6.824   5.182
  307    HD1  HIS  46           1HD      HIS  46  -7.108  -4.213   2.767
  308    HD2  HIS  46           2HD      HIS  46  -8.985  -7.356   4.731
  309    HE1  HIS  46           1HE      HIS  46  -9.258  -4.596   1.521
  310    H    THR  47           H        THR  47  -7.034  -6.231   8.562
  311    HA   THR  47           HA       THR  47  -9.947  -6.518   8.210
  312    HB   THR  47           HB       THR  47  -7.956  -8.432   9.404
  313    HG1  THR  47           1HG      THR  47  -8.502  -8.690   7.199
  314   HG21  THR  47          1HG2      THR  47 -10.954  -8.510   9.765
  315   HG22  THR  47          2HG2      THR  47  -9.782  -8.144  11.030
  316   HG23  THR  47          3HG2      THR  47  -9.809  -9.743  10.289
  317    H    CYS  48           H        CYS  48  -7.303  -5.895  10.446
  318    HA   CYS  48           HA       CYS  48  -9.270  -4.868  12.388
  319    HB2  CYS  48           1HB      CYS  48  -7.564  -5.352  14.142
  320    HB3  CYS  48           2HB      CYS  48  -8.161  -6.795  13.328
  321    H    GLU  49           H        GLU  49  -6.985  -3.986  10.185
  322    HA   GLU  49           HA       GLU  49  -5.679  -2.145   9.835
  323    HB2  GLU  49           1HB      GLU  49  -7.806  -0.847  11.548
  324    HB3  GLU  49           2HB      GLU  49  -6.718  -0.015  10.445
  325    HG2  GLU  49           1HG      GLU  49  -7.768  -0.907   8.554
  326    HG3  GLU  49           2HG      GLU  49  -8.595  -2.148   9.494
  327    H    ALA  50           H        ALA  50  -4.479  -3.621  11.692
  328    HA   ALA  50           HA       ALA  50  -3.810  -1.839  13.928
  329    HB1  ALA  50           1HB      ALA  50  -2.521  -4.016  14.637
  330    HB2  ALA  50           2HB      ALA  50  -4.261  -3.869  14.888
  331    HB3  ALA  50           3HB      ALA  50  -3.643  -4.783  13.512
  332    H    THR  51           H        THR  51  -1.882  -0.865  14.070
  333    HA   THR  51           HA       THR  51  -0.195  -0.399  12.012
  334    HB   THR  51           HB       THR  51   0.778  -0.695  14.858
  335    HG1  THR  51           1HG      THR  51  -0.135   1.729  13.742
  336   HG21  THR  51          1HG2      THR  51   2.518   0.765  14.292
  337   HG22  THR  51          2HG2      THR  51   1.718   1.290  12.810
  338   HG23  THR  51          3HG2      THR  51   2.417  -0.326  12.910
  339    H    LEU  52           H        LEU  52   0.482  -2.002  10.685
  340    HA   LEU  52           HA       LEU  52   1.437  -4.521  11.616
  341    HB2  LEU  52           1HB      LEU  52   1.763  -3.214   8.919
  342    HB3  LEU  52           2HB      LEU  52   2.063  -4.912   9.285
  343    HG   LEU  52           HG       LEU  52  -0.628  -3.560   9.476
  344   HD11  LEU  52          1HD1      LEU  52   0.346  -3.748   7.158
  345   HD12  LEU  52          2HD1      LEU  52  -1.196  -4.564   7.413
  346   HD13  LEU  52          3HD1      LEU  52   0.299  -5.498   7.372
  347   HD21  LEU  52          1HD2      LEU  52  -1.464  -5.491  10.259
  348   HD22  LEU  52          2HD2      LEU  52   0.199  -5.809  10.754
  349   HD23  LEU  52          3HD2      LEU  52  -0.415  -6.478   9.241
  350    H    TRP  53           H        TRP  53   3.186  -4.389  12.935
  351    HA   TRP  53           HA       TRP  53   5.362  -2.631  12.581
  352    HB2  TRP  53           1HB      TRP  53   5.541  -5.283  14.001
  353    HB3  TRP  53           2HB      TRP  53   6.413  -3.794  14.352
  354    HD1  TRP  53           HD       TRP  53   3.001  -5.455  14.860
  355    HE1  TRP  53           1HE      TRP  53   1.731  -4.175  16.696
  356    HE3  TRP  53           3HE      TRP  53   6.205  -1.519  15.471
  357    HZ2  TRP  53           2HZ      TRP  53   2.045  -1.810  18.204
  358    HZ3  TRP  53           3HZ      TRP  53   5.647   0.210  17.131
  359    HH2  TRP  53           HH       TRP  53   3.609   0.066  18.468
  360    HA   PRO  54           HA       PRO  54   7.841  -4.543   9.505
  361    HB2  PRO  54           1HB      PRO  54  10.339  -3.965  10.397
  362    HB3  PRO  54           2HB      PRO  54   9.262  -2.749   9.701
  363    HG2  PRO  54           1HG      PRO  54   9.833  -3.348  12.578
  364    HG3  PRO  54           2HG      PRO  54   9.688  -1.776  11.770
  365    HD2  PRO  54           1HD      PRO  54   7.681  -2.852  13.235
  366    HD3  PRO  54           2HD      PRO  54   7.384  -1.822  11.820
  367    H    GLY  55           H        GLY  55   7.294  -5.970  12.308
  368    HA2  GLY  55           1HA      GLY  55   8.937  -8.283  11.621
  369    HA3  GLY  55           2HA      GLY  55   9.175  -7.599  13.223
  370    H    GLY  56           H        GLY  56   6.094  -7.773  11.522
  371    HA2  GLY  56           1HA      GLY  56   5.190 -10.146  12.809
  372    HA3  GLY  56           2HA      GLY  56   4.630  -8.720  13.669
  373    H    TYR  57           H        TYR  57   5.008  -9.433  10.201
  374    HA   TYR  57           HA       TYR  57   2.157  -9.473   9.792
  375    HB2  TYR  57           1HB      TYR  57   1.864  -7.480   8.647
  376    HB3  TYR  57           2HB      TYR  57   2.987  -6.992   9.911
  377    HD1  TYR  57           2HD      TYR  57   5.430  -6.775   9.350
  378    HD2  TYR  57           1HD      TYR  57   2.447  -7.307   6.363
  379    HE1  TYR  57           2HE      TYR  57   7.000  -5.952   7.645
  380    HE2  TYR  57           1HE      TYR  57   4.009  -6.486   4.649
  381    HH   TYR  57           HH       TYR  57   7.181  -6.350   4.967
  382    H    GLU  58           H        GLU  58   1.591  -9.882   7.524
  383    HA   GLU  58           HA       GLU  58   3.782 -10.763   5.813
  384    HB2  GLU  58           1HB      GLU  58   1.748 -12.554   7.065
  385    HB3  GLU  58           2HB      GLU  58   2.276 -12.903   5.425
  386    HG2  GLU  58           1HG      GLU  58   4.272 -12.473   7.607
  387    HG3  GLU  58           2HG      GLU  58   3.478 -14.033   7.403
  388    H    GLN  59           H        GLN  59   3.082 -11.244   3.610
  389    HA   GLN  59           HA       GLN  59   0.631  -9.766   2.915
  390    HB2  GLN  59           1HB      GLN  59   2.666  -8.655   2.136
  391    HB3  GLN  59           2HB      GLN  59   3.164 -10.123   1.304
  392    HG2  GLN  59           1HG      GLN  59   0.973  -9.905   0.004
  393    HG3  GLN  59           2HG      GLN  59   0.919  -8.259   0.633
  394   HE21  GLN  59          1HE2      GLN  59   0.954  -7.986  -1.810
  395   HE22  GLN  59          2HE2      GLN  59   2.509  -7.772  -2.530
  396    H    HIS  60           H        HIS  60  -0.900 -11.284   2.633
  397    HA   HIS  60           HA       HIS  60  -0.499 -13.902   1.731
  398    HB2  HIS  60           1HB      HIS  60  -2.552 -12.868   2.898
  399    HB3  HIS  60           2HB      HIS  60  -3.064 -12.390   1.282
  400    HD1  HIS  60           1HD      HIS  60  -4.190 -14.136  -0.124
  401    HD2  HIS  60           2HD      HIS  60  -2.388 -15.732   3.262
  402    HE1  HIS  60           1HE      HIS  60  -4.936 -16.536  -0.034
  403    HA   PRO  61           HA       PRO  61   0.305 -13.093  -2.570
  404    HB2  PRO  61           1HB      PRO  61   0.458 -15.696  -3.325
  405    HB3  PRO  61           2HB      PRO  61   1.762 -14.866  -2.468
  406    HG2  PRO  61           1HG      PRO  61  -0.343 -16.703  -1.393
  407    HG3  PRO  61           2HG      PRO  61   1.389 -16.643  -1.016
  408    HD2  PRO  61           1HD      PRO  61  -0.492 -15.561   0.603
  409    HD3  PRO  61           2HD      PRO  61   1.139 -14.878   0.445
  410    H    GLY  62           H        GLY  62  -2.223 -15.241  -1.376
  411    HA2  GLY  62           1HA      GLY  62  -3.635 -15.940  -3.577
  412    HA3  GLY  62           2HA      GLY  62  -4.415 -15.435  -2.086
  413    H    ASP  63           H        ASP  63  -4.422 -12.933  -1.830
  414    HA   ASP  63           HA       ASP  63  -5.630 -11.886  -4.273
  415    HB2  ASP  63           1HB      ASP  63  -5.604 -10.691  -1.494
  416    HB3  ASP  63           2HB      ASP  63  -6.590 -10.162  -2.854
  417    H    GLY  64           H        GLY  64  -3.379 -10.709  -1.761
  418    HA2  GLY  64           1HA      GLY  64  -1.193  -9.887  -2.661
  419    HA3  GLY  64           2HA      GLY  64  -2.151  -9.004  -3.840
  420    H    HIS  65           H        HIS  65  -2.769  -9.396  -0.377
  421    HA   HIS  65           HA       HIS  65  -2.389  -6.489  -0.069
  422    HB2  HIS  65           1HB      HIS  65  -4.542  -8.278   1.049
  423    HB3  HIS  65           2HB      HIS  65  -4.181  -6.702   1.749
  424    HD1  HIS  65           1HD      HIS  65  -5.111  -4.670   0.578
  425    HD2  HIS  65           2HD      HIS  65  -5.602  -8.165  -1.614
  426    HE1  HIS  65           1HE      HIS  65  -6.623  -4.057  -1.335
  427    H    PHE  66           H        PHE  66  -2.525  -6.126   2.553
  428    HA   PHE  66           HA       PHE  66  -0.466  -7.913   3.671
  429    HB2  PHE  66           1HB      PHE  66  -0.779  -4.923   3.940
  430    HB3  PHE  66           2HB      PHE  66   0.265  -5.872   4.993
  431    HD1  PHE  66           1HD      PHE  66   2.206  -7.088   4.021
  432    HD2  PHE  66           2HD      PHE  66  -0.108  -4.321   1.761
  433    HE1  PHE  66           1HE      PHE  66   4.023  -6.921   2.371
  434    HE2  PHE  66           2HE      PHE  66   1.705  -4.151   0.108
  435    HZ   PHE  66           HZ       PHE  66   3.774  -5.452   0.411
  436    H    TYR  67           H        TYR  67  -1.128  -9.027   5.373
  437    HA   TYR  67           HA       TYR  67  -3.131  -7.821   7.162
  438    HB2  TYR  67           1HB      TYR  67  -3.029 -10.761   6.481
  439    HB3  TYR  67           2HB      TYR  67  -4.275  -9.911   7.388
  440    HD1  TYR  67           2HD      TYR  67  -2.801 -10.341   4.021
  441    HD2  TYR  67           1HD      TYR  67  -6.083  -8.851   6.282
  442    HE1  TYR  67           2HE      TYR  67  -4.070  -9.998   1.943
  443    HE2  TYR  67           1HE      TYR  67  -7.362  -8.505   4.210
  444    HH   TYR  67           HH       TYR  67  -7.179  -8.370   1.934
  445    H    CYS  68           H        CYS  68  -3.130  -8.724   9.351
  446    HA   CYS  68           HA       CYS  68  -0.489  -8.890  10.393
  447    HB2  CYS  68           1HB      CYS  68  -1.578  -9.155  12.569
  448    HB3  CYS  68           2HB      CYS  68  -2.331  -7.857  11.649
  449    H    LEU  69           H        LEU  69   0.062 -10.664  12.033
  450    HA   LEU  69           HA       LEU  69   0.025 -13.174  10.624
  451    HB2  LEU  69           1HB      LEU  69   1.134 -12.636  13.368
  452    HB3  LEU  69           2HB      LEU  69   1.569 -13.941  12.266
  453    HG   LEU  69           HG       LEU  69   2.235 -11.015  11.971
  454   HD11  LEU  69          1HD1      LEU  69   4.561 -11.889  12.070
  455   HD12  LEU  69          2HD1      LEU  69   3.902 -13.471  12.486
  456   HD13  LEU  69          3HD1      LEU  69   3.652 -12.100  13.567
  457   HD21  LEU  69          1HD2      LEU  69   3.097 -13.219  10.123
  458   HD22  LEU  69          2HD2      LEU  69   3.219 -11.475   9.892
  459   HD23  LEU  69          3HD2      LEU  69   1.643 -12.265   9.828
  460    H    GLN  70           H        GLN  70  -2.408 -11.924  12.059
  461    HA   GLN  70           HA       GLN  70  -3.185 -14.385  13.477
  462    HB2  GLN  70           1HB      GLN  70  -2.882 -12.561  15.079
  463    HB3  GLN  70           2HB      GLN  70  -3.985 -11.550  14.156
  464    HG2  GLN  70           1HG      GLN  70  -5.295 -12.322  15.897
  465    HG3  GLN  70           2HG      GLN  70  -5.708 -13.406  14.568
  466   HE21  GLN  70          1HE2      GLN  70  -6.462 -14.767  16.350
  467   HE22  GLN  70          2HE2      GLN  70  -5.328 -15.809  17.133
  468    H    HIS  71           H        HIS  71  -3.909 -12.038  11.089
  469    HA   HIS  71           HA       HIS  71  -6.583 -13.211  10.696
  470    HB2  HIS  71           1HB      HIS  71  -5.495 -10.467  10.131
  471    HB3  HIS  71           2HB      HIS  71  -6.905 -11.069   9.265
  472    HD2  HIS  71           2HD      HIS  71  -7.435 -12.457  12.624
  473    HE1  HIS  71           1HE      HIS  71  -8.994  -8.520  12.882
  474    HE2  HIS  71           2HE      HIS  71  -8.815 -10.764  14.010
  475    H    LEU  72           H        LEU  72  -3.461 -12.744   9.345
  476    HA   LEU  72           HA       LEU  72  -3.797 -12.827   6.641
  477    HB2  LEU  72           1HB      LEU  72  -1.631 -12.786   7.868
  478    HB3  LEU  72           2HB      LEU  72  -1.814 -14.514   8.160
  479    HG   LEU  72           HG       LEU  72  -1.985 -14.555   5.507
  480   HD11  LEU  72          1HD1      LEU  72  -0.434 -12.057   6.145
  481   HD12  LEU  72          2HD1      LEU  72  -1.832 -12.227   5.083
  482   HD13  LEU  72          3HD1      LEU  72  -0.282 -12.932   4.622
  483   HD21  LEU  72          1HD2      LEU  72   0.758 -14.224   6.626
  484   HD22  LEU  72          2HD2      LEU  72   0.132 -15.442   5.514
  485   HD23  LEU  72          3HD2      LEU  72  -0.266 -15.527   7.231
  486    HA   PRO  73           HA       PRO  73  -6.210 -16.552   6.127
  487    HB2  PRO  73           1HB      PRO  73  -6.495 -16.302   3.439
  488    HB3  PRO  73           2HB      PRO  73  -7.446 -15.365   4.598
  489    HG2  PRO  73           1HG      PRO  73  -5.008 -14.561   3.056
  490    HG3  PRO  73           2HG      PRO  73  -6.491 -13.639   3.365
  491    HD2  PRO  73           1HD      PRO  73  -4.210 -13.243   4.769
  492    HD3  PRO  73           2HD      PRO  73  -5.821 -13.030   5.485
  493    H    GLN  74           H        GLN  74  -6.082 -18.410   4.461
  494    HA   GLN  74           HA       GLN  74  -3.407 -18.901   3.439
  495    HB2  GLN  74           1HB      GLN  74  -4.557 -20.264   5.814
  496    HB3  GLN  74           2HB      GLN  74  -3.699 -21.270   4.655
  497    HG2  GLN  74           1HG      GLN  74  -2.593 -18.857   6.074
  498    HG3  GLN  74           2HG      GLN  74  -2.228 -20.543   6.438
  499   HE21  GLN  74          1HE2      GLN  74  -1.743 -17.914   4.222
  500   HE22  GLN  74          2HE2      GLN  74  -0.432 -18.623   3.348
  501    H    THR  75           H        THR  75  -3.743 -19.570   1.435
  502    HA   THR  75           HA       THR  75  -6.213 -20.604   0.512
  503    HB   THR  75           HB       THR  75  -4.649 -19.370  -0.951
  504    HG1  THR  75           1HG      THR  75  -4.660 -21.372  -2.577
  505   HG21  THR  75          1HG2      THR  75  -2.795 -20.913  -1.953
  506   HG22  THR  75          2HG2      THR  75  -2.932 -21.759  -0.411
  507   HG23  THR  75          3HG2      THR  75  -2.497 -20.050  -0.444
  508    H    ASP  76           H        ASP  76  -6.446 -22.698  -0.636
  509    HA   ASP  76           HA       ASP  76  -5.527 -24.842   1.075
  510    HB2  ASP  76           1HB      ASP  76  -7.538 -24.590  -1.127
  511    HB3  ASP  76           2HB      ASP  76  -6.951 -26.190  -0.681
  512    H    SER  77           H        SER  77  -5.279 -23.981  -2.363
  513    HA   SER  77           HA       SER  77  -3.059 -25.905  -2.599
  514    HB2  SER  77           1HB      SER  77  -5.214 -26.150  -4.041
  515    HB3  SER  77           2HB      SER  77  -4.549 -24.804  -4.966
  516    HG   SER  77           HG       SER  77  -2.750 -26.815  -4.441
  517    H    GLY  78           H        GLY  78  -1.103 -25.222  -3.318
  518    HA2  GLY  78           1HA      GLY  78   0.321 -23.729  -4.531
  519    HA3  GLY  78           2HA      GLY  78  -0.872 -22.460  -4.300
  520    HA   PRO  79           HA       PRO  79   1.306 -22.913  -0.017
  521    HB2  PRO  79           1HB      PRO  79   3.375 -24.664   0.144
  522    HB3  PRO  79           2HB      PRO  79   1.700 -25.123   0.472
  523    HG2  PRO  79           1HG      PRO  79   3.321 -25.521  -2.013
  524    HG3  PRO  79           2HG      PRO  79   2.218 -26.649  -1.204
  525    HD2  PRO  79           1HD      PRO  79   1.500 -25.228  -3.394
  526    HD3  PRO  79           2HD      PRO  79   0.344 -25.672  -2.122
  527    H    SER  80           H        SER  80   2.942 -21.581   0.671
  528    HA   SER  80           HA       SER  80   4.223 -19.854  -0.911
  529    HB2  SER  80           1HB      SER  80   5.519 -21.065   1.543
  530    HB3  SER  80           2HB      SER  80   5.871 -19.483   0.846
  531    HG   SER  80           HG       SER  80   4.421 -19.354   2.619
  532    H    SER  81           H        SER  81   5.617 -19.951  -2.532
  533    HA   SER  81           HA       SER  81   7.604 -22.124  -2.564
  534    HB2  SER  81           1HB      SER  81   7.270 -22.503  -4.890
  535    HB3  SER  81           2HB      SER  81   5.659 -22.463  -4.175
  536    HG   SER  81           HG       SER  81   5.306 -21.014  -5.660
  537    H    GLY  82           H        GLY  82   9.270 -21.585  -4.435
  538    HA2  GLY  82           1HA      GLY  82   9.952 -19.157  -5.374
  539    HA3  GLY  82           2HA      GLY  82  10.418 -19.032  -3.684
  Start of MODEL   11
    1    H1   GLY   1           H        GLY   1 -17.916  13.828 -32.127
    2    HA2  GLY   1           1HA      GLY   1 -16.606  15.664 -31.667
    3    HA3  GLY   1           2HA      GLY   1 -18.065  16.499 -31.155
    4    H    SER   2           H        SER   2 -18.675  16.464 -28.986
    5    HA   SER   2           HA       SER   2 -18.182  16.681 -26.763
    6    HB2  SER   2           1HB      SER   2 -17.324  13.835 -27.314
    7    HB3  SER   2           2HB      SER   2 -17.465  14.511 -25.692
    8    HG   SER   2           HG       SER   2 -19.554  14.351 -27.609
    9    H    SER   3           H        SER   3 -16.214  17.831 -28.342
   10    HA   SER   3           HA       SER   3 -13.637  16.977 -27.299
   11    HB2  SER   3           1HB      SER   3 -13.559  17.603 -29.587
   12    HB3  SER   3           2HB      SER   3 -14.476  19.080 -29.293
   13    HG   SER   3           HG       SER   3 -12.698  20.064 -28.746
   14    H    GLY   4           H        GLY   4 -12.317  18.199 -25.959
   15    HA2  GLY   4           1HA      GLY   4 -12.146  20.600 -25.031
   16    HA3  GLY   4           2HA      GLY   4 -13.750  20.248 -24.405
   17    H    SER   5           H        SER   5 -10.480  20.191 -23.736
   18    HA   SER   5           HA       SER   5 -10.847  19.150 -21.136
   19    HB2  SER   5           1HB      SER   5  -9.729  17.055 -21.241
   20    HB3  SER   5           2HB      SER   5 -10.899  17.034 -22.561
   21    HG   SER   5           HG       SER   5  -9.101  17.759 -23.914
   22    H    SER   6           H        SER   6  -9.521  20.420 -20.039
   23    HA   SER   6           HA       SER   6  -6.799  20.851 -21.076
   24    HB2  SER   6           1HB      SER   6  -8.759  22.869 -20.018
   25    HB3  SER   6           2HB      SER   6  -7.024  23.157 -19.890
   26    HG   SER   6           HG       SER   6  -8.440  23.753 -21.917
   27    H    GLY   7           H        GLY   7  -5.356  21.789 -19.266
   28    HA2  GLY   7           1HA      GLY   7  -4.801  21.850 -16.947
   29    HA3  GLY   7           2HA      GLY   7  -6.073  20.675 -16.644
   30    H    GLN   8           H        GLN   8  -2.880  21.077 -18.118
   31    HA   GLN   8           HA       GLN   8  -2.426  18.191 -17.790
   32    HB2  GLN   8           1HB      GLN   8  -2.058  18.902 -20.052
   33    HB3  GLN   8           2HB      GLN   8  -1.050  20.243 -19.524
   34    HG2  GLN   8           1HG      GLN   8   0.498  18.459 -18.552
   35    HG3  GLN   8           2HG      GLN   8  -0.415  17.317 -19.536
   36   HE21  GLN   8          1HE2      GLN   8   1.881  17.098 -20.357
   37   HE22  GLN   8          2HE2      GLN   8   2.314  18.090 -21.703
   38    H    HIS   9           H        HIS   9  -1.100  17.494 -16.249
   39    HA   HIS   9           HA       HIS   9   0.985  19.279 -15.225
   40    HB2  HIS   9           1HB      HIS   9  -0.906  17.750 -13.427
   41    HB3  HIS   9           2HB      HIS   9   0.410  18.801 -12.914
   42    HD1  HIS   9           1HD      HIS   9  -0.345  21.044 -12.232
   43    HD2  HIS   9           2HD      HIS   9  -2.877  19.369 -15.069
   44    HE1  HIS   9           1HE      HIS   9  -2.190  22.721 -12.560
   45    H    GLN  10           H        GLN  10   2.872  18.263 -15.198
   46    HA   GLN  10           HA       GLN  10   2.993  15.430 -14.514
   47    HB2  GLN  10           1HB      GLN  10   3.807  16.608 -17.145
   48    HB3  GLN  10           2HB      GLN  10   4.689  15.230 -16.499
   49    HG2  GLN  10           1HG      GLN  10   1.721  15.304 -16.993
   50    HG3  GLN  10           2HG      GLN  10   2.916  14.587 -18.073
   51   HE21  GLN  10          1HE2      GLN  10   1.143  14.251 -15.133
   52   HE22  GLN  10          2HE2      GLN  10   1.618  12.628 -14.780
   53    H    GLU  11           H        GLU  11   4.271  15.530 -12.776
   54    HA   GLU  11           HA       GLU  11   6.425  17.442 -12.588
   55    HB2  GLU  11           1HB      GLU  11   6.706  16.684 -10.350
   56    HB3  GLU  11           2HB      GLU  11   4.974  16.742 -10.649
   57    HG2  GLU  11           1HG      GLU  11   6.518  14.202 -10.996
   58    HG3  GLU  11           2HG      GLU  11   5.943  14.717  -9.411
   59    H    ALA  12           H        ALA  12   8.541  16.427 -11.545
   60    HA   ALA  12           HA       ALA  12   9.356  14.133 -13.205
   61    HB1  ALA  12           1HB      ALA  12  10.221  16.211 -14.172
   62    HB2  ALA  12           2HB      ALA  12  11.016  16.588 -12.643
   63    HB3  ALA  12           3HB      ALA  12  11.520  15.178 -13.575
   64    H    GLY  13           H        GLY  13  11.460  13.156 -12.394
   65    HA2  GLY  13           1HA      GLY  13  12.852  12.451 -10.656
   66    HA3  GLY  13           2HA      GLY  13  11.972  13.502  -9.556
   67    H    ALA  14           H        ALA  14  11.670  11.986  -7.956
   68    HA   ALA  14           HA       ALA  14  10.008   9.661  -8.675
   69    HB1  ALA  14           1HB      ALA  14  12.284   9.176  -7.740
   70    HB2  ALA  14           2HB      ALA  14  11.743   9.906  -6.227
   71    HB3  ALA  14           3HB      ALA  14  10.942   8.462  -6.845
   72    H    GLY  15           H        GLY  15   8.116   9.302  -7.600
   73    HA2  GLY  15           1HA      GLY  15   6.736  11.442  -6.471
   74    HA3  GLY  15           2HA      GLY  15   6.274   9.754  -6.308
   75    H    ASP  16           H        ASP  16   7.803   8.540  -4.693
   76    HA   ASP  16           HA       ASP  16   8.355   8.220  -2.509
   77    HB2  ASP  16           1HB      ASP  16   9.171  11.120  -2.422
   78    HB3  ASP  16           2HB      ASP  16   9.843   9.769  -1.513
   79    H    LEU  17           H        LEU  17   5.686   8.755  -2.945
   80    HA   LEU  17           HA       LEU  17   4.974  10.297  -0.538
   81    HB2  LEU  17           1HB      LEU  17   3.153   9.990  -2.901
   82    HB3  LEU  17           2HB      LEU  17   3.042  11.138  -1.568
   83    HG   LEU  17           HG       LEU  17   5.130  11.199  -3.747
   84   HD11  LEU  17          1HD1      LEU  17   3.890  12.743  -4.877
   85   HD12  LEU  17          2HD1      LEU  17   3.029  13.277  -3.434
   86   HD13  LEU  17          3HD1      LEU  17   2.592  11.754  -4.208
   87   HD21  LEU  17          1HD2      LEU  17   6.236  12.578  -2.407
   88   HD22  LEU  17          2HD2      LEU  17   4.980  12.445  -1.176
   89   HD23  LEU  17          3HD2      LEU  17   4.853  13.674  -2.436
   90    H    CYS  18           H        CYS  18   3.768   9.274   0.941
   91    HA   CYS  18           HA       CYS  18   3.488   6.669   1.303
   92    HB2  CYS  18           1HB      CYS  18   2.601   8.472   2.816
   93    HB3  CYS  18           2HB      CYS  18   1.153   8.518   1.815
   94    H    ALA  19           H        ALA  19   2.725   4.985   0.223
   95    HA   ALA  19           HA       ALA  19   1.022   5.369  -2.076
   96    HB1  ALA  19           1HB      ALA  19   2.529   3.753  -2.603
   97    HB2  ALA  19           2HB      ALA  19   2.616   3.138  -0.952
   98    HB3  ALA  19           3HB      ALA  19   1.243   2.721  -1.977
   99    H    LEU  20           H        LEU  20   0.180   5.554   0.932
  100    HA   LEU  20           HA       LEU  20  -2.176   3.801   0.708
  101    HB2  LEU  20           1HB      LEU  20  -0.513   4.680   3.001
  102    HB3  LEU  20           2HB      LEU  20  -2.241   4.480   3.281
  103    HG   LEU  20           HG       LEU  20  -0.764   2.243   1.992
  104   HD11  LEU  20          1HD1      LEU  20   0.403   3.292   4.163
  105   HD12  LEU  20          2HD1      LEU  20   0.379   1.563   3.817
  106   HD13  LEU  20          3HD1      LEU  20  -0.790   2.253   4.943
  107   HD21  LEU  20          1HD2      LEU  20  -3.315   2.518   2.644
  108   HD22  LEU  20          2HD2      LEU  20  -2.720   1.963   4.209
  109   HD23  LEU  20          3HD2      LEU  20  -2.484   0.967   2.772
  110    H    CYS  21           H        CYS  21  -1.116   7.003   1.830
  111    HA   CYS  21           HA       CYS  21  -3.886   7.951   1.567
  112    HB2  CYS  21           1HB      CYS  21  -3.117   9.898   2.919
  113    HB3  CYS  21           2HB      CYS  21  -2.961   8.359   3.760
  114    H    GLY  22           H        GLY  22  -0.535   8.866   0.796
  115    HA2  GLY  22           1HA      GLY  22  -0.033   9.588  -1.474
  116    HA3  GLY  22           2HA      GLY  22  -1.602  10.379  -1.504
  117    H    GLU  23           H        GLU  23   0.621  10.510   1.211
  118    HA   GLU  23           HA       GLU  23   0.891  13.402   0.743
  119    HB2  GLU  23           1HB      GLU  23   0.940  11.765   3.272
  120    HB3  GLU  23           2HB      GLU  23   1.498  13.431   3.222
  121    HG2  GLU  23           1HG      GLU  23  -0.886  13.781   2.103
  122    HG3  GLU  23           2HG      GLU  23  -1.246  12.339   3.052
  123    H    HIS  24           H        HIS  24   2.978  14.140   2.170
  124    HA   HIS  24           HA       HIS  24   5.205  13.136   0.676
  125    HB2  HIS  24           1HB      HIS  24   4.687  15.546   1.707
  126    HB3  HIS  24           2HB      HIS  24   5.640  14.895   3.037
  127    HD1  HIS  24           1HD      HIS  24   5.930  16.324  -0.336
  128    HD2  HIS  24           2HD      HIS  24   8.343  14.215   2.308
  129    HE1  HIS  24           1HE      HIS  24   8.276  16.603  -1.198
  130    H    LEU  25           H        LEU  25   6.914  11.906   1.355
  131    HA   LEU  25           HA       LEU  25   6.518  10.475   3.885
  132    HB2  LEU  25           1HB      LEU  25   8.009   9.817   1.364
  133    HB3  LEU  25           2HB      LEU  25   8.264   8.917   2.858
  134    HG   LEU  25           HG       LEU  25   5.557   9.182   1.571
  135   HD11  LEU  25          1HD1      LEU  25   7.742   7.190   1.051
  136   HD12  LEU  25          2HD1      LEU  25   6.810   8.133  -0.111
  137   HD13  LEU  25          3HD1      LEU  25   6.041   6.816   0.774
  138   HD21  LEU  25          1HD2      LEU  25   5.786   6.779   2.925
  139   HD22  LEU  25          2HD2      LEU  25   4.953   8.228   3.490
  140   HD23  LEU  25          3HD2      LEU  25   6.628   7.934   3.959
  141    H    TYR  26           H        TYR  26   8.578   9.772   4.995
  142    HA   TYR  26           HA       TYR  26  10.699  11.788   4.789
  143    HB2  TYR  26           1HB      TYR  26   9.095  12.427   6.602
  144    HB3  TYR  26           2HB      TYR  26   9.483  10.916   7.417
  145    HD1  TYR  26           1HD      TYR  26  11.235  13.885   5.967
  146    HD2  TYR  26           2HD      TYR  26  11.098  10.969   9.062
  147    HE1  TYR  26           1HE      TYR  26  13.141  14.978   7.072
  148    HE2  TYR  26           2HE      TYR  26  13.003  12.054  10.177
  149    HH   TYR  26           HH       TYR  26  13.987  14.491  10.185
  150    H    VAL  27           H        VAL  27  12.638  11.141   6.136
  151    HA   VAL  27           HA       VAL  27  13.704   8.759   5.293
  152    HB   VAL  27           HB       VAL  27  14.406  10.138   7.888
  153   HG11  VAL  27          1HG1      VAL  27  16.726   9.180   7.019
  154   HG12  VAL  27          2HG1      VAL  27  15.634   8.226   8.025
  155   HG13  VAL  27          3HG1      VAL  27  15.661   7.986   6.278
  156   HG21  VAL  27          1HG2      VAL  27  15.466  10.613   5.103
  157   HG22  VAL  27          2HG2      VAL  27  14.422  11.705   6.013
  158   HG23  VAL  27          3HG2      VAL  27  16.060  11.376   6.579
  159    H    LEU  28           H        LEU  28  12.495   9.371   8.597
  160    HA   LEU  28           HA       LEU  28  12.473   6.545   9.184
  161    HB2  LEU  28           1HB      LEU  28  11.650   8.984  10.739
  162    HB3  LEU  28           2HB      LEU  28  11.445   7.346  11.354
  163    HG   LEU  28           HG       LEU  28  14.119   8.480  10.559
  164   HD11  LEU  28          1HD1      LEU  28  12.621   9.459  12.616
  165   HD12  LEU  28          2HD1      LEU  28  14.382   9.474  12.545
  166   HD13  LEU  28          3HD1      LEU  28  13.546   8.185  13.411
  167   HD21  LEU  28          1HD2      LEU  28  13.199   5.893  11.282
  168   HD22  LEU  28          2HD2      LEU  28  14.217   6.499  12.588
  169   HD23  LEU  28          3HD2      LEU  28  14.847   6.421  10.941
  170    H    GLU  29           H        GLU  29  10.131   9.064   8.449
  171    HA   GLU  29           HA       GLU  29   7.867   7.336   8.923
  172    HB2  GLU  29           1HB      GLU  29   7.744   9.943   7.437
  173    HB3  GLU  29           2HB      GLU  29   6.515   9.190   8.443
  174    HG2  GLU  29           1HG      GLU  29   8.151   9.559  10.379
  175    HG3  GLU  29           2HG      GLU  29   8.981  10.662   9.283
  176    H    ARG  30           H        ARG  30   9.146   5.826   7.304
  177    HA   ARG  30           HA       ARG  30   7.563   5.750   4.920
  178    HB2  ARG  30           1HB      ARG  30   9.221   6.056   3.278
  179    HB3  ARG  30           2HB      ARG  30   9.464   7.381   4.409
  180    HG2  ARG  30           1HG      ARG  30  11.278   6.077   5.476
  181    HG3  ARG  30           2HG      ARG  30  11.073   4.844   4.231
  182    HD2  ARG  30           1HD      ARG  30  11.614   6.480   2.507
  183    HD3  ARG  30           2HD      ARG  30  11.775   7.735   3.734
  184    HE   ARG  30           HE       ARG  30  13.498   5.538   4.268
  185   HH11  ARG  30          2HH1      ARG  30  13.130   8.356   2.256
  186   HH12  ARG  30          1HH1      ARG  30  14.833   8.565   2.013
  187   HH21  ARG  30          2HH2      ARG  30  15.742   5.803   3.955
  188   HH22  ARG  30          1HH2      ARG  30  16.317   7.112   2.979
  189    H    LEU  31           H        LEU  31   7.249   3.688   4.352
  190    HA   LEU  31           HA       LEU  31   9.138   1.673   5.381
  191    HB2  LEU  31           1HB      LEU  31   6.176   1.798   5.374
  192    HB3  LEU  31           2HB      LEU  31   6.918   0.224   5.096
  193    HG   LEU  31           HG       LEU  31   8.191   0.605   7.261
  194   HD11  LEU  31          1HD1      LEU  31   6.552   2.190   8.707
  195   HD12  LEU  31          2HD1      LEU  31   6.534   3.031   7.157
  196   HD13  LEU  31          3HD1      LEU  31   8.065   2.731   7.980
  197   HD21  LEU  31          1HD2      LEU  31   6.433  -0.981   7.234
  198   HD22  LEU  31          2HD2      LEU  31   5.200   0.279   7.190
  199   HD23  LEU  31          3HD2      LEU  31   6.163   0.037   8.649
  200    H    CYS  32           H        CYS  32  10.352   1.149   3.655
  201    HA   CYS  32           HA       CYS  32   9.384   1.096   0.985
  202    HB2  CYS  32           1HB      CYS  32  11.571  -0.018   0.488
  203    HB3  CYS  32           2HB      CYS  32  11.723   1.498   1.367
  204    HG   CYS  32           HG       CYS  32  13.649  -0.112   2.441
  205    H    VAL  33           H        VAL  33   7.776  -0.290   0.518
  206    HA   VAL  33           HA       VAL  33   8.237  -3.141   1.109
  207    HB   VAL  33           HB       VAL  33   5.559  -1.744   1.021
  208   HG11  VAL  33          1HG1      VAL  33   5.652  -4.127   0.203
  209   HG12  VAL  33          2HG1      VAL  33   6.145  -4.582   1.835
  210   HG13  VAL  33          3HG1      VAL  33   4.573  -3.830   1.566
  211   HG21  VAL  33          1HG2      VAL  33   6.849  -3.026   3.414
  212   HG22  VAL  33          2HG2      VAL  33   7.059  -1.317   3.033
  213   HG23  VAL  33          3HG2      VAL  33   5.449  -1.955   3.364
  214    H    ASN  34           H        ASN  34   8.635  -4.207  -0.707
  215    HA   ASN  34           HA       ASN  34   8.673  -4.805  -2.906
  216    HB2  ASN  34           1HB      ASN  34   5.772  -3.947  -2.789
  217    HB3  ASN  34           2HB      ASN  34   6.489  -5.029  -3.979
  218   HD21  ASN  34          1HD2      ASN  34   4.363  -5.929  -2.666
  219   HD22  ASN  34          2HD2      ASN  34   4.805  -7.121  -1.496
  220    H    GLY  35           H        GLY  35   9.381  -2.047  -2.280
  221    HA2  GLY  35           1HA      GLY  35  10.251  -0.458  -3.803
  222    HA3  GLY  35           2HA      GLY  35   9.044  -0.960  -4.978
  223    H    HIS  36           H        HIS  36   6.870  -0.812  -2.989
  224    HA   HIS  36           HA       HIS  36   6.367   2.036  -3.254
  225    HB2  HIS  36           1HB      HIS  36   4.496   0.001  -2.055
  226    HB3  HIS  36           2HB      HIS  36   4.093   1.543  -2.804
  227    HD1  HIS  36           1HD      HIS  36   5.243   1.449  -5.502
  228    HD2  HIS  36           2HD      HIS  36   3.666  -1.952  -3.711
  229    HE1  HIS  36           1HE      HIS  36   4.682  -0.109  -7.395
  230    H    PHE  37           H        PHE  37   6.446   3.483  -1.652
  231    HA   PHE  37           HA       PHE  37   7.243   2.557   0.994
  232    HB2  PHE  37           1HB      PHE  37   7.114   5.347  -0.170
  233    HB3  PHE  37           2HB      PHE  37   7.732   4.945   1.429
  234    HD1  PHE  37           1HD      PHE  37   8.240   3.953  -2.132
  235    HD2  PHE  37           2HD      PHE  37  10.000   4.715   1.667
  236    HE1  PHE  37           1HE      PHE  37  10.473   3.579  -3.096
  237    HE2  PHE  37           2HE      PHE  37  12.236   4.343   0.710
  238    HZ   PHE  37           HZ       PHE  37  12.474   3.775  -1.675
  239    H    PHE  38           H        PHE  38   6.201   3.219   2.913
  240    HA   PHE  38           HA       PHE  38   3.579   4.469   2.681
  241    HB2  PHE  38           1HB      PHE  38   3.953   1.763   3.981
  242    HB3  PHE  38           2HB      PHE  38   2.455   2.687   3.922
  243    HD1  PHE  38           1HD      PHE  38   4.813   0.651   2.003
  244    HD2  PHE  38           2HD      PHE  38   1.141   2.802   1.910
  245    HE1  PHE  38           1HE      PHE  38   4.232  -0.439  -0.125
  246    HE2  PHE  38           2HE      PHE  38   0.554   1.715  -0.217
  247    HZ   PHE  38           HZ       PHE  38   2.100   0.092  -1.238
  248    H    HIS  39           H        HIS  39   2.762   5.285   4.663
  249    HA   HIS  39           HA       HIS  39   4.758   6.253   6.424
  250    HB2  HIS  39           1HB      HIS  39   1.768   6.392   6.337
  251    HB3  HIS  39           2HB      HIS  39   2.613   6.903   7.795
  252    HD2  HIS  39           2HD      HIS  39   5.107   8.440   6.145
  253    HE1  HIS  39           1HE      HIS  39   1.924  10.847   4.707
  254    HE2  HIS  39           2HE      HIS  39   4.422  10.625   4.943
  255    H    ARG  40           H        ARG  40   4.570   6.030   8.845
  256    HA   ARG  40           HA       ARG  40   4.716   3.236   9.511
  257    HB2  ARG  40           1HB      ARG  40   5.027   5.697  11.241
  258    HB3  ARG  40           2HB      ARG  40   5.378   4.051  11.751
  259    HG2  ARG  40           1HG      ARG  40   6.959   4.081   9.654
  260    HG3  ARG  40           2HG      ARG  40   6.881   5.827   9.902
  261    HD2  ARG  40           1HD      ARG  40   7.499   3.958  12.164
  262    HD3  ARG  40           2HD      ARG  40   8.761   4.501  11.059
  263    HE   ARG  40           HE       ARG  40   7.713   6.826  11.789
  264   HH11  ARG  40          2HH1      ARG  40   8.557   4.043  13.702
  265   HH12  ARG  40          1HH1      ARG  40   8.920   4.966  15.123
  266   HH21  ARG  40          2HH2      ARG  40   8.188   8.053  13.653
  267   HH22  ARG  40          1HH2      ARG  40   8.708   7.247  15.094
  268    H    SER  41           H        SER  41   2.317   5.659   9.625
  269    HA   SER  41           HA       SER  41   0.767   4.243  11.666
  270    HB2  SER  41           1HB      SER  41   1.064   6.805  11.615
  271    HB3  SER  41           2HB      SER  41  -0.081   6.777  10.275
  272    HG   SER  41           HG       SER  41  -0.651   6.782  12.821
  273    H    CYS  42           H        CYS  42   0.495   5.371   8.311
  274    HA   CYS  42           HA       CYS  42  -2.052   4.298   7.799
  275    HB2  CYS  42           1HB      CYS  42   0.247   4.903   5.932
  276    HB3  CYS  42           2HB      CYS  42  -1.368   4.458   5.389
  277    H    PHE  43           H        PHE  43   1.146   2.889   7.734
  278    HA   PHE  43           HA       PHE  43   0.382   0.506   6.351
  279    HB2  PHE  43           1HB      PHE  43   2.723   1.428   6.460
  280    HB3  PHE  43           2HB      PHE  43   2.786   0.902   8.139
  281    HD1  PHE  43           2HD      PHE  43   1.882  -0.510   4.802
  282    HD2  PHE  43           1HD      PHE  43   3.813  -1.100   8.549
  283    HE1  PHE  43           2HE      PHE  43   2.614  -2.742   4.069
  284    HE2  PHE  43           1HE      PHE  43   4.549  -3.333   7.822
  285    HZ   PHE  43           HZ       PHE  43   3.949  -4.156   5.580
  286    H    ARG  44           H        ARG  44  -1.297  -0.528   7.340
  287    HA   ARG  44           HA       ARG  44  -0.665  -1.941   9.794
  288    HB2  ARG  44           1HB      ARG  44  -3.165  -1.248  10.488
  289    HB3  ARG  44           2HB      ARG  44  -1.742  -0.359  11.016
  290    HG2  ARG  44           1HG      ARG  44  -3.183   1.303  10.288
  291    HG3  ARG  44           2HG      ARG  44  -2.106   1.066   8.910
  292    HD2  ARG  44           1HD      ARG  44  -3.920  -0.638   8.140
  293    HD3  ARG  44           2HD      ARG  44  -4.961   0.251   9.251
  294    HE   ARG  44           HE       ARG  44  -3.989   2.249   7.821
  295   HH11  ARG  44          2HH1      ARG  44  -5.149  -0.864   6.779
  296   HH12  ARG  44          1HH1      ARG  44  -5.687  -0.292   5.235
  297   HH21  ARG  44          2HH2      ARG  44  -4.693   3.014   5.790
  298   HH22  ARG  44          1HH2      ARG  44  -5.426   1.914   4.673
  299    H    CYS  45           H        CYS  45  -2.647  -3.405  10.370
  300    HA   CYS  45           HA       CYS  45  -3.001  -5.248   8.349
  301    HB2  CYS  45           1HB      CYS  45  -3.445  -5.587  10.807
  302    HB3  CYS  45           2HB      CYS  45  -4.983  -4.760  10.579
  303    H    HIS  46           H        HIS  46  -5.037  -5.916   7.281
  304    HA   HIS  46           HA       HIS  46  -6.414  -3.556   6.209
  305    HB2  HIS  46           1HB      HIS  46  -5.354  -4.845   4.492
  306    HB3  HIS  46           2HB      HIS  46  -6.037  -6.345   5.112
  307    HD1  HIS  46           1HD      HIS  46  -6.723  -3.554   2.824
  308    HD2  HIS  46           2HD      HIS  46  -8.863  -6.626   4.625
  309    HE1  HIS  46           1HE      HIS  46  -8.888  -3.701   1.553
  310    H    THR  47           H        THR  47  -6.883  -5.826   8.517
  311    HA   THR  47           HA       THR  47  -9.804  -5.852   8.108
  312    HB   THR  47           HB       THR  47  -8.017  -7.939   9.346
  313    HG1  THR  47           1HG      THR  47  -9.834  -7.829   7.173
  314   HG21  THR  47          1HG2      THR  47 -10.014  -9.127  10.070
  315   HG22  THR  47          2HG2      THR  47 -11.031  -7.809   9.489
  316   HG23  THR  47          3HG2      THR  47  -9.934  -7.544  10.844
  317    H    CYS  48           H        CYS  48  -7.174  -5.528  10.429
  318    HA   CYS  48           HA       CYS  48  -9.099  -4.448  12.382
  319    HB2  CYS  48           1HB      CYS  48  -7.421  -5.008  14.113
  320    HB3  CYS  48           2HB      CYS  48  -7.970  -6.428  13.229
  321    H    GLU  49           H        GLU  49  -6.689  -3.615  10.228
  322    HA   GLU  49           HA       GLU  49  -5.456  -1.738   9.857
  323    HB2  GLU  49           1HB      GLU  49  -7.446  -0.473  11.749
  324    HB3  GLU  49           2HB      GLU  49  -6.406   0.381  10.618
  325    HG2  GLU  49           1HG      GLU  49  -8.280  -1.689   9.585
  326    HG3  GLU  49           2HG      GLU  49  -8.906  -0.105  10.040
  327    H    ALA  50           H        ALA  50  -4.318  -3.397  11.695
  328    HA   ALA  50           HA       ALA  50  -3.378  -1.650  13.863
  329    HB1  ALA  50           1HB      ALA  50  -3.119  -4.637  13.530
  330    HB2  ALA  50           2HB      ALA  50  -2.514  -3.703  14.899
  331    HB3  ALA  50           3HB      ALA  50  -4.248  -3.795  14.591
  332    H    THR  51           H        THR  51  -1.397  -0.811  13.810
  333    HA   THR  51           HA       THR  51   0.254  -0.646  11.692
  334    HB   THR  51           HB       THR  51   1.234  -0.846  14.546
  335    HG1  THR  51           1HG      THR  51   1.103   1.619  14.025
  336   HG21  THR  51          1HG2      THR  51   2.477   0.081  11.992
  337   HG22  THR  51          2HG2      THR  51   3.182  -0.856  13.310
  338   HG23  THR  51          3HG2      THR  51   2.913   0.876  13.504
  339    H    LEU  52           H        LEU  52   1.094  -2.169  10.433
  340    HA   LEU  52           HA       LEU  52   1.681  -4.807  11.436
  341    HB2  LEU  52           1HB      LEU  52   2.120  -3.582   8.717
  342    HB3  LEU  52           2HB      LEU  52   2.337  -5.286   9.111
  343    HG   LEU  52           HG       LEU  52  -0.288  -3.806   9.273
  344   HD11  LEU  52          1HD1      LEU  52   0.654  -5.759   7.181
  345   HD12  LEU  52          2HD1      LEU  52   0.584  -4.011   6.963
  346   HD13  LEU  52          3HD1      LEU  52  -0.899  -4.925   7.237
  347   HD21  LEU  52          1HD2      LEU  52   0.460  -6.107  10.551
  348   HD22  LEU  52          2HD2      LEU  52  -0.263  -6.720   9.064
  349   HD23  LEU  52          3HD2      LEU  52  -1.194  -5.665  10.127
  350    H    TRP  53           H        TRP  53   3.401  -4.715  12.822
  351    HA   TRP  53           HA       TRP  53   5.762  -3.224  12.343
  352    HB2  TRP  53           1HB      TRP  53   5.816  -5.669  14.059
  353    HB3  TRP  53           2HB      TRP  53   6.540  -4.087  14.337
  354    HD1  TRP  53           HD       TRP  53   3.152  -5.898  14.587
  355    HE1  TRP  53           1HE      TRP  53   1.662  -4.601  16.237
  356    HE3  TRP  53           3HE      TRP  53   6.172  -1.854  15.402
  357    HZ2  TRP  53           2HZ      TRP  53   1.754  -2.184  17.691
  358    HZ3  TRP  53           3HZ      TRP  53   5.397  -0.094  16.937
  359    HH2  TRP  53           HH       TRP  53   3.233  -0.257  18.056
  360    HA   PRO  54           HA       PRO  54   8.085  -5.775   9.631
  361    HB2  PRO  54           1HB      PRO  54  10.608  -5.404  10.562
  362    HB3  PRO  54           2HB      PRO  54   9.715  -4.156   9.685
  363    HG2  PRO  54           1HG      PRO  54  10.119  -4.478  12.634
  364    HG3  PRO  54           2HG      PRO  54  10.198  -3.006  11.648
  365    HD2  PRO  54           1HD      PRO  54   8.028  -3.650  13.135
  366    HD3  PRO  54           2HD      PRO  54   7.906  -2.765  11.600
  367    H    GLY  55           H        GLY  55   7.294  -6.774  12.566
  368    HA2  GLY  55           1HA      GLY  55   8.686  -9.325  12.226
  369    HA3  GLY  55           2HA      GLY  55   8.888  -8.495  13.762
  370    H    GLY  56           H        GLY  56   5.931  -8.539  11.847
  371    HA2  GLY  56           1HA      GLY  56   4.669 -10.664  13.226
  372    HA3  GLY  56           2HA      GLY  56   4.259  -9.138  13.994
  373    H    TYR  57           H        TYR  57   4.709 -10.005  10.574
  374    HA   TYR  57           HA       TYR  57   1.892  -9.758  10.024
  375    HB2  TYR  57           1HB      TYR  57   1.851  -7.766   8.863
  376    HB3  TYR  57           2HB      TYR  57   3.015  -7.377  10.124
  377    HD1  TYR  57           2HD      TYR  57   5.505  -7.647   9.550
  378    HD2  TYR  57           1HD      TYR  57   2.430  -7.540   6.611
  379    HE1  TYR  57           2HE      TYR  57   7.170  -7.060   7.837
  380    HE2  TYR  57           1HE      TYR  57   4.087  -6.954   4.890
  381    HH   TYR  57           HH       TYR  57   6.370  -6.981   4.448
  382    H    GLU  58           H        GLU  58   1.393 -10.168   7.742
  383    HA   GLU  58           HA       GLU  58   3.537 -11.247   6.108
  384    HB2  GLU  58           1HB      GLU  58   1.473 -12.920   7.456
  385    HB3  GLU  58           2HB      GLU  58   1.924 -13.342   5.810
  386    HG2  GLU  58           1HG      GLU  58   4.033 -12.914   7.879
  387    HG3  GLU  58           2HG      GLU  58   3.155 -14.440   7.801
  388    H    GLN  59           H        GLN  59   2.954 -11.548   3.916
  389    HA   GLN  59           HA       GLN  59   0.492 -10.124   3.168
  390    HB2  GLN  59           1HB      GLN  59   2.410  -8.973   2.340
  391    HB3  GLN  59           2HB      GLN  59   3.124 -10.463   1.737
  392    HG2  GLN  59           1HG      GLN  59   0.954 -10.547   0.274
  393    HG3  GLN  59           2HG      GLN  59   0.927  -8.814   0.597
  394   HE21  GLN  59          1HE2      GLN  59   1.132  -9.161  -1.890
  395   HE22  GLN  59          2HE2      GLN  59   2.744  -9.057  -2.501
  396    H    HIS  60           H        HIS  60  -1.071 -11.583   2.825
  397    HA   HIS  60           HA       HIS  60  -0.750 -14.236   2.045
  398    HB2  HIS  60           1HB      HIS  60  -2.829 -13.082   2.999
  399    HB3  HIS  60           2HB      HIS  60  -3.176 -12.590   1.344
  400    HD1  HIS  60           1HD      HIS  60  -4.206 -14.312  -0.189
  401    HD2  HIS  60           2HD      HIS  60  -2.965 -15.912   3.439
  402    HE1  HIS  60           1HE      HIS  60  -5.130 -16.650  -0.134
  403    HA   PRO  61           HA       PRO  61   0.458 -13.645  -2.203
  404    HB2  PRO  61           1HB      PRO  61   0.624 -16.286  -2.810
  405    HB3  PRO  61           2HB      PRO  61   1.867 -15.433  -1.889
  406    HG2  PRO  61           1HG      PRO  61  -0.355 -17.180  -0.903
  407    HG3  PRO  61           2HG      PRO  61   1.340 -17.126  -0.385
  408    HD2  PRO  61           1HD      PRO  61  -0.649 -15.933   1.012
  409    HD3  PRO  61           2HD      PRO  61   1.002 -15.283   0.958
  410    H    GLY  62           H        GLY  62  -2.247 -15.580  -1.079
  411    HA2  GLY  62           1HA      GLY  62  -3.460 -16.380  -3.403
  412    HA3  GLY  62           2HA      GLY  62  -4.348 -15.859  -1.978
  413    H    ASP  63           H        ASP  63  -4.595 -13.446  -1.749
  414    HA   ASP  63           HA       ASP  63  -5.587 -12.407  -4.259
  415    HB2  ASP  63           1HB      ASP  63  -6.619 -12.235  -1.826
  416    HB3  ASP  63           2HB      ASP  63  -5.611 -10.793  -1.746
  417    H    GLY  64           H        GLY  64  -3.272 -11.332  -1.770
  418    HA2  GLY  64           1HA      GLY  64  -1.100 -10.506  -2.589
  419    HA3  GLY  64           2HA      GLY  64  -1.990  -9.676  -3.856
  420    H    HIS  65           H        HIS  65  -2.573  -9.890  -0.356
  421    HA   HIS  65           HA       HIS  65  -2.220  -6.971  -0.204
  422    HB2  HIS  65           1HB      HIS  65  -4.486  -8.656   0.823
  423    HB3  HIS  65           2HB      HIS  65  -4.084  -7.126   1.598
  424    HD1  HIS  65           1HD      HIS  65  -4.764  -4.989   0.404
  425    HD2  HIS  65           2HD      HIS  65  -5.489  -8.417  -1.828
  426    HE1  HIS  65           1HE      HIS  65  -6.168  -4.239  -1.543
  427    H    PHE  66           H        PHE  66  -2.413  -6.441   2.366
  428    HA   PHE  66           HA       PHE  66  -0.463  -8.226   3.668
  429    HB2  PHE  66           1HB      PHE  66  -0.700  -5.217   3.760
  430    HB3  PHE  66           2HB      PHE  66   0.278  -6.134   4.901
  431    HD1  PHE  66           1HD      PHE  66   2.279  -7.325   4.147
  432    HD2  PHE  66           2HD      PHE  66   0.005  -4.884   1.503
  433    HE1  PHE  66           1HE      PHE  66   4.159  -7.298   2.560
  434    HE2  PHE  66           2HE      PHE  66   1.881  -4.854  -0.088
  435    HZ   PHE  66           HZ       PHE  66   3.961  -6.063   0.439
  436    H    TYR  67           H        TYR  67  -1.141  -9.167   5.469
  437    HA   TYR  67           HA       TYR  67  -3.168  -7.815   7.110
  438    HB2  TYR  67           1HB      TYR  67  -3.216 -10.766   6.451
  439    HB3  TYR  67           2HB      TYR  67  -4.389  -9.886   7.424
  440    HD1  TYR  67           1HD      TYR  67  -5.959  -8.313   6.350
  441    HD2  TYR  67           2HD      TYR  67  -3.297 -10.712   4.056
  442    HE1  TYR  67           1HE      TYR  67  -7.299  -7.865   4.337
  443    HE2  TYR  67           2HE      TYR  67  -4.628 -10.269   2.037
  444    HH   TYR  67           HH       TYR  67  -6.329  -8.162   1.379
  445    H    CYS  68           H        CYS  68  -3.297  -8.686   9.326
  446    HA   CYS  68           HA       CYS  68  -0.679  -8.981  10.432
  447    HB2  CYS  68           1HB      CYS  68  -1.784  -8.964  12.587
  448    HB3  CYS  68           2HB      CYS  68  -2.506  -7.730  11.559
  449    H    LEU  69           H        LEU  69  -0.346 -10.706  12.197
  450    HA   LEU  69           HA       LEU  69  -0.561 -13.273  10.913
  451    HB2  LEU  69           1HB      LEU  69   0.507 -12.671  13.662
  452    HB3  LEU  69           2HB      LEU  69   0.840 -14.088  12.668
  453    HG   LEU  69           HG       LEU  69   1.795 -11.270  12.172
  454   HD11  LEU  69          1HD1      LEU  69   3.173 -13.802  13.037
  455   HD12  LEU  69          2HD1      LEU  69   3.065 -12.273  13.909
  456   HD13  LEU  69          3HD1      LEU  69   4.029 -12.381  12.437
  457   HD21  LEU  69          1HD2      LEU  69   2.510 -13.712  10.574
  458   HD22  LEU  69          2HD2      LEU  69   2.832 -12.018  10.200
  459   HD23  LEU  69          3HD2      LEU  69   1.183 -12.642  10.119
  460    H    GLN  70           H        GLN  70  -2.912 -11.731  12.207
  461    HA   GLN  70           HA       GLN  70  -3.971 -14.052  13.676
  462    HB2  GLN  70           1HB      GLN  70  -3.491 -12.209  15.233
  463    HB3  GLN  70           2HB      GLN  70  -4.507 -11.138  14.278
  464    HG2  GLN  70           1HG      GLN  70  -6.437 -12.608  14.761
  465    HG3  GLN  70           2HG      GLN  70  -5.396 -13.569  15.810
  466   HE21  GLN  70          1HE2      GLN  70  -5.262 -13.007  17.869
  467   HE22  GLN  70          2HE2      GLN  70  -5.791 -11.506  18.542
  468    H    HIS  71           H        HIS  71  -4.295 -11.924  11.089
  469    HA   HIS  71           HA       HIS  71  -7.090 -12.765  10.686
  470    HB2  HIS  71           1HB      HIS  71  -5.776 -10.114  10.199
  471    HB3  HIS  71           2HB      HIS  71  -7.157 -10.601   9.221
  472    HD2  HIS  71           2HD      HIS  71  -8.182 -12.007  12.402
  473    HE1  HIS  71           1HE      HIS  71  -9.213  -7.910  12.789
  474    HE2  HIS  71           2HE      HIS  71  -9.459 -10.218  13.766
  475    H    LEU  72           H        LEU  72  -3.901 -12.650   9.476
  476    HA   LEU  72           HA       LEU  72  -4.146 -12.683   6.748
  477    HB2  LEU  72           1HB      LEU  72  -2.030 -12.825   8.047
  478    HB3  LEU  72           2HB      LEU  72  -2.376 -14.528   8.344
  479    HG   LEU  72           HG       LEU  72  -2.460 -14.564   5.681
  480   HD11  LEU  72          1HD1      LEU  72  -2.055 -12.263   5.271
  481   HD12  LEU  72          2HD1      LEU  72  -0.573 -13.126   4.861
  482   HD13  LEU  72          3HD1      LEU  72  -0.685 -12.238   6.380
  483   HD21  LEU  72          1HD2      LEU  72   0.241 -14.513   6.961
  484   HD22  LEU  72          2HD2      LEU  72  -0.407 -15.622   5.752
  485   HD23  LEU  72          3HD2      LEU  72  -0.939 -15.738   7.430
  486    HA   PRO  73           HA       PRO  73  -6.848 -16.180   6.127
  487    HB2  PRO  73           1HB      PRO  73  -6.953 -15.954   3.424
  488    HB3  PRO  73           2HB      PRO  73  -7.874 -14.909   4.511
  489    HG2  PRO  73           1HG      PRO  73  -5.286 -14.369   3.107
  490    HG3  PRO  73           2HG      PRO  73  -6.690 -13.305   3.315
  491    HD2  PRO  73           1HD      PRO  73  -4.466 -13.100   4.847
  492    HD3  PRO  73           2HD      PRO  73  -6.088 -12.723   5.463
  493    H    GLN  74           H        GLN  74  -6.788 -17.967   4.261
  494    HA   GLN  74           HA       GLN  74  -4.106 -18.762   3.529
  495    HB2  GLN  74           1HB      GLN  74  -5.603 -20.023   5.761
  496    HB3  GLN  74           2HB      GLN  74  -4.769 -21.104   4.653
  497    HG2  GLN  74           1HG      GLN  74  -3.473 -18.819   6.120
  498    HG3  GLN  74           2HG      GLN  74  -3.435 -20.504   6.637
  499   HE21  GLN  74          1HE2      GLN  74  -1.708 -18.190   5.135
  500   HE22  GLN  74          2HE2      GLN  74  -0.678 -19.168   4.152
  501    H    THR  75           H        THR  75  -4.135 -19.805   1.641
  502    HA   THR  75           HA       THR  75  -6.716 -20.538   0.506
  503    HB   THR  75           HB       THR  75  -5.156 -19.168  -0.837
  504    HG1  THR  75           1HG      THR  75  -5.848 -20.158  -2.598
  505   HG21  THR  75          1HG2      THR  75  -3.051 -19.827  -1.452
  506   HG22  THR  75          2HG2      THR  75  -3.437 -21.544  -1.344
  507   HG23  THR  75          3HG2      THR  75  -3.151 -20.610   0.124
  508    H    ASP  76           H        ASP  76  -6.637 -22.537  -0.990
  509    HA   ASP  76           HA       ASP  76  -5.526 -24.761   0.581
  510    HB2  ASP  76           1HB      ASP  76  -7.266 -26.148  -0.544
  511    HB3  ASP  76           2HB      ASP  76  -7.936 -24.847   0.437
  512    H    SER  77           H        SER  77  -3.801 -23.433  -1.139
  513    HA   SER  77           HA       SER  77  -3.469 -25.396  -3.313
  514    HB2  SER  77           1HB      SER  77  -2.482 -23.697  -4.688
  515    HB3  SER  77           2HB      SER  77  -3.990 -23.038  -4.054
  516    HG   SER  77           HG       SER  77  -1.448 -22.584  -2.882
  517    H    GLY  78           H        GLY  78  -1.997 -23.649  -0.687
  518    HA2  GLY  78           1HA      GLY  78   0.706 -24.290  -1.239
  519    HA3  GLY  78           2HA      GLY  78   0.059 -23.819   0.325
  520    HA   PRO  79           HA       PRO  79   0.738 -27.886   1.811
  521    HB2  PRO  79           1HB      PRO  79  -1.226 -28.085   3.675
  522    HB3  PRO  79           2HB      PRO  79   0.210 -27.079   3.896
  523    HG2  PRO  79           1HG      PRO  79  -2.545 -26.285   3.036
  524    HG3  PRO  79           2HG      PRO  79  -1.454 -25.479   4.177
  525    HD2  PRO  79           1HD      PRO  79  -1.763 -24.644   1.620
  526    HD3  PRO  79           2HD      PRO  79  -0.228 -24.485   2.498
  527    H    SER  80           H        SER  80  -2.281 -27.008   0.384
  528    HA   SER  80           HA       SER  80  -4.041 -28.219  -0.448
  529    HB2  SER  80           1HB      SER  80  -3.387 -29.848  -2.077
  530    HB3  SER  80           2HB      SER  80  -2.124 -28.619  -2.050
  531    HG   SER  80           HG       SER  80  -2.007 -31.053  -0.597
  532    H    SER  81           H        SER  81  -3.738 -28.703   2.268
  533    HA   SER  81           HA       SER  81  -3.563 -31.404   2.999
  534    HB2  SER  81           1HB      SER  81  -5.138 -29.181   4.321
  535    HB3  SER  81           2HB      SER  81  -4.730 -30.726   5.066
  536    HG   SER  81           HG       SER  81  -3.168 -29.341   5.722
  537    H    GLY  82           H        GLY  82  -6.498 -29.415   2.556
  538    HA2  GLY  82           1HA      GLY  82  -8.106 -30.690   0.973
  539    HA3  GLY  82           2HA      GLY  82  -8.042 -31.898   2.249
  Start of MODEL   12
    1    H1   GLY   1           H        GLY   1 -20.975  -3.926 -22.507
    2    HA2  GLY   1           1HA      GLY   1 -22.368  -2.376 -24.551
    3    HA3  GLY   1           2HA      GLY   1 -23.014  -2.289 -22.919
    4    H    SER   2           H        SER   2 -21.417  -1.658 -21.205
    5    HA   SER   2           HA       SER   2 -19.694   0.480 -22.260
    6    HB2  SER   2           1HB      SER   2 -21.694   0.855 -20.570
    7    HB3  SER   2           2HB      SER   2 -20.493   0.354 -19.380
    8    HG   SER   2           HG       SER   2 -20.780   2.735 -20.390
    9    H    SER   3           H        SER   3 -17.565   0.324 -22.037
   10    HA   SER   3           HA       SER   3 -16.476  -1.882 -20.468
   11    HB2  SER   3           1HB      SER   3 -15.330  -0.080 -22.595
   12    HB3  SER   3           2HB      SER   3 -14.302  -1.132 -21.622
   13    HG   SER   3           HG       SER   3 -16.554  -2.088 -23.046
   14    H    GLY   4           H        GLY   4 -15.756   1.585 -20.940
   15    HA2  GLY   4           1HA      GLY   4 -15.622   3.036 -18.989
   16    HA3  GLY   4           2HA      GLY   4 -14.942   1.679 -18.104
   17    H    SER   5           H        SER   5 -13.249   3.217 -17.534
   18    HA   SER   5           HA       SER   5 -10.972   2.912 -19.233
   19    HB2  SER   5           1HB      SER   5 -12.137   4.855 -20.302
   20    HB3  SER   5           2HB      SER   5 -11.950   5.742 -18.789
   21    HG   SER   5           HG       SER   5  -9.981   4.902 -20.616
   22    H    SER   6           H        SER   6  -9.057   4.201 -18.281
   23    HA   SER   6           HA       SER   6  -9.322   4.302 -15.348
   24    HB2  SER   6           1HB      SER   6  -8.029   2.299 -16.504
   25    HB3  SER   6           2HB      SER   6  -6.728   3.486 -16.589
   26    HG   SER   6           HG       SER   6  -8.109   3.076 -14.173
   27    H    GLY   7           H        GLY   7  -7.510   5.540 -14.301
   28    HA2  GLY   7           1HA      GLY   7  -6.752   7.834 -16.006
   29    HA3  GLY   7           2HA      GLY   7  -7.254   8.011 -14.331
   30    H    GLN   8           H        GLN   8  -4.654   8.234 -16.181
   31    HA   GLN   8           HA       GLN   8  -2.863   7.524 -13.983
   32    HB2  GLN   8           1HB      GLN   8  -2.675   6.506 -16.803
   33    HB3  GLN   8           2HB      GLN   8  -1.234   6.674 -15.808
   34    HG2  GLN   8           1HG      GLN   8  -3.650   5.040 -15.068
   35    HG3  GLN   8           2HG      GLN   8  -2.179   4.398 -15.797
   36   HE21  GLN   8          1HE2      GLN   8  -0.189   4.635 -14.592
   37   HE22  GLN   8          2HE2      GLN   8  -0.239   4.644 -12.865
   38    H    HIS   9           H        HIS   9  -1.986   9.415 -13.462
   39    HA   HIS   9           HA       HIS   9  -1.089  11.186 -15.641
   40    HB2  HIS   9           1HB      HIS   9  -2.405  11.751 -13.031
   41    HB3  HIS   9           2HB      HIS   9  -1.196  12.900 -13.597
   42    HD1  HIS   9           1HD      HIS   9  -1.759  14.251 -15.743
   43    HD2  HIS   9           2HD      HIS   9  -4.807  11.743 -14.446
   44    HE1  HIS   9           1HE      HIS   9  -3.807  14.971 -17.012
   45    H    GLN  10           H        GLN  10   1.039  11.048 -15.885
   46    HA   GLN  10           HA       GLN  10   2.777  10.146 -13.798
   47    HB2  GLN  10           1HB      GLN  10   3.262  11.199 -16.579
   48    HB3  GLN  10           2HB      GLN  10   4.578  10.761 -15.498
   49    HG2  GLN  10           1HG      GLN  10   3.697   8.481 -15.359
   50    HG3  GLN  10           2HG      GLN  10   2.399   8.925 -16.466
   51   HE21  GLN  10          1HE2      GLN  10   5.838   8.412 -16.140
   52   HE22  GLN  10          2HE2      GLN  10   6.167   8.219 -17.825
   53    H    GLU  11           H        GLU  11   4.705  11.361 -13.098
   54    HA   GLU  11           HA       GLU  11   4.378  14.269 -13.112
   55    HB2  GLU  11           1HB      GLU  11   3.292  13.195 -11.054
   56    HB3  GLU  11           2HB      GLU  11   4.927  12.799 -10.542
   57    HG2  GLU  11           1HG      GLU  11   4.062  14.858  -9.513
   58    HG3  GLU  11           2HG      GLU  11   5.526  15.121 -10.460
   59    H    ALA  12           H        ALA  12   6.311  15.401 -12.283
   60    HA   ALA  12           HA       ALA  12   8.755  13.812 -12.728
   61    HB1  ALA  12           1HB      ALA  12   7.816  16.027 -14.187
   62    HB2  ALA  12           2HB      ALA  12   9.202  16.588 -13.250
   63    HB3  ALA  12           3HB      ALA  12   9.371  15.209 -14.337
   64    H    GLY  13           H        GLY  13  10.721  14.746 -11.705
   65    HA2  GLY  13           1HA      GLY  13  11.722  16.116 -10.019
   66    HA3  GLY  13           2HA      GLY  13  10.134  16.324  -9.294
   67    H    ALA  14           H        ALA  14   9.539  15.017  -7.663
   68    HA   ALA  14           HA       ALA  14  11.337  12.769  -7.025
   69    HB1  ALA  14           1HB      ALA  14  11.680  14.208  -5.266
   70    HB2  ALA  14           2HB      ALA  14  10.023  14.812  -5.294
   71    HB3  ALA  14           3HB      ALA  14  10.366  13.212  -4.638
   72    H    GLY  15           H        GLY  15  10.365  10.934  -5.927
   73    HA2  GLY  15           1HA      GLY  15   7.461  10.679  -6.327
   74    HA3  GLY  15           2HA      GLY  15   8.537   9.480  -7.030
   75    H    ASP  16           H        ASP  16   8.597  11.092  -3.862
   76    HA   ASP  16           HA       ASP  16   8.435   8.423  -2.621
   77    HB2  ASP  16           1HB      ASP  16   9.887  10.855  -1.557
   78    HB3  ASP  16           2HB      ASP  16   9.843   9.259  -0.813
   79    H    LEU  17           H        LEU  17   6.095   8.776  -2.665
   80    HA   LEU  17           HA       LEU  17   5.240  10.314  -0.315
   81    HB2  LEU  17           1HB      LEU  17   3.534  10.166  -2.772
   82    HB3  LEU  17           2HB      LEU  17   3.410  11.270  -1.404
   83    HG   LEU  17           HG       LEU  17   5.666  11.348  -3.400
   84   HD11  LEU  17          1HD1      LEU  17   2.926  12.208  -3.680
   85   HD12  LEU  17          2HD1      LEU  17   4.233  12.204  -4.864
   86   HD13  LEU  17          3HD1      LEU  17   4.040  13.573  -3.770
   87   HD21  LEU  17          1HD2      LEU  17   4.694  13.491  -1.527
   88   HD22  LEU  17          2HD2      LEU  17   6.197  13.445  -2.450
   89   HD23  LEU  17          3HD2      LEU  17   5.959  12.341  -1.094
   90    H    CYS  18           H        CYS  18   3.947   9.221   1.032
   91    HA   CYS  18           HA       CYS  18   3.608   6.582   1.163
   92    HB2  CYS  18           1HB      CYS  18   2.773   8.263   2.832
   93    HB3  CYS  18           2HB      CYS  18   1.344   8.474   1.826
   94    H    ALA  19           H        ALA  19   2.266   4.976   0.409
   95    HA   ALA  19           HA       ALA  19   0.834   5.611  -2.064
   96    HB1  ALA  19           1HB      ALA  19   1.381   3.561  -2.818
   97    HB2  ALA  19           2HB      ALA  19   2.617   3.649  -1.562
   98    HB3  ALA  19           3HB      ALA  19   1.105   2.795  -1.253
   99    H    LEU  20           H        LEU  20  -0.006   5.706   0.986
  100    HA   LEU  20           HA       LEU  20  -2.521   4.215   0.677
  101    HB2  LEU  20           1HB      LEU  20  -0.889   5.045   3.026
  102    HB3  LEU  20           2HB      LEU  20  -2.630   4.864   3.227
  103    HG   LEU  20           HG       LEU  20  -1.133   2.609   1.998
  104   HD11  LEU  20          1HD1      LEU  20   0.065   3.583   4.123
  105   HD12  LEU  20          2HD1      LEU  20  -0.156   1.845   3.920
  106   HD13  LEU  20          3HD1      LEU  20  -1.243   2.755   4.968
  107   HD21  LEU  20          1HD2      LEU  20  -2.864   1.329   2.812
  108   HD22  LEU  20          2HD2      LEU  20  -3.683   2.858   2.491
  109   HD23  LEU  20          3HD2      LEU  20  -3.207   2.441   4.138
  110    H    CYS  21           H        CYS  21  -1.272   7.316   1.906
  111    HA   CYS  21           HA       CYS  21  -3.935   8.486   1.489
  112    HB2  CYS  21           1HB      CYS  21  -3.075  10.359   2.905
  113    HB3  CYS  21           2HB      CYS  21  -3.125   8.806   3.733
  114    H    GLY  22           H        GLY  22  -0.520   8.874   0.698
  115    HA2  GLY  22           1HA      GLY  22   0.231   9.690  -1.397
  116    HA3  GLY  22           2HA      GLY  22  -1.308  10.514  -1.599
  117    H    GLU  23           H        GLU  23   0.923  10.598   1.156
  118    HA   GLU  23           HA       GLU  23   1.239  13.490   0.682
  119    HB2  GLU  23           1HB      GLU  23   1.229  12.074   3.353
  120    HB3  GLU  23           2HB      GLU  23   1.369  13.807   3.092
  121    HG2  GLU  23           1HG      GLU  23  -0.868  13.944   2.285
  122    HG3  GLU  23           2HG      GLU  23  -1.023  12.188   2.260
  123    H    HIS  24           H        HIS  24   3.218  14.327   2.014
  124    HA   HIS  24           HA       HIS  24   5.530  13.271   0.860
  125    HB2  HIS  24           1HB      HIS  24   5.118  15.602   1.895
  126    HB3  HIS  24           2HB      HIS  24   5.575  14.851   3.421
  127    HD1  HIS  24           1HD      HIS  24   8.058  13.942   3.575
  128    HD2  HIS  24           2HD      HIS  24   7.209  16.258   0.232
  129    HE1  HIS  24           1HE      HIS  24  10.293  14.592   2.623
  130    H    LEU  25           H        LEU  25   7.266  12.087   1.708
  131    HA   LEU  25           HA       LEU  25   6.589  10.451   4.063
  132    HB2  LEU  25           1HB      LEU  25   7.836   9.777   1.447
  133    HB3  LEU  25           2HB      LEU  25   8.341   8.877   2.875
  134    HG   LEU  25           HG       LEU  25   5.443   9.106   2.132
  135   HD11  LEU  25          1HD1      LEU  25   7.443   7.106   1.092
  136   HD12  LEU  25          2HD1      LEU  25   6.503   8.260   0.147
  137   HD13  LEU  25          3HD1      LEU  25   5.692   6.932   0.975
  138   HD21  LEU  25          1HD2      LEU  25   5.139   7.288   3.545
  139   HD22  LEU  25          2HD2      LEU  25   6.359   8.245   4.387
  140   HD23  LEU  25          3HD2      LEU  25   6.837   6.816   3.469
  141    H    TYR  26           H        TYR  26   8.083  10.200   5.655
  142    HA   TYR  26           HA       TYR  26  10.429  11.937   5.508
  143    HB2  TYR  26           1HB      TYR  26   8.657  11.809   7.459
  144    HB3  TYR  26           2HB      TYR  26   9.655  10.460   7.991
  145    HD1  TYR  26           1HD      TYR  26  10.361  13.860   6.589
  146    HD2  TYR  26           2HD      TYR  26  11.069  11.052   9.706
  147    HE1  TYR  26           1HE      TYR  26  11.920  15.439   7.649
  148    HE2  TYR  26           2HE      TYR  26  12.629  12.624  10.776
  149    HH   TYR  26           HH       TYR  26  13.867  14.521  10.415
  150    H    VAL  27           H        VAL  27  12.512  11.208   6.167
  151    HA   VAL  27           HA       VAL  27  13.314   8.776   5.047
  152    HB   VAL  27           HB       VAL  27  14.910  10.555   5.300
  153   HG11  VAL  27          1HG1      VAL  27  15.797  11.023   7.660
  154   HG12  VAL  27          2HG1      VAL  27  14.246  11.731   7.207
  155   HG13  VAL  27          3HG1      VAL  27  14.296  10.291   8.224
  156   HG21  VAL  27          1HG2      VAL  27  16.789   9.350   6.254
  157   HG22  VAL  27          2HG2      VAL  27  15.690   8.260   7.098
  158   HG23  VAL  27          3HG2      VAL  27  15.764   8.247   5.336
  159    H    LEU  28           H        LEU  28  11.857   9.412   8.048
  160    HA   LEU  28           HA       LEU  28  12.645   6.750   9.037
  161    HB2  LEU  28           1HB      LEU  28  11.975   9.253  10.570
  162    HB3  LEU  28           2HB      LEU  28  12.100   7.660  11.313
  163    HG   LEU  28           HG       LEU  28  14.367   9.009   9.855
  164   HD11  LEU  28          1HD1      LEU  28  13.950  10.410  11.696
  165   HD12  LEU  28          2HD1      LEU  28  15.248   9.335  12.212
  166   HD13  LEU  28          3HD1      LEU  28  13.596   9.048  12.758
  167   HD21  LEU  28          1HD2      LEU  28  14.910   7.009  11.915
  168   HD22  LEU  28          2HD2      LEU  28  15.586   7.185  10.296
  169   HD23  LEU  28          3HD2      LEU  28  14.033   6.378  10.521
  170    H    GLU  29           H        GLU  29  10.209   8.338   7.597
  171    HA   GLU  29           HA       GLU  29   8.154   6.747   8.986
  172    HB2  GLU  29           1HB      GLU  29   7.649   9.351   7.546
  173    HB3  GLU  29           2HB      GLU  29   6.526   8.451   8.554
  174    HG2  GLU  29           1HG      GLU  29   9.079   9.541   9.672
  175    HG3  GLU  29           2HG      GLU  29   7.636  10.543   9.527
  176    H    ARG  30           H        ARG  30   9.774   5.860   6.807
  177    HA   ARG  30           HA       ARG  30   7.681   5.503   4.770
  178    HB2  ARG  30           1HB      ARG  30   9.172   5.786   2.999
  179    HB3  ARG  30           2HB      ARG  30   9.648   7.049   4.125
  180    HG2  ARG  30           1HG      ARG  30  11.431   5.517   4.968
  181    HG3  ARG  30           2HG      ARG  30  11.012   4.410   3.659
  182    HD2  ARG  30           1HD      ARG  30  11.650   5.986   2.005
  183    HD3  ARG  30           2HD      ARG  30  11.764   7.285   3.192
  184    HE   ARG  30           HE       ARG  30  13.559   5.065   3.637
  185   HH11  ARG  30          2HH1      ARG  30  13.100   8.175   2.140
  186   HH12  ARG  30          1HH1      ARG  30  14.794   8.522   2.039
  187   HH21  ARG  30          2HH2      ARG  30  15.793   5.510   3.509
  188   HH22  ARG  30          1HH2      ARG  30  16.325   7.005   2.817
  189    H    LEU  31           H        LEU  31   7.194   3.443   4.388
  190    HA   LEU  31           HA       LEU  31   9.051   1.375   5.352
  191    HB2  LEU  31           1HB      LEU  31   6.096   1.603   5.264
  192    HB3  LEU  31           2HB      LEU  31   6.792   0.001   5.029
  193    HG   LEU  31           HG       LEU  31   7.954   0.246   7.213
  194   HD11  LEU  31          1HD1      LEU  31   6.177   2.425   8.059
  195   HD12  LEU  31          2HD1      LEU  31   7.472   2.897   6.961
  196   HD13  LEU  31          3HD1      LEU  31   7.857   2.094   8.484
  197   HD21  LEU  31          1HD2      LEU  31   6.102  -1.044   7.501
  198   HD22  LEU  31          2HD2      LEU  31   5.006   0.190   6.880
  199   HD23  LEU  31          3HD2      LEU  31   5.646   0.322   8.519
  200    H    CYS  32           H        CYS  32  10.281   0.755   3.676
  201    HA   CYS  32           HA       CYS  32   9.411   0.738   0.976
  202    HB2  CYS  32           1HB      CYS  32  11.534  -0.503   0.555
  203    HB3  CYS  32           2HB      CYS  32  11.760   0.983   1.469
  204    HG   CYS  32           HG       CYS  32  13.518  -0.883   2.511
  205    H    VAL  33           H        VAL  33   7.577  -0.496   0.729
  206    HA   VAL  33           HA       VAL  33   7.888  -3.387   1.224
  207    HB   VAL  33           HB       VAL  33   5.319  -1.797   1.157
  208   HG11  VAL  33          1HG1      VAL  33   4.450  -4.030   2.117
  209   HG12  VAL  33          2HG1      VAL  33   4.734  -3.909   0.380
  210   HG13  VAL  33          3HG1      VAL  33   5.910  -4.722   1.413
  211   HG21  VAL  33          1HG2      VAL  33   6.988  -2.884   3.400
  212   HG22  VAL  33          2HG2      VAL  33   6.322  -1.263   3.198
  213   HG23  VAL  33          3HG2      VAL  33   5.256  -2.611   3.594
  214    H    ASN  34           H        ASN  34   8.291  -4.410  -0.620
  215    HA   ASN  34           HA       ASN  34   8.240  -5.039  -2.806
  216    HB2  ASN  34           1HB      ASN  34   5.418  -3.963  -2.610
  217    HB3  ASN  34           2HB      ASN  34   6.024  -4.979  -3.914
  218   HD21  ASN  34          1HD2      ASN  34   3.959  -6.029  -2.862
  219   HD22  ASN  34          2HD2      ASN  34   4.311  -7.279  -1.724
  220    H    GLY  35           H        GLY  35   9.105  -2.302  -2.123
  221    HA2  GLY  35           1HA      GLY  35  10.142  -0.798  -3.640
  222    HA3  GLY  35           2HA      GLY  35   8.920  -1.204  -4.836
  223    H    HIS  36           H        HIS  36   6.704  -0.887  -2.956
  224    HA   HIS  36           HA       HIS  36   6.425   1.984  -3.207
  225    HB2  HIS  36           1HB      HIS  36   4.411   0.076  -2.023
  226    HB3  HIS  36           2HB      HIS  36   4.115   1.655  -2.744
  227    HD1  HIS  36           1HD      HIS  36   4.663   1.745  -5.427
  228    HD2  HIS  36           2HD      HIS  36   4.051  -1.998  -3.731
  229    HE1  HIS  36           1HE      HIS  36   4.152   0.209  -7.352
  230    H    PHE  37           H        PHE  37   6.259   3.448  -1.565
  231    HA   PHE  37           HA       PHE  37   7.161   2.526   1.059
  232    HB2  PHE  37           1HB      PHE  37   7.027   5.273  -0.190
  233    HB3  PHE  37           2HB      PHE  37   7.496   4.991   1.484
  234    HD1  PHE  37           1HD      PHE  37   8.464   4.568  -2.024
  235    HD2  PHE  37           2HD      PHE  37   9.635   4.056   2.036
  236    HE1  PHE  37           1HE      PHE  37  10.787   4.195  -2.745
  237    HE2  PHE  37           2HE      PHE  37  11.960   3.682   1.322
  238    HZ   PHE  37           HZ       PHE  37  12.539   3.752  -1.071
  239    H    PHE  38           H        PHE  38   6.091   3.043   2.975
  240    HA   PHE  38           HA       PHE  38   3.444   4.267   2.773
  241    HB2  PHE  38           1HB      PHE  38   3.911   1.569   4.062
  242    HB3  PHE  38           2HB      PHE  38   2.387   2.449   4.022
  243    HD1  PHE  38           1HD      PHE  38   4.825   0.570   2.019
  244    HD2  PHE  38           2HD      PHE  38   1.008   2.451   2.077
  245    HE1  PHE  38           1HE      PHE  38   4.255  -0.529  -0.107
  246    HE2  PHE  38           2HE      PHE  38   0.431   1.355  -0.049
  247    HZ   PHE  38           HZ       PHE  38   2.055  -0.138  -1.144
  248    H    HIS  39           H        HIS  39   2.700   5.204   4.679
  249    HA   HIS  39           HA       HIS  39   4.674   6.141   6.461
  250    HB2  HIS  39           1HB      HIS  39   1.660   6.235   6.524
  251    HB3  HIS  39           2HB      HIS  39   2.650   6.964   7.786
  252    HD2  HIS  39           2HD      HIS  39   4.866   8.465   5.920
  253    HE1  HIS  39           1HE      HIS  39   1.503  10.275   4.074
  254    HE2  HIS  39           2HE      HIS  39   4.003  10.346   4.369
  255    H    ARG  40           H        ARG  40   4.960   5.745   8.688
  256    HA   ARG  40           HA       ARG  40   4.832   3.012   9.423
  257    HB2  ARG  40           1HB      ARG  40   5.734   5.535  10.707
  258    HB3  ARG  40           2HB      ARG  40   5.379   4.180  11.770
  259    HG2  ARG  40           1HG      ARG  40   6.911   2.835  10.188
  260    HG3  ARG  40           2HG      ARG  40   7.479   4.419   9.658
  261    HD2  ARG  40           1HD      ARG  40   8.966   3.947  11.349
  262    HD3  ARG  40           2HD      ARG  40   7.735   4.864  12.216
  263    HE   ARG  40           HE       ARG  40   7.361   1.997  12.218
  264   HH11  ARG  40          2HH1      ARG  40   8.717   4.757  13.850
  265   HH12  ARG  40          1HH1      ARG  40   8.784   3.975  15.395
  266   HH21  ARG  40          2HH2      ARG  40   7.444   0.956  14.246
  267   HH22  ARG  40          1HH2      ARG  40   8.060   1.812  15.618
  268    H    SER  41           H        SER  41   2.482   5.377   9.433
  269    HA   SER  41           HA       SER  41   1.010   4.110  11.645
  270    HB2  SER  41           1HB      SER  41  -0.346   6.147  11.732
  271    HB3  SER  41           2HB      SER  41   1.366   6.543  11.883
  272    HG   SER  41           HG       SER  41  -0.374   6.955   9.713
  273    H    CYS  42           H        CYS  42   0.607   5.378   8.351
  274    HA   CYS  42           HA       CYS  42  -2.014   4.542   7.918
  275    HB2  CYS  42           1HB      CYS  42   0.244   4.750   5.914
  276    HB3  CYS  42           2HB      CYS  42  -1.467   4.656   5.512
  277    H    PHE  43           H        PHE  43   1.035   2.813   7.441
  278    HA   PHE  43           HA       PHE  43  -0.028   0.518   6.221
  279    HB2  PHE  43           1HB      PHE  43   2.441   1.267   6.509
  280    HB3  PHE  43           2HB      PHE  43   2.355   0.417   8.049
  281    HD1  PHE  43           2HD      PHE  43   1.789  -0.060   4.407
  282    HD2  PHE  43           1HD      PHE  43   2.746  -1.864   8.142
  283    HE1  PHE  43           2HE      PHE  43   2.265  -2.182   3.257
  284    HE2  PHE  43           1HE      PHE  43   3.224  -3.988   6.997
  285    HZ   PHE  43           HZ       PHE  43   2.983  -4.150   4.552
  286    H    ARG  44           H        ARG  44  -1.707  -0.527   7.111
  287    HA   ARG  44           HA       ARG  44  -1.306  -1.749   9.729
  288    HB2  ARG  44           1HB      ARG  44  -3.805  -0.197   9.028
  289    HB3  ARG  44           2HB      ARG  44  -3.547  -1.125  10.499
  290    HG2  ARG  44           1HG      ARG  44  -1.903   0.387  11.276
  291    HG3  ARG  44           2HG      ARG  44  -1.809   1.194   9.709
  292    HD2  ARG  44           1HD      ARG  44  -4.088   2.009   9.978
  293    HD3  ARG  44           2HD      ARG  44  -4.221   1.165  11.519
  294    HE   ARG  44           HE       ARG  44  -2.011   2.933  11.544
  295   HH11  ARG  44          2HH1      ARG  44  -5.489   2.885  11.687
  296   HH12  ARG  44          1HH1      ARG  44  -5.602   4.357  12.594
  297   HH21  ARG  44          2HH2      ARG  44  -2.147   4.872  12.738
  298   HH22  ARG  44          1HH2      ARG  44  -3.700   5.487  13.190
  299    H    CYS  45           H        CYS  45  -3.159  -3.342  10.178
  300    HA   CYS  45           HA       CYS  45  -3.201  -5.291   8.207
  301    HB2  CYS  45           1HB      CYS  45  -3.714  -5.611  10.648
  302    HB3  CYS  45           2HB      CYS  45  -5.310  -4.934  10.342
  303    H    HIS  46           H        HIS  46  -5.151  -6.203   7.118
  304    HA   HIS  46           HA       HIS  46  -6.686  -4.021   5.891
  305    HB2  HIS  46           1HB      HIS  46  -5.393  -5.322   4.308
  306    HB3  HIS  46           2HB      HIS  46  -6.091  -6.821   4.914
  307    HD1  HIS  46           1HD      HIS  46  -6.678  -4.072   2.536
  308    HD2  HIS  46           2HD      HIS  46  -8.846  -7.201   4.199
  309    HE1  HIS  46           1HE      HIS  46  -8.733  -4.301   1.105
  310    H    THR  47           H        THR  47  -7.048  -6.171   8.302
  311    HA   THR  47           HA       THR  47  -9.933  -6.494   7.786
  312    HB   THR  47           HB       THR  47  -8.005  -8.393   9.106
  313    HG1  THR  47           1HG      THR  47  -9.903  -9.453   7.497
  314   HG21  THR  47          1HG2      THR  47  -9.962  -8.086  10.592
  315   HG22  THR  47          2HG2      THR  47  -9.884  -9.705   9.897
  316   HG23  THR  47          3HG2      THR  47 -11.019  -8.521   9.250
  317    H    CYS  48           H        CYS  48  -7.415  -5.824  10.144
  318    HA   CYS  48           HA       CYS  48  -9.487  -4.800  11.973
  319    HB2  CYS  48           1HB      CYS  48  -7.879  -5.275  13.823
  320    HB3  CYS  48           2HB      CYS  48  -8.443  -6.720  12.990
  321    H    GLU  49           H        GLU  49  -7.037  -3.955   9.920
  322    HA   GLU  49           HA       GLU  49  -5.739  -2.105   9.617
  323    HB2  GLU  49           1HB      GLU  49  -7.986  -0.863  11.213
  324    HB3  GLU  49           2HB      GLU  49  -6.787   0.041  10.298
  325    HG2  GLU  49           1HG      GLU  49  -7.624  -0.685   8.249
  326    HG3  GLU  49           2HG      GLU  49  -8.508  -2.023   8.981
  327    H    ALA  50           H        ALA  50  -4.668  -3.624  11.550
  328    HA   ALA  50           HA       ALA  50  -4.063  -1.859  13.812
  329    HB1  ALA  50           1HB      ALA  50  -4.627  -3.954  14.642
  330    HB2  ALA  50           2HB      ALA  50  -3.761  -4.804  13.361
  331    HB3  ALA  50           3HB      ALA  50  -2.863  -3.986  14.639
  332    H    THR  51           H        THR  51  -2.081  -1.004  14.153
  333    HA   THR  51           HA       THR  51  -0.322  -0.479  12.134
  334    HB   THR  51           HB       THR  51   0.436  -0.786  15.046
  335    HG1  THR  51           1HG      THR  51  -0.985   1.146  13.626
  336   HG21  THR  51          1HG2      THR  51   2.455   0.024  14.534
  337   HG22  THR  51          2HG2      THR  51   1.761   1.306  13.539
  338   HG23  THR  51          3HG2      THR  51   2.060  -0.287  12.844
  339    H    LEU  52           H        LEU  52   0.320  -2.136  10.829
  340    HA   LEU  52           HA       LEU  52   1.222  -4.654  11.758
  341    HB2  LEU  52           1HB      LEU  52   1.743  -3.288   9.122
  342    HB3  LEU  52           2HB      LEU  52   2.003  -4.997   9.464
  343    HG   LEU  52           HG       LEU  52  -0.679  -3.613   9.493
  344   HD11  LEU  52          1HD1      LEU  52   0.495  -5.478   7.437
  345   HD12  LEU  52          2HD1      LEU  52   0.318  -3.735   7.244
  346   HD13  LEU  52          3HD1      LEU  52  -1.112  -4.753   7.408
  347   HD21  LEU  52          1HD2      LEU  52  -1.640  -5.725   9.832
  348   HD22  LEU  52          2HD2      LEU  52  -0.299  -5.653  10.975
  349   HD23  LEU  52          3HD2      LEU  52  -0.131  -6.566   9.475
  350    H    TRP  53           H        TRP  53   2.872  -4.562  13.208
  351    HA   TRP  53           HA       TRP  53   5.132  -2.860  12.930
  352    HB2  TRP  53           1HB      TRP  53   5.258  -5.367  14.554
  353    HB3  TRP  53           2HB      TRP  53   5.877  -3.760  14.925
  354    HD1  TRP  53           HD       TRP  53   2.572  -5.741  14.909
  355    HE1  TRP  53           1HE      TRP  53   0.941  -4.600  16.541
  356    HE3  TRP  53           3HE      TRP  53   5.357  -1.621  16.093
  357    HZ2  TRP  53           2HZ      TRP  53   0.847  -2.263  18.120
  358    HZ3  TRP  53           3HZ      TRP  53   4.424   0.020  17.671
  359    HH2  TRP  53           HH       TRP  53   2.215  -0.296  18.663
  360    HA   PRO  54           HA       PRO  54   7.769  -5.126  10.253
  361    HB2  PRO  54           1HB      PRO  54  10.208  -4.617  11.332
  362    HB3  PRO  54           2HB      PRO  54   9.272  -3.400  10.456
  363    HG2  PRO  54           1HG      PRO  54   9.548  -3.813  13.408
  364    HG3  PRO  54           2HG      PRO  54   9.569  -2.300  12.483
  365    HD2  PRO  54           1HD      PRO  54   7.379  -3.156  13.826
  366    HD3  PRO  54           2HD      PRO  54   7.271  -2.220  12.321
  367    H    GLY  55           H        GLY  55   6.858  -6.337  13.043
  368    HA2  GLY  55           1HA      GLY  55   8.508  -8.733  12.723
  369    HA3  GLY  55           2HA      GLY  55   8.482  -7.974  14.308
  370    H    GLY  56           H        GLY  56   5.682  -8.032  12.212
  371    HA2  GLY  56           1HA      GLY  56   4.510 -10.392  13.282
  372    HA3  GLY  56           2HA      GLY  56   3.921  -8.972  14.134
  373    H    TYR  57           H        TYR  57   4.666  -9.603  10.708
  374    HA   TYR  57           HA       TYR  57   1.886  -9.440   9.972
  375    HB2  TYR  57           1HB      TYR  57   1.828  -7.390   8.937
  376    HB3  TYR  57           2HB      TYR  57   2.937  -7.024  10.254
  377    HD1  TYR  57           2HD      TYR  57   5.396  -6.956   9.800
  378    HD2  TYR  57           1HD      TYR  57   2.529  -7.279   6.673
  379    HE1  TYR  57           2HE      TYR  57   7.097  -6.241   8.174
  380    HE2  TYR  57           1HE      TYR  57   4.222  -6.566   5.038
  381    HH   TYR  57           HH       TYR  57   6.278  -5.604   4.817
  382    H    GLU  58           H        GLU  58   1.506  -9.980   7.766
  383    HA   GLU  58           HA       GLU  58   3.759 -10.689   6.091
  384    HB2  GLU  58           1HB      GLU  58   2.106 -12.701   7.523
  385    HB3  GLU  58           2HB      GLU  58   2.507 -13.043   5.846
  386    HG2  GLU  58           1HG      GLU  58   4.594 -12.308   7.871
  387    HG3  GLU  58           2HG      GLU  58   4.059 -13.969   7.622
  388    H    GLN  59           H        GLN  59   3.149 -11.202   3.918
  389    HA   GLN  59           HA       GLN  59   0.512 -10.111   3.224
  390    HB2  GLN  59           1HB      GLN  59   2.178  -8.837   2.158
  391    HB3  GLN  59           2HB      GLN  59   3.124 -10.260   1.743
  392    HG2  GLN  59           1HG      GLN  59   0.402 -10.024   0.592
  393    HG3  GLN  59           2HG      GLN  59   1.666  -8.969  -0.039
  394   HE21  GLN  59          1HE2      GLN  59   1.371 -10.101  -2.040
  395   HE22  GLN  59          2HE2      GLN  59   2.136 -11.629  -2.289
  396    H    HIS  60           H        HIS  60  -0.960 -11.274   2.109
  397    HA   HIS  60           HA       HIS  60  -0.478 -14.115   1.826
  398    HB2  HIS  60           1HB      HIS  60  -2.620 -13.091   2.741
  399    HB3  HIS  60           2HB      HIS  60  -2.993 -12.621   1.085
  400    HD1  HIS  60           1HD      HIS  60  -4.094 -14.343  -0.353
  401    HD2  HIS  60           2HD      HIS  60  -2.450 -15.977   3.096
  402    HE1  HIS  60           1HE      HIS  60  -4.855 -16.740  -0.315
  403    HA   PRO  61           HA       PRO  61   0.686 -13.695  -2.447
  404    HB2  PRO  61           1HB      PRO  61   0.901 -16.354  -2.948
  405    HB3  PRO  61           2HB      PRO  61   2.128 -15.441  -2.061
  406    HG2  PRO  61           1HG      PRO  61  -0.062 -17.189  -1.007
  407    HG3  PRO  61           2HG      PRO  61   1.631 -17.083  -0.491
  408    HD2  PRO  61           1HD      PRO  61  -0.381 -15.873   0.857
  409    HD3  PRO  61           2HD      PRO  61   1.258 -15.195   0.777
  410    H    GLY  62           H        GLY  62  -2.208 -14.784  -1.185
  411    HA2  GLY  62           1HA      GLY  62  -3.343 -15.954  -3.546
  412    HA3  GLY  62           2HA      GLY  62  -4.215 -15.470  -2.099
  413    H    ASP  63           H        ASP  63  -4.434 -13.042  -1.818
  414    HA   ASP  63           HA       ASP  63  -5.474 -11.970  -4.305
  415    HB2  ASP  63           1HB      ASP  63  -6.183 -10.062  -2.704
  416    HB3  ASP  63           2HB      ASP  63  -6.969 -11.630  -2.541
  417    H    GLY  64           H        GLY  64  -3.068 -11.078  -1.852
  418    HA2  GLY  64           1HA      GLY  64  -0.950 -10.156  -2.664
  419    HA3  GLY  64           2HA      GLY  64  -1.882  -9.249  -3.846
  420    H    HIS  65           H        HIS  65  -2.834  -9.614  -0.492
  421    HA   HIS  65           HA       HIS  65  -2.294  -6.743  -0.101
  422    HB2  HIS  65           1HB      HIS  65  -4.597  -8.469   0.734
  423    HB3  HIS  65           2HB      HIS  65  -4.182  -7.050   1.690
  424    HD1  HIS  65           1HD      HIS  65  -4.686  -4.749   0.676
  425    HD2  HIS  65           2HD      HIS  65  -5.649  -7.925  -1.823
  426    HE1  HIS  65           1HE      HIS  65  -6.061  -3.752  -1.179
  427    H    PHE  66           H        PHE  66  -2.213  -6.197   2.337
  428    HA   PHE  66           HA       PHE  66  -0.405  -8.139   3.607
  429    HB2  PHE  66           1HB      PHE  66  -0.566  -5.135   3.755
  430    HB3  PHE  66           2HB      PHE  66   0.317  -6.073   4.955
  431    HD1  PHE  66           2HD      PHE  66   0.194  -5.044   1.437
  432    HD2  PHE  66           1HD      PHE  66   2.405  -7.115   4.427
  433    HE1  PHE  66           2HE      PHE  66   2.159  -5.077  -0.043
  434    HE2  PHE  66           1HE      PHE  66   4.374  -7.151   2.952
  435    HZ   PHE  66           HZ       PHE  66   4.252  -6.132   0.713
  436    H    TYR  67           H        TYR  67  -1.106  -9.159   5.354
  437    HA   TYR  67           HA       TYR  67  -3.160  -7.865   7.021
  438    HB2  TYR  67           1HB      TYR  67  -3.063 -10.824   6.415
  439    HB3  TYR  67           2HB      TYR  67  -4.312  -9.960   7.304
  440    HD1  TYR  67           2HD      TYR  67  -2.833 -10.469   3.955
  441    HD2  TYR  67           1HD      TYR  67  -6.095  -8.871   6.171
  442    HE1  TYR  67           2HE      TYR  67  -4.088 -10.146   1.864
  443    HE2  TYR  67           1HE      TYR  67  -7.359  -8.545   4.087
  444    HH   TYR  67           HH       TYR  67  -6.497  -8.214   1.445
  445    H    CYS  68           H        CYS  68  -3.289  -8.807   9.230
  446    HA   CYS  68           HA       CYS  68  -0.672  -8.930  10.378
  447    HB2  CYS  68           1HB      CYS  68  -1.822  -9.047  12.517
  448    HB3  CYS  68           2HB      CYS  68  -2.574  -7.819  11.504
  449    H    LEU  69           H        LEU  69  -0.205 -10.651  12.090
  450    HA   LEU  69           HA       LEU  69  -0.238 -13.208  10.778
  451    HB2  LEU  69           1HB      LEU  69   0.752 -12.566  13.547
  452    HB3  LEU  69           2HB      LEU  69   1.189 -13.951  12.548
  453    HG   LEU  69           HG       LEU  69   1.991 -11.074  12.147
  454   HD11  LEU  69          1HD1      LEU  69   4.275 -12.112  12.296
  455   HD12  LEU  69          2HD1      LEU  69   3.484 -13.594  12.835
  456   HD13  LEU  69          3HD1      LEU  69   3.341 -12.120  13.792
  457   HD21  LEU  69          1HD2      LEU  69   2.614 -13.432  10.375
  458   HD22  LEU  69          2HD2      LEU  69   3.139 -11.764  10.149
  459   HD23  LEU  69          3HD2      LEU  69   1.430 -12.179  10.000
  460    H    GLN  70           H        GLN  70  -2.681 -11.815  12.142
  461    HA   GLN  70           HA       GLN  70  -3.596 -14.235  13.550
  462    HB2  GLN  70           1HB      GLN  70  -3.280 -12.352  15.106
  463    HB3  GLN  70           2HB      GLN  70  -4.377 -11.375  14.140
  464    HG2  GLN  70           1HG      GLN  70  -6.169 -13.025  14.607
  465    HG3  GLN  70           2HG      GLN  70  -5.056 -13.863  15.688
  466   HE21  GLN  70          1HE2      GLN  70  -7.062 -13.290  17.043
  467   HE22  GLN  70          2HE2      GLN  70  -6.949 -11.824  17.950
  468    H    HIS  71           H        HIS  71  -4.044 -12.136  10.958
  469    HA   HIS  71           HA       HIS  71  -6.765 -13.179  10.519
  470    HB2  HIS  71           1HB      HIS  71  -5.623 -10.452   9.999
  471    HB3  HIS  71           2HB      HIS  71  -6.974 -11.045   9.037
  472    HD2  HIS  71           2HD      HIS  71  -7.779 -12.426  12.334
  473    HE1  HIS  71           1HE      HIS  71  -9.268  -8.457  12.506
  474    HE2  HIS  71           2HE      HIS  71  -9.222 -10.713  13.627
  475    H    LEU  72           H        LEU  72  -3.576 -12.794   9.324
  476    HA   LEU  72           HA       LEU  72  -3.869 -12.947   6.584
  477    HB2  LEU  72           1HB      LEU  72  -1.736 -12.709   7.883
  478    HB3  LEU  72           2HB      LEU  72  -1.797 -14.446   8.176
  479    HG   LEU  72           HG       LEU  72  -1.935 -14.459   5.502
  480   HD11  LEU  72          1HD1      LEU  72  -1.305 -11.765   6.120
  481   HD12  LEU  72          2HD1      LEU  72  -1.406 -12.537   4.538
  482   HD13  LEU  72          3HD1      LEU  72   0.127 -12.511   5.409
  483   HD21  LEU  72          1HD2      LEU  72   0.278 -15.183   5.516
  484   HD22  LEU  72          2HD2      LEU  72  -0.269 -15.498   7.163
  485   HD23  LEU  72          3HD2      LEU  72   0.731 -14.086   6.821
  486    HA   PRO  73           HA       PRO  73  -6.010 -16.856   6.239
  487    HB2  PRO  73           1HB      PRO  73  -6.296 -16.749   3.541
  488    HB3  PRO  73           2HB      PRO  73  -7.320 -15.832   4.653
  489    HG2  PRO  73           1HG      PRO  73  -4.938 -14.922   3.084
  490    HG3  PRO  73           2HG      PRO  73  -6.487 -14.098   3.346
  491    HD2  PRO  73           1HD      PRO  73  -4.249 -13.473   4.738
  492    HD3  PRO  73           2HD      PRO  73  -5.876 -13.347   5.438
  493    H    GLN  74           H        GLN  74  -5.718 -18.814   4.785
  494    HA   GLN  74           HA       GLN  74  -2.998 -19.141   3.779
  495    HB2  GLN  74           1HB      GLN  74  -4.130 -20.495   6.168
  496    HB3  GLN  74           2HB      GLN  74  -3.182 -21.485   5.067
  497    HG2  GLN  74           1HG      GLN  74  -2.116 -18.878   6.068
  498    HG3  GLN  74           2HG      GLN  74  -2.014 -20.335   7.055
  499   HE21  GLN  74          1HE2      GLN  74  -0.093 -18.545   5.425
  500   HE22  GLN  74          2HE2      GLN  74   0.892 -19.694   4.592
  501    H    THR  75           H        THR  75  -2.989 -20.232   1.926
  502    HA   THR  75           HA       THR  75  -5.283 -21.050   0.606
  503    HB   THR  75           HB       THR  75  -3.775 -22.302  -0.933
  504    HG1  THR  75           1HG      THR  75  -1.650 -21.385   0.715
  505   HG21  THR  75          1HG2      THR  75  -3.021 -19.503  -0.112
  506   HG22  THR  75          2HG2      THR  75  -4.083 -20.003  -1.428
  507   HG23  THR  75          3HG2      THR  75  -2.347 -20.295  -1.536
  508    H    ASP  76           H        ASP  76  -5.401 -23.423  -0.340
  509    HA   ASP  76           HA       ASP  76  -5.625 -25.188   1.994
  510    HB2  ASP  76           1HB      ASP  76  -7.620 -24.604   0.447
  511    HB3  ASP  76           2HB      ASP  76  -6.874 -25.727  -0.686
  512    H    SER  77           H        SER  77  -4.785 -25.387  -1.467
  513    HA   SER  77           HA       SER  77  -2.805 -27.450  -0.765
  514    HB2  SER  77           1HB      SER  77  -5.021 -28.156  -2.029
  515    HB3  SER  77           2HB      SER  77  -4.153 -27.536  -3.433
  516    HG   SER  77           HG       SER  77  -2.767 -29.251  -1.733
  517    H    GLY  78           H        GLY  78  -2.152 -24.774  -0.909
  518    HA2  GLY  78           1HA      GLY  78  -1.036 -24.296  -3.565
  519    HA3  GLY  78           2HA      GLY  78  -1.050 -23.161  -2.223
  520    HA   PRO  79           HA       PRO  79   2.939 -25.903  -2.511
  521    HB2  PRO  79           1HB      PRO  79   4.330 -24.788  -4.558
  522    HB3  PRO  79           2HB      PRO  79   3.251 -26.172  -4.771
  523    HG2  PRO  79           1HG      PRO  79   2.743 -23.273  -5.319
  524    HG3  PRO  79           2HG      PRO  79   2.313 -24.689  -6.297
  525    HD2  PRO  79           1HD      PRO  79   0.527 -23.420  -4.706
  526    HD3  PRO  79           2HD      PRO  79   0.458 -25.167  -5.016
  527    H    SER  80           H        SER  80   3.854 -25.051  -0.733
  528    HA   SER  80           HA       SER  80   4.321 -22.247  -0.410
  529    HB2  SER  80           1HB      SER  80   5.374 -24.554   1.244
  530    HB3  SER  80           2HB      SER  80   5.329 -22.859   1.726
  531    HG   SER  80           HG       SER  80   2.999 -24.293   1.009
  532    H    SER  81           H        SER  81   6.405 -21.260  -0.046
  533    HA   SER  81           HA       SER  81   8.647 -22.638  -1.354
  534    HB2  SER  81           1HB      SER  81   7.745 -19.797  -1.880
  535    HB3  SER  81           2HB      SER  81   9.257 -20.490  -2.464
  536    HG   SER  81           HG       SER  81   6.662 -20.896  -3.334
  537    H    GLY  82           H        GLY  82  10.764 -21.599  -0.888
  538    HA2  GLY  82           1HA      GLY  82  11.259 -19.664   1.007
  539    HA3  GLY  82           2HA      GLY  82  11.016 -21.145   1.921
  Start of MODEL   13
    1    H1   GLY   1           H        GLY   1  -8.640  35.434 -42.586
    2    HA2  GLY   1           1HA      GLY   1  -9.595  35.756 -40.279
    3    HA3  GLY   1           2HA      GLY   1 -10.872  34.669 -40.806
    4    H    SER   2           H        SER   2  -9.232  34.251 -38.540
    5    HA   SER   2           HA       SER   2  -8.426  31.572 -39.002
    6    HB2  SER   2           1HB      SER   2  -6.023  31.805 -38.547
    7    HB3  SER   2           2HB      SER   2  -6.472  32.676 -40.014
    8    HG   SER   2           HG       SER   2  -5.080  33.788 -38.393
    9    H    SER   3           H        SER   3  -7.811  30.477 -37.064
   10    HA   SER   3           HA       SER   3  -7.643  31.863 -34.568
   11    HB2  SER   3           1HB      SER   3 -10.168  31.783 -35.282
   12    HB3  SER   3           2HB      SER   3 -10.062  30.102 -34.757
   13    HG   SER   3           HG       SER   3  -9.487  32.412 -33.210
   14    H    GLY   4           H        GLY   4  -6.841  30.574 -32.948
   15    HA2  GLY   4           1HA      GLY   4  -6.985  27.960 -32.418
   16    HA3  GLY   4           2HA      GLY   4  -5.894  27.957 -33.796
   17    H    SER   5           H        SER   5  -6.110  28.165 -30.462
   18    HA   SER   5           HA       SER   5  -3.263  28.774 -30.278
   19    HB2  SER   5           1HB      SER   5  -4.546  30.917 -29.916
   20    HB3  SER   5           2HB      SER   5  -5.265  30.169 -28.489
   21    HG   SER   5           HG       SER   5  -3.228  30.020 -27.575
   22    H    SER   6           H        SER   6  -2.562  26.914 -29.437
   23    HA   SER   6           HA       SER   6  -3.328  26.181 -26.775
   24    HB2  SER   6           1HB      SER   6  -4.021  23.851 -27.370
   25    HB3  SER   6           2HB      SER   6  -5.159  25.085 -27.912
   26    HG   SER   6           HG       SER   6  -4.902  24.232 -29.808
   27    H    GLY   7           H        GLY   7  -1.501  25.601 -25.817
   28    HA2  GLY   7           1HA      GLY   7   0.292  23.688 -26.973
   29    HA3  GLY   7           2HA      GLY   7   0.956  25.315 -27.002
   30    H    GLN   8           H        GLN   8   0.911  22.524 -25.288
   31    HA   GLN   8           HA       GLN   8   2.289  23.615 -23.081
   32    HB2  GLN   8           1HB      GLN   8   0.736  23.318 -21.299
   33    HB3  GLN   8           2HB      GLN   8  -0.072  24.288 -22.523
   34    HG2  GLN   8           1HG      GLN   8  -1.549  22.639 -23.061
   35    HG3  GLN   8           2HG      GLN   8  -0.440  21.345 -22.607
   36   HE21  GLN   8          1HE2      GLN   8  -2.544  20.610 -21.638
   37   HE22  GLN   8          2HE2      GLN   8  -2.865  21.092 -20.010
   38    H    HIS   9           H        HIS   9   3.036  21.991 -21.595
   39    HA   HIS   9           HA       HIS   9   2.361  19.232 -22.013
   40    HB2  HIS   9           1HB      HIS   9   4.013  19.973 -23.897
   41    HB3  HIS   9           2HB      HIS   9   5.223  19.894 -22.621
   42    HD1  HIS   9           1HD      HIS   9   2.426  17.561 -23.758
   43    HD2  HIS   9           2HD      HIS   9   6.446  17.499 -22.709
   44    HE1  HIS   9           1HE      HIS   9   3.139  15.158 -23.968
   45    H    GLN  10           H        GLN  10   2.804  18.053 -20.234
   46    HA   GLN  10           HA       GLN  10   4.954  18.605 -18.459
   47    HB2  GLN  10           1HB      GLN  10   3.293  20.455 -17.939
   48    HB3  GLN  10           2HB      GLN  10   2.217  19.199 -17.340
   49    HG2  GLN  10           1HG      GLN  10   3.926  18.539 -15.704
   50    HG3  GLN  10           2HG      GLN  10   4.961  19.844 -16.284
   51   HE21  GLN  10          1HE2      GLN  10   4.131  19.593 -13.635
   52   HE22  GLN  10          2HE2      GLN  10   3.100  20.925 -13.251
   53    H    GLU  11           H        GLU  11   5.401  16.852 -17.235
   54    HA   GLU  11           HA       GLU  11   3.348  14.743 -17.090
   55    HB2  GLU  11           1HB      GLU  11   5.065  13.066 -17.381
   56    HB3  GLU  11           2HB      GLU  11   5.131  14.200 -18.723
   57    HG2  GLU  11           1HG      GLU  11   6.979  15.380 -17.488
   58    HG3  GLU  11           2HG      GLU  11   6.996  14.011 -16.377
   59    H    ALA  12           H        ALA  12   3.048  13.764 -15.158
   60    HA   ALA  12           HA       ALA  12   4.951  14.319 -12.993
   61    HB1  ALA  12           1HB      ALA  12   3.107  14.818 -11.453
   62    HB2  ALA  12           2HB      ALA  12   3.191  15.979 -12.779
   63    HB3  ALA  12           3HB      ALA  12   1.967  14.709 -12.795
   64    H    GLY  13           H        GLY  13   5.667  12.345 -12.482
   65    HA2  GLY  13           1HA      GLY  13   3.695  10.336 -11.687
   66    HA3  GLY  13           2HA      GLY  13   4.845   9.883 -12.936
   67    H    ALA  14           H        ALA  14   4.592  11.023  -9.595
   68    HA   ALA  14           HA       ALA  14   7.308  10.083  -9.055
   69    HB1  ALA  14           1HB      ALA  14   5.516  12.053  -7.863
   70    HB2  ALA  14           2HB      ALA  14   6.347  11.047  -6.676
   71    HB3  ALA  14           3HB      ALA  14   7.278  11.969  -7.856
   72    H    GLY  15           H        GLY  15   7.774   8.588  -7.388
   73    HA2  GLY  15           1HA      GLY  15   5.473   6.940  -6.542
   74    HA3  GLY  15           2HA      GLY  15   6.950   6.211  -7.155
   75    H    ASP  16           H        ASP  16   6.521   8.929  -4.914
   76    HA   ASP  16           HA       ASP  16   7.755   7.300  -2.800
   77    HB2  ASP  16           1HB      ASP  16   8.471  10.198  -3.218
   78    HB3  ASP  16           2HB      ASP  16   9.282   9.009  -2.203
   79    H    LEU  17           H        LEU  17   5.002   7.874  -3.162
   80    HA   LEU  17           HA       LEU  17   4.513   9.552  -0.793
   81    HB2  LEU  17           1HB      LEU  17   2.616   9.318  -3.114
   82    HB3  LEU  17           2HB      LEU  17   2.534  10.437  -1.755
   83    HG   LEU  17           HG       LEU  17   4.644  10.504  -3.910
   84   HD11  LEU  17          1HD1      LEU  17   3.045  11.394  -5.180
   85   HD12  LEU  17          2HD1      LEU  17   3.129  12.792  -4.108
   86   HD13  LEU  17          3HD1      LEU  17   1.926  11.534  -3.824
   87   HD21  LEU  17          1HD2      LEU  17   5.258  11.408  -1.657
   88   HD22  LEU  17          2HD2      LEU  17   3.948  12.576  -1.837
   89   HD23  LEU  17          3HD2      LEU  17   5.304  12.590  -2.965
   90    H    CYS  18           H        CYS  18   3.239   8.694   0.748
   91    HA   CYS  18           HA       CYS  18   2.835   6.139   1.263
   92    HB2  CYS  18           1HB      CYS  18   2.027   8.042   2.676
   93    HB3  CYS  18           2HB      CYS  18   0.596   8.134   1.654
   94    H    ALA  19           H        ALA  19   2.063   4.440   0.216
   95    HA   ALA  19           HA       ALA  19   0.343   4.760  -2.075
   96    HB1  ALA  19           1HB      ALA  19   1.746   2.445  -0.803
   97    HB2  ALA  19           2HB      ALA  19   0.503   2.176  -2.025
   98    HB3  ALA  19           3HB      ALA  19   1.940   3.119  -2.421
   99    H    LEU  20           H        LEU  20  -0.474   5.102   0.927
  100    HA   LEU  20           HA       LEU  20  -2.876   3.403   0.794
  101    HB2  LEU  20           1HB      LEU  20  -1.163   4.318   3.030
  102    HB3  LEU  20           2HB      LEU  20  -2.895   4.214   3.339
  103    HG   LEU  20           HG       LEU  20  -1.458   1.866   2.175
  104   HD11  LEU  20          1HD1      LEU  20  -1.537   2.571   5.105
  105   HD12  LEU  20          2HD1      LEU  20  -0.099   2.549   4.085
  106   HD13  LEU  20          3HD1      LEU  20  -0.967   1.050   4.418
  107   HD21  LEU  20          1HD2      LEU  20  -3.187   0.689   3.560
  108   HD22  LEU  20          2HD2      LEU  20  -3.830   1.688   2.255
  109   HD23  LEU  20          3HD2      LEU  20  -3.879   2.271   3.920
  110    H    CYS  21           H        CYS  21  -1.725   6.621   1.775
  111    HA   CYS  21           HA       CYS  21  -4.471   7.631   1.488
  112    HB2  CYS  21           1HB      CYS  21  -3.669   9.599   2.763
  113    HB3  CYS  21           2HB      CYS  21  -3.482   8.094   3.656
  114    H    GLY  22           H        GLY  22  -1.105   8.398   0.634
  115    HA2  GLY  22           1HA      GLY  22  -0.583   9.023  -1.648
  116    HA3  GLY  22           2HA      GLY  22  -2.147   9.820  -1.731
  117    H    GLU  23           H        GLU  23   0.298  10.016   0.827
  118    HA   GLU  23           HA       GLU  23   0.541  12.894   0.237
  119    HB2  GLU  23           1HB      GLU  23   0.430  11.440   2.870
  120    HB3  GLU  23           2HB      GLU  23   1.110  13.055   2.738
  121    HG2  GLU  23           1HG      GLU  23  -1.586  12.599   1.596
  122    HG3  GLU  23           2HG      GLU  23  -1.426  12.634   3.351
  123    H    HIS  24           H        HIS  24   2.610  13.762   1.470
  124    HA   HIS  24           HA       HIS  24   4.838  12.602   0.164
  125    HB2  HIS  24           1HB      HIS  24   4.379  15.056   1.075
  126    HB3  HIS  24           2HB      HIS  24   5.241  14.437   2.481
  127    HD1  HIS  24           1HD      HIS  24   5.740  15.599  -0.992
  128    HD2  HIS  24           2HD      HIS  24   7.964  13.743   1.986
  129    HE1  HIS  24           1HE      HIS  24   8.138  15.791  -1.726
  130    H    LEU  25           H        LEU  25   6.542  11.400   0.939
  131    HA   LEU  25           HA       LEU  25   6.068  10.077   3.521
  132    HB2  LEU  25           1HB      LEU  25   7.508   9.217   1.030
  133    HB3  LEU  25           2HB      LEU  25   7.717   8.380   2.567
  134    HG   LEU  25           HG       LEU  25   5.049   8.715   1.206
  135   HD11  LEU  25          1HD1      LEU  25   7.223   7.071   0.422
  136   HD12  LEU  25          2HD1      LEU  25   5.581   7.108  -0.220
  137   HD13  LEU  25          3HD1      LEU  25   5.978   6.036   1.123
  138   HD21  LEU  25          1HD2      LEU  25   4.429   8.121   3.290
  139   HD22  LEU  25          2HD2      LEU  25   6.018   7.472   3.695
  140   HD23  LEU  25          3HD2      LEU  25   4.886   6.507   2.745
  141    H    TYR  26           H        TYR  26   8.058   9.385   4.703
  142    HA   TYR  26           HA       TYR  26  10.166  11.433   4.477
  143    HB2  TYR  26           1HB      TYR  26   8.530  11.483   6.507
  144    HB3  TYR  26           2HB      TYR  26   9.475  10.115   7.084
  145    HD1  TYR  26           1HD      TYR  26  10.195  13.457   5.556
  146    HD2  TYR  26           2HD      TYR  26  11.083  10.657   8.633
  147    HE1  TYR  26           1HE      TYR  26  11.866  15.009   6.477
  148    HE2  TYR  26           2HE      TYR  26  12.756  12.202   9.564
  149    HH   TYR  26           HH       TYR  26  12.937  15.117   9.264
  150    H    VAL  27           H        VAL  27  12.076  10.573   6.071
  151    HA   VAL  27           HA       VAL  27  13.049   8.203   4.731
  152    HB   VAL  27           HB       VAL  27  14.382   9.900   6.846
  153   HG11  VAL  27          1HG1      VAL  27  16.420   8.793   5.552
  154   HG12  VAL  27          2HG1      VAL  27  15.650   8.010   6.933
  155   HG13  VAL  27          3HG1      VAL  27  15.229   7.519   5.291
  156   HG21  VAL  27          1HG2      VAL  27  14.906   9.932   3.885
  157   HG22  VAL  27          2HG2      VAL  27  13.768  11.032   4.663
  158   HG23  VAL  27          3HG2      VAL  27  15.474  11.069   5.108
  159    H    LEU  28           H        LEU  28  12.354   9.182   8.075
  160    HA   LEU  28           HA       LEU  28  12.679   6.407   8.947
  161    HB2  LEU  28           1HB      LEU  28  12.367   8.985  10.469
  162    HB3  LEU  28           2HB      LEU  28  12.410   7.399  11.236
  163    HG   LEU  28           HG       LEU  28  14.710   7.256   9.900
  164   HD11  LEU  28          1HD1      LEU  28  14.408  10.199  10.480
  165   HD12  LEU  28          2HD1      LEU  28  14.420   9.473   8.873
  166   HD13  LEU  28          3HD1      LEU  28  15.857   9.386   9.891
  167   HD21  LEU  28          1HD2      LEU  28  14.244   8.644  12.535
  168   HD22  LEU  28          2HD2      LEU  28  15.814   8.073  11.969
  169   HD23  LEU  28          3HD2      LEU  28  14.512   6.921  12.270
  170    H    GLU  29           H        GLU  29  10.365   7.555   7.373
  171    HA   GLU  29           HA       GLU  29   8.249   6.596   9.180
  172    HB2  GLU  29           1HB      GLU  29   7.953   8.844   7.181
  173    HB3  GLU  29           2HB      GLU  29   6.702   8.232   8.254
  174    HG2  GLU  29           1HG      GLU  29   8.179   8.914  10.175
  175    HG3  GLU  29           2HG      GLU  29   9.186   9.748   8.993
  176    H    ARG  30           H        ARG  30   9.459   6.924   5.903
  177    HA   ARG  30           HA       ARG  30   7.352   5.584   4.587
  178    HB2  ARG  30           1HB      ARG  30   8.776   5.503   2.689
  179    HB3  ARG  30           2HB      ARG  30   9.145   7.009   3.518
  180    HG2  ARG  30           1HG      ARG  30  11.164   6.120   4.405
  181    HG3  ARG  30           2HG      ARG  30  10.751   4.491   3.865
  182    HD2  ARG  30           1HD      ARG  30  12.229   5.158   2.229
  183    HD3  ARG  30           2HD      ARG  30  10.681   5.593   1.505
  184    HE   ARG  30           HE       ARG  30  12.713   7.413   2.517
  185   HH11  ARG  30          2HH1      ARG  30   9.492   6.969   1.272
  186   HH12  ARG  30          1HH1      ARG  30   9.294   8.631   0.827
  187   HH21  ARG  30          2HH2      ARG  30  12.465   9.604   1.936
  188   HH22  ARG  30          1HH2      ARG  30  10.986  10.129   1.204
  189    H    LEU  31           H        LEU  31   6.933   3.472   4.253
  190    HA   LEU  31           HA       LEU  31   8.717   1.536   5.559
  191    HB2  LEU  31           1HB      LEU  31   5.794   1.744   5.211
  192    HB3  LEU  31           2HB      LEU  31   6.475   0.123   5.089
  193    HG   LEU  31           HG       LEU  31   7.588   0.684   7.362
  194   HD11  LEU  31          1HD1      LEU  31   6.811   2.416   8.608
  195   HD12  LEU  31          2HD1      LEU  31   5.232   2.423   7.822
  196   HD13  LEU  31          3HD1      LEU  31   6.626   3.133   7.007
  197   HD21  LEU  31          1HD2      LEU  31   5.121  -0.484   6.603
  198   HD22  LEU  31          2HD2      LEU  31   4.857   0.406   8.103
  199   HD23  LEU  31          3HD2      LEU  31   6.111  -0.833   8.021
  200    H    CYS  32           H        CYS  32  10.135   0.864   4.044
  201    HA   CYS  32           HA       CYS  32   9.530   0.543   1.300
  202    HB2  CYS  32           1HB      CYS  32  11.761  -0.885   2.735
  203    HB3  CYS  32           2HB      CYS  32  11.716  -0.333   1.065
  204    HG   CYS  32           HG       CYS  32  11.318   2.324   2.858
  205    H    VAL  33           H        VAL  33   7.852  -0.794   0.846
  206    HA   VAL  33           HA       VAL  33   8.146  -3.608   1.675
  207    HB   VAL  33           HB       VAL  33   5.553  -2.111   1.269
  208   HG11  VAL  33          1HG1      VAL  33   5.259  -4.370   0.566
  209   HG12  VAL  33          2HG1      VAL  33   6.128  -4.983   1.975
  210   HG13  VAL  33          3HG1      VAL  33   4.549  -4.221   2.174
  211   HG21  VAL  33          1HG2      VAL  33   7.082  -1.839   3.418
  212   HG22  VAL  33          2HG2      VAL  33   5.324  -1.928   3.531
  213   HG23  VAL  33          3HG2      VAL  33   6.303  -3.359   3.857
  214    H    ASN  34           H        ASN  34   9.017  -4.476  -0.137
  215    HA   ASN  34           HA       ASN  34   9.265  -5.118  -2.312
  216    HB2  ASN  34           1HB      ASN  34   6.281  -5.126  -1.922
  217    HB3  ASN  34           2HB      ASN  34   7.000  -5.615  -3.454
  218   HD21  ASN  34          1HD2      ASN  34   5.515  -7.044  -1.245
  219   HD22  ASN  34          2HD2      ASN  34   6.501  -8.419  -0.896
  220    H    GLY  35           H        GLY  35   9.745  -2.471  -2.116
  221    HA2  GLY  35           1HA      GLY  35  10.122  -0.783  -3.679
  222    HA3  GLY  35           2HA      GLY  35   8.944  -1.539  -4.742
  223    H    HIS  36           H        HIS  36   6.860  -1.641  -2.711
  224    HA   HIS  36           HA       HIS  36   5.847   1.032  -3.076
  225    HB2  HIS  36           1HB      HIS  36   4.591  -1.280  -1.586
  226    HB3  HIS  36           2HB      HIS  36   3.775   0.175  -2.149
  227    HD1  HIS  36           1HD      HIS  36   4.884   0.252  -5.038
  228    HD2  HIS  36           2HD      HIS  36   3.395  -3.149  -3.174
  229    HE1  HIS  36           1HE      HIS  36   4.181  -1.283  -6.901
  230    H    PHE  37           H        PHE  37   5.748   2.630  -1.615
  231    HA   PHE  37           HA       PHE  37   6.753   2.053   1.089
  232    HB2  PHE  37           1HB      PHE  37   6.757   4.668  -0.434
  233    HB3  PHE  37           2HB      PHE  37   7.405   4.426   1.185
  234    HD1  PHE  37           1HD      PHE  37   7.818   3.463  -2.361
  235    HD2  PHE  37           2HD      PHE  37   9.581   3.611   1.510
  236    HE1  PHE  37           1HE      PHE  37   9.993   2.845  -3.332
  237    HE2  PHE  37           2HE      PHE  37  11.758   2.994   0.546
  238    HZ   PHE  37           HZ       PHE  37  11.967   2.611  -1.878
  239    H    PHE  38           H        PHE  38   5.668   2.801   2.884
  240    HA   PHE  38           HA       PHE  38   3.154   4.243   2.477
  241    HB2  PHE  38           1HB      PHE  38   3.307   1.762   4.194
  242    HB3  PHE  38           2HB      PHE  38   1.870   2.693   3.784
  243    HD1  PHE  38           1HD      PHE  38   4.569   0.653   2.242
  244    HD2  PHE  38           2HD      PHE  38   0.563   2.068   1.979
  245    HE1  PHE  38           1HE      PHE  38   4.182  -0.811   0.302
  246    HE2  PHE  38           2HE      PHE  38   0.170   0.606   0.040
  247    HZ   PHE  38           HZ       PHE  38   1.981  -0.836  -0.801
  248    H    HIS  39           H        HIS  39   2.176   4.844   4.670
  249    HA   HIS  39           HA       HIS  39   4.260   6.110   6.218
  250    HB2  HIS  39           1HB      HIS  39   1.281   6.296   6.091
  251    HB3  HIS  39           2HB      HIS  39   2.098   6.864   7.545
  252    HD2  HIS  39           2HD      HIS  39   4.666   8.263   5.879
  253    HE1  HIS  39           1HE      HIS  39   1.569  10.664   4.253
  254    HE2  HIS  39           2HE      HIS  39   4.056  10.400   4.556
  255    H    ARG  40           H        ARG  40   4.472   5.931   8.513
  256    HA   ARG  40           HA       ARG  40   4.406   3.244   9.435
  257    HB2  ARG  40           1HB      ARG  40   5.122   5.878  10.683
  258    HB3  ARG  40           2HB      ARG  40   5.015   4.428  11.671
  259    HG2  ARG  40           1HG      ARG  40   6.659   4.333   9.197
  260    HG3  ARG  40           2HG      ARG  40   7.288   5.197  10.602
  261    HD2  ARG  40           1HD      ARG  40   7.103   3.227  11.965
  262    HD3  ARG  40           2HD      ARG  40   6.283   2.357  10.669
  263    HE   ARG  40           HE       ARG  40   8.323   1.893   9.757
  264   HH11  ARG  40          2HH1      ARG  40   8.664   4.563  11.965
  265   HH12  ARG  40          1HH1      ARG  40  10.391   4.614  11.842
  266   HH21  ARG  40          2HH2      ARG  40  10.597   1.951   9.586
  267   HH22  ARG  40          1HH2      ARG  40  11.490   3.128  10.487
  268    H    SER  41           H        SER  41   2.117   5.762   9.455
  269    HA   SER  41           HA       SER  41   0.630   4.611  11.698
  270    HB2  SER  41           1HB      SER  41  -0.807   6.604  11.509
  271    HB3  SER  41           2HB      SER  41   0.891   7.052  11.677
  272    HG   SER  41           HG       SER  41   0.935   7.313   9.382
  273    H    CYS  42           H        CYS  42   0.169   5.480   8.282
  274    HA   CYS  42           HA       CYS  42  -2.421   4.394   8.038
  275    HB2  CYS  42           1HB      CYS  42  -0.292   4.862   5.940
  276    HB3  CYS  42           2HB      CYS  42  -1.970   4.460   5.589
  277    H    PHE  43           H        PHE  43   0.790   3.018   7.593
  278    HA   PHE  43           HA       PHE  43   0.021   0.593   6.404
  279    HB2  PHE  43           1HB      PHE  43   2.363   1.492   6.552
  280    HB3  PHE  43           2HB      PHE  43   2.380   1.013   8.246
  281    HD1  PHE  43           2HD      PHE  43   1.510  -0.507   4.947
  282    HD2  PHE  43           1HD      PHE  43   3.425  -0.963   8.721
  283    HE1  PHE  43           2HE      PHE  43   2.247  -2.762   4.297
  284    HE2  PHE  43           1HE      PHE  43   4.166  -3.219   8.076
  285    HZ   PHE  43           HZ       PHE  43   3.576  -4.122   5.862
  286    H    ARG  44           H        ARG  44  -1.705  -0.394   7.371
  287    HA   ARG  44           HA       ARG  44  -1.152  -1.699   9.921
  288    HB2  ARG  44           1HB      ARG  44  -3.764  -0.262   9.438
  289    HB3  ARG  44           2HB      ARG  44  -3.254  -1.081  10.909
  290    HG2  ARG  44           1HG      ARG  44  -1.629   0.585  11.376
  291    HG3  ARG  44           2HG      ARG  44  -1.836   1.318   9.784
  292    HD2  ARG  44           1HD      ARG  44  -3.974   2.144  10.329
  293    HD3  ARG  44           2HD      ARG  44  -4.091   1.118  11.758
  294    HE   ARG  44           HE       ARG  44  -1.989   2.646  12.371
  295   HH11  ARG  44          2HH1      ARG  44  -5.123   3.459  11.093
  296   HH12  ARG  44          1HH1      ARG  44  -5.163   5.026  11.831
  297   HH21  ARG  44          2HH2      ARG  44  -2.029   4.706  13.349
  298   HH22  ARG  44          1HH2      ARG  44  -3.401   5.735  13.114
  299    H    CYS  45           H        CYS  45  -3.011  -3.298  10.419
  300    HA   CYS  45           HA       CYS  45  -3.130  -5.192   8.385
  301    HB2  CYS  45           1HB      CYS  45  -3.505  -5.590  10.845
  302    HB3  CYS  45           2HB      CYS  45  -5.124  -4.930  10.641
  303    H    HIS  46           H        HIS  46  -5.153  -6.091   7.403
  304    HA   HIS  46           HA       HIS  46  -6.734  -3.882   6.294
  305    HB2  HIS  46           1HB      HIS  46  -5.627  -5.157   4.595
  306    HB3  HIS  46           2HB      HIS  46  -6.183  -6.677   5.289
  307    HD1  HIS  46           1HD      HIS  46  -7.204  -3.932   3.024
  308    HD2  HIS  46           2HD      HIS  46  -8.917  -7.279   4.790
  309    HE1  HIS  46           1HE      HIS  46  -9.366  -4.307   1.795
  310    H    THR  47           H        THR  47  -6.967  -6.144   8.668
  311    HA   THR  47           HA       THR  47  -9.893  -6.347   8.371
  312    HB   THR  47           HB       THR  47  -7.935  -8.319   9.532
  313    HG1  THR  47           1HG      THR  47  -8.930  -8.169   7.206
  314   HG21  THR  47          1HG2      THR  47  -9.864  -9.622  10.324
  315   HG22  THR  47          2HG2      THR  47 -10.936  -8.294   9.876
  316   HG23  THR  47          3HG2      THR  47  -9.741  -8.071  11.153
  317    H    CYS  48           H        CYS  48  -7.201  -5.887  10.603
  318    HA   CYS  48           HA       CYS  48  -9.110  -4.868  12.604
  319    HB2  CYS  48           1HB      CYS  48  -7.334  -5.349  14.284
  320    HB3  CYS  48           2HB      CYS  48  -7.924  -6.790  13.462
  321    H    GLU  49           H        GLU  49  -6.895  -3.918  10.344
  322    HA   GLU  49           HA       GLU  49  -5.649  -2.042   9.974
  323    HB2  GLU  49           1HB      GLU  49  -7.756  -0.830  11.772
  324    HB3  GLU  49           2HB      GLU  49  -6.701   0.062  10.686
  325    HG2  GLU  49           1HG      GLU  49  -7.701  -1.219   8.791
  326    HG3  GLU  49           2HG      GLU  49  -8.859  -1.893   9.936
  327    H    ALA  50           H        ALA  50  -4.479  -3.591  11.886
  328    HA   ALA  50           HA       ALA  50  -3.744  -1.836  14.104
  329    HB1  ALA  50           1HB      ALA  50  -4.266  -4.100  14.717
  330    HB2  ALA  50           2HB      ALA  50  -3.096  -4.728  13.555
  331    HB3  ALA  50           3HB      ALA  50  -2.541  -3.826  14.965
  332    H    THR  51           H        THR  51  -1.704  -1.038  14.431
  333    HA   THR  51           HA       THR  51  -0.128  -0.383  12.245
  334    HB   THR  51           HB       THR  51   0.810  -0.583  15.113
  335    HG1  THR  51           1HG      THR  51  -0.017   1.828  13.947
  336   HG21  THR  51          1HG2      THR  51   2.707  -0.272  13.732
  337   HG22  THR  51          2HG2      THR  51   2.296   1.331  14.342
  338   HG23  THR  51          3HG2      THR  51   1.858   0.874  12.696
  339    H    LEU  52           H        LEU  52   0.488  -2.077  10.956
  340    HA   LEU  52           HA       LEU  52   1.587  -4.502  11.902
  341    HB2  LEU  52           1HB      LEU  52   1.921  -3.211   9.199
  342    HB3  LEU  52           2HB      LEU  52   2.226  -4.903   9.588
  343    HG   LEU  52           HG       LEU  52  -0.476  -3.567   9.717
  344   HD11  LEU  52          1HD1      LEU  52   0.305  -5.606   7.683
  345   HD12  LEU  52          2HD1      LEU  52   0.707  -3.909   7.422
  346   HD13  LEU  52          3HD1      LEU  52  -0.976  -4.395   7.629
  347   HD21  LEU  52          1HD2      LEU  52  -1.327  -5.508  10.476
  348   HD22  LEU  52          2HD2      LEU  52   0.315  -5.768  11.064
  349   HD23  LEU  52          3HD2      LEU  52  -0.202  -6.492   9.540
  350    H    TRP  53           H        TRP  53   3.266  -4.132  13.321
  351    HA   TRP  53           HA       TRP  53   5.437  -2.386  12.783
  352    HB2  TRP  53           1HB      TRP  53   5.586  -4.759  14.631
  353    HB3  TRP  53           2HB      TRP  53   6.406  -3.206  14.771
  354    HD1  TRP  53           HD       TRP  53   3.089  -4.920  15.519
  355    HE1  TRP  53           1HE      TRP  53   1.673  -3.377  17.015
  356    HE3  TRP  53           3HE      TRP  53   5.986  -0.712  15.318
  357    HZ2  TRP  53           2HZ      TRP  53   1.770  -0.727  17.981
  358    HZ3  TRP  53           3HZ      TRP  53   5.253   1.284  16.555
  359    HH2  TRP  53           HH       TRP  53   3.188   1.275  17.858
  360    HA   PRO  54           HA       PRO  54   8.030  -4.768  10.162
  361    HB2  PRO  54           1HB      PRO  54  10.489  -4.000  11.016
  362    HB3  PRO  54           2HB      PRO  54   9.423  -2.943  10.082
  363    HG2  PRO  54           1HG      PRO  54   9.903  -3.017  13.036
  364    HG3  PRO  54           2HG      PRO  54   9.768  -1.614  11.959
  365    HD2  PRO  54           1HD      PRO  54   7.725  -2.449  13.528
  366    HD3  PRO  54           2HD      PRO  54   7.464  -1.690  11.944
  367    H    GLY  55           H        GLY  55   7.235  -6.755  11.340
  368    HA2  GLY  55           1HA      GLY  55   8.983  -8.696  11.700
  369    HA3  GLY  55           2HA      GLY  55   9.161  -7.867  13.239
  370    H    GLY  56           H        GLY  56   6.072  -7.970  11.643
  371    HA2  GLY  56           1HA      GLY  56   5.135 -10.327  12.985
  372    HA3  GLY  56           2HA      GLY  56   4.606  -8.852  13.781
  373    H    TYR  57           H        TYR  57   5.029  -9.410  10.314
  374    HA   TYR  57           HA       TYR  57   2.170  -9.580   9.888
  375    HB2  TYR  57           1HB      TYR  57   1.908  -7.596   8.628
  376    HB3  TYR  57           2HB      TYR  57   2.772  -7.107  10.081
  377    HD1  TYR  57           2HD      TYR  57   5.263  -6.737   9.943
  378    HD2  TYR  57           1HD      TYR  57   2.838  -7.258   6.486
  379    HE1  TYR  57           2HE      TYR  57   7.033  -5.739   8.558
  380    HE2  TYR  57           1HE      TYR  57   4.603  -6.262   5.091
  381    HH   TYR  57           HH       TYR  57   7.037  -5.914   5.173
  382    H    GLU  58           H        GLU  58   1.712  -9.645   7.446
  383    HA   GLU  58           HA       GLU  58   3.878 -10.469   5.749
  384    HB2  GLU  58           1HB      GLU  58   1.980 -12.490   6.908
  385    HB3  GLU  58           2HB      GLU  58   2.724 -12.747   5.337
  386    HG2  GLU  58           1HG      GLU  58   4.947 -12.321   6.559
  387    HG3  GLU  58           2HG      GLU  58   4.017 -12.605   8.029
  388    H    GLN  59           H        GLN  59   3.186 -10.900   3.558
  389    HA   GLN  59           HA       GLN  59   0.594  -9.640   2.968
  390    HB2  GLN  59           1HB      GLN  59   2.381  -8.349   2.048
  391    HB3  GLN  59           2HB      GLN  59   3.153  -9.780   1.378
  392    HG2  GLN  59           1HG      GLN  59   0.873  -9.977   0.072
  393    HG3  GLN  59           2HG      GLN  59   0.814  -8.243   0.390
  394   HE21  GLN  59          1HE2      GLN  59   0.984  -9.383  -2.167
  395   HE22  GLN  59          2HE2      GLN  59   2.497  -8.928  -2.864
  396    H    HIS  60           H        HIS  60  -0.935 -11.061   2.478
  397    HA   HIS  60           HA       HIS  60  -0.465 -13.734   1.730
  398    HB2  HIS  60           1HB      HIS  60  -2.569 -12.721   2.784
  399    HB3  HIS  60           2HB      HIS  60  -3.013 -12.231   1.151
  400    HD1  HIS  60           1HD      HIS  60  -3.998 -13.994  -0.365
  401    HD2  HIS  60           2HD      HIS  60  -2.518 -15.558   3.188
  402    HE1  HIS  60           1HE      HIS  60  -4.776 -16.385  -0.307
  403    HA   PRO  61           HA       PRO  61   0.474 -13.179  -2.566
  404    HB2  PRO  61           1HB      PRO  61   0.385 -15.803  -3.256
  405    HB3  PRO  61           2HB      PRO  61   1.736 -15.089  -2.368
  406    HG2  PRO  61           1HG      PRO  61  -0.584 -16.673  -1.333
  407    HG3  PRO  61           2HG      PRO  61   1.130 -16.780  -0.892
  408    HD2  PRO  61           1HD      PRO  61  -0.687 -15.470   0.629
  409    HD3  PRO  61           2HD      PRO  61   1.010 -14.960   0.518
  410    H    GLY  62           H        GLY  62  -2.341 -14.901  -1.372
  411    HA2  GLY  62           1HA      GLY  62  -3.701 -15.485  -3.700
  412    HA3  GLY  62           2HA      GLY  62  -4.483 -15.031  -2.194
  413    H    ASP  63           H        ASP  63  -5.142 -12.893  -1.873
  414    HA   ASP  63           HA       ASP  63  -6.016 -11.534  -4.182
  415    HB2  ASP  63           1HB      ASP  63  -5.921 -10.807  -1.265
  416    HB3  ASP  63           2HB      ASP  63  -6.479  -9.652  -2.472
  417    H    GLY  64           H        GLY  64  -3.488 -10.690  -1.812
  418    HA2  GLY  64           1HA      GLY  64  -1.344  -9.903  -2.738
  419    HA3  GLY  64           2HA      GLY  64  -2.284  -8.975  -3.897
  420    H    HIS  65           H        HIS  65  -2.746  -9.337  -0.398
  421    HA   HIS  65           HA       HIS  65  -2.197  -6.459  -0.109
  422    HB2  HIS  65           1HB      HIS  65  -4.483  -8.062   1.028
  423    HB3  HIS  65           2HB      HIS  65  -3.999  -6.509   1.702
  424    HD1  HIS  65           1HD      HIS  65  -4.348  -4.402   0.167
  425    HD2  HIS  65           2HD      HIS  65  -5.966  -7.936  -1.300
  426    HE1  HIS  65           1HE      HIS  65  -5.924  -3.710  -1.667
  427    H    PHE  66           H        PHE  66  -2.321  -6.098   2.523
  428    HA   PHE  66           HA       PHE  66  -0.400  -8.038   3.634
  429    HB2  PHE  66           1HB      PHE  66  -0.479  -5.033   3.866
  430    HB3  PHE  66           2HB      PHE  66   0.441  -6.034   4.985
  431    HD1  PHE  66           2HD      PHE  66   0.020  -5.362   1.351
  432    HD2  PHE  66           1HD      PHE  66   2.618  -6.618   4.479
  433    HE1  PHE  66           2HE      PHE  66   1.905  -5.388  -0.230
  434    HE2  PHE  66           1HE      PHE  66   4.508  -6.645   2.904
  435    HZ   PHE  66           HZ       PHE  66   4.153  -6.030   0.545
  436    H    TYR  67           H        TYR  67  -1.032  -9.040   5.421
  437    HA   TYR  67           HA       TYR  67  -2.997  -7.723   7.169
  438    HB2  TYR  67           1HB      TYR  67  -3.058 -10.672   6.525
  439    HB3  TYR  67           2HB      TYR  67  -4.255  -9.744   7.421
  440    HD1  TYR  67           2HD      TYR  67  -2.764 -10.193   4.052
  441    HD2  TYR  67           1HD      TYR  67  -6.048  -8.703   6.310
  442    HE1  TYR  67           2HE      TYR  67  -4.013  -9.805   1.969
  443    HE2  TYR  67           1HE      TYR  67  -7.307  -8.313   4.234
  444    HH   TYR  67           HH       TYR  67  -6.727  -7.904   1.779
  445    H    CYS  68           H        CYS  68  -3.098  -8.743   9.354
  446    HA   CYS  68           HA       CYS  68  -0.457  -8.981  10.417
  447    HB2  CYS  68           1HB      CYS  68  -1.546  -9.158  12.581
  448    HB3  CYS  68           2HB      CYS  68  -2.309  -7.881  11.641
  449    H    LEU  69           H        LEU  69   0.070 -10.778  11.999
  450    HA   LEU  69           HA       LEU  69  -0.085 -13.277  10.596
  451    HB2  LEU  69           1HB      LEU  69   1.032 -12.777  13.347
  452    HB3  LEU  69           2HB      LEU  69   1.402 -14.120  12.267
  453    HG   LEU  69           HG       LEU  69   2.231 -11.239  11.950
  454   HD11  LEU  69          1HD1      LEU  69   3.913 -13.722  12.207
  455   HD12  LEU  69          2HD1      LEU  69   3.482 -12.684  13.566
  456   HD13  LEU  69          3HD1      LEU  69   4.451 -12.042  12.240
  457   HD21  LEU  69          1HD2      LEU  69   1.550 -12.433   9.808
  458   HD22  LEU  69          2HD2      LEU  69   2.931 -13.494  10.091
  459   HD23  LEU  69          3HD2      LEU  69   3.181 -11.762   9.866
  460    H    GLN  70           H        GLN  70  -2.467 -11.928  12.047
  461    HA   GLN  70           HA       GLN  70  -3.352 -14.367  13.442
  462    HB2  GLN  70           1HB      GLN  70  -3.065 -12.678  15.113
  463    HB3  GLN  70           2HB      GLN  70  -3.903 -11.483  14.133
  464    HG2  GLN  70           1HG      GLN  70  -5.401 -12.140  15.829
  465    HG3  GLN  70           2HG      GLN  70  -5.961 -12.901  14.341
  466   HE21  GLN  70          1HE2      GLN  70  -6.999 -14.619  15.198
  467   HE22  GLN  70          2HE2      GLN  70  -6.226 -15.866  16.110
  468    H    HIS  71           H        HIS  71  -3.944 -12.041  11.015
  469    HA   HIS  71           HA       HIS  71  -6.644 -13.142  10.581
  470    HB2  HIS  71           1HB      HIS  71  -5.541 -10.384  10.127
  471    HB3  HIS  71           2HB      HIS  71  -6.943 -10.950   9.225
  472    HD2  HIS  71           2HD      HIS  71  -7.770 -12.514  12.349
  473    HE1  HIS  71           1HE      HIS  71  -8.873  -8.475  13.039
  474    HE2  HIS  71           2HE      HIS  71  -9.022 -10.845  13.879
  475    H    LEU  72           H        LEU  72  -3.496 -12.728   9.323
  476    HA   LEU  72           HA       LEU  72  -3.812 -12.694   6.596
  477    HB2  LEU  72           1HB      LEU  72  -1.658 -12.663   7.844
  478    HB3  LEU  72           2HB      LEU  72  -1.825 -14.401   8.088
  479    HG   LEU  72           HG       LEU  72  -1.980 -14.351   5.426
  480   HD11  LEU  72          1HD1      LEU  72  -0.115 -12.064   6.017
  481   HD12  LEU  72          2HD1      LEU  72  -1.766 -11.851   5.435
  482   HD13  LEU  72          3HD1      LEU  72  -0.584 -12.702   4.441
  483   HD21  LEU  72          1HD2      LEU  72  -0.378 -15.580   6.903
  484   HD22  LEU  72          2HD2      LEU  72   0.655 -14.151   6.874
  485   HD23  LEU  72          3HD2      LEU  72   0.309 -15.020   5.378
  486    HA   PRO  73           HA       PRO  73  -6.187 -16.431   5.981
  487    HB2  PRO  73           1HB      PRO  73  -6.487 -16.101   3.303
  488    HB3  PRO  73           2HB      PRO  73  -7.445 -15.213   4.494
  489    HG2  PRO  73           1HG      PRO  73  -5.025 -14.328   2.970
  490    HG3  PRO  73           2HG      PRO  73  -6.520 -13.437   3.313
  491    HD2  PRO  73           1HD      PRO  73  -4.239 -13.053   4.721
  492    HD3  PRO  73           2HD      PRO  73  -5.850 -12.885   5.448
  493    H    GLN  74           H        GLN  74  -6.050 -18.076   3.955
  494    HA   GLN  74           HA       GLN  74  -3.340 -18.549   3.073
  495    HB2  GLN  74           1HB      GLN  74  -4.594 -20.097   5.276
  496    HB3  GLN  74           2HB      GLN  74  -3.697 -21.010   4.070
  497    HG2  GLN  74           1HG      GLN  74  -2.611 -18.712   5.682
  498    HG3  GLN  74           2HG      GLN  74  -2.323 -20.421   6.004
  499   HE21  GLN  74          1HE2      GLN  74  -1.558 -17.710   4.006
  500   HE22  GLN  74          2HE2      GLN  74  -0.254 -18.444   3.143
  501    H    THR  75           H        THR  75  -3.412 -19.354   1.086
  502    HA   THR  75           HA       THR  75  -5.884 -20.086  -0.125
  503    HB   THR  75           HB       THR  75  -4.165 -18.991  -1.447
  504    HG1  THR  75           1HG      THR  75  -4.623 -20.154  -3.195
  505   HG21  THR  75          1HG2      THR  75  -2.496 -21.476  -1.427
  506   HG22  THR  75          2HG2      THR  75  -2.297 -20.270  -0.155
  507   HG23  THR  75          3HG2      THR  75  -2.038 -19.824  -1.842
  508    H    ASP  76           H        ASP  76  -6.842 -21.940   0.450
  509    HA   ASP  76           HA       ASP  76  -5.243 -24.406   0.289
  510    HB2  ASP  76           1HB      ASP  76  -5.585 -24.296   2.582
  511    HB3  ASP  76           2HB      ASP  76  -7.161 -23.526   2.413
  512    H    SER  77           H        SER  77  -8.597 -23.201   0.385
  513    HA   SER  77           HA       SER  77  -9.810 -25.400  -0.813
  514    HB2  SER  77           1HB      SER  77 -10.670 -22.515  -1.122
  515    HB3  SER  77           2HB      SER  77 -11.691 -23.946  -1.267
  516    HG   SER  77           HG       SER  77 -11.164 -24.370   0.969
  517    H    GLY  78           H        GLY  78 -10.914 -25.324  -3.015
  518    HA2  GLY  78           1HA      GLY  78 -10.819 -24.585  -5.308
  519    HA3  GLY  78           2HA      GLY  78  -9.144 -24.123  -5.042
  520    HA   PRO  79           HA       PRO  79  -9.772 -28.801  -6.230
  521    HB2  PRO  79           1HB      PRO  79 -10.714 -28.787  -8.776
  522    HB3  PRO  79           2HB      PRO  79 -11.770 -28.885  -7.362
  523    HG2  PRO  79           1HG      PRO  79 -11.069 -26.508  -9.042
  524    HG3  PRO  79           2HG      PRO  79 -12.646 -26.993  -8.392
  525    HD2  PRO  79           1HD      PRO  79 -11.126 -25.068  -7.244
  526    HD3  PRO  79           2HD      PRO  79 -12.190 -26.133  -6.302
  527    H    SER  80           H        SER  80  -8.180 -29.886  -7.360
  528    HA   SER  80           HA       SER  80  -5.836 -28.679  -8.000
  529    HB2  SER  80           1HB      SER  80  -7.045 -31.202  -9.133
  530    HB3  SER  80           2HB      SER  80  -5.395 -30.698  -9.497
  531    HG   SER  80           HG       SER  80  -5.070 -30.662  -7.170
  532    H    SER  81           H        SER  81  -4.737 -28.522 -10.162
  533    HA   SER  81           HA       SER  81  -5.697 -26.535 -11.715
  534    HB2  SER  81           1HB      SER  81  -3.431 -27.824 -11.827
  535    HB3  SER  81           2HB      SER  81  -4.235 -28.780 -13.072
  536    HG   SER  81           HG       SER  81  -3.147 -27.022 -13.997
  537    H    GLY  82           H        GLY  82  -6.322 -29.991 -12.203
  538    HA2  GLY  82           1HA      GLY  82  -8.208 -30.972 -13.142
  539    HA3  GLY  82           2HA      GLY  82  -8.812 -29.369 -13.535
  Start of MODEL   14
    1    H1   GLY   1           H        GLY   1 -18.256   5.559 -10.509
    2    HA2  GLY   1           1HA      GLY   1 -19.079   6.036 -13.012
    3    HA3  GLY   1           2HA      GLY   1 -19.193   7.641 -12.306
    4    H    SER   2           H        SER   2 -16.978   7.705 -10.681
    5    HA   SER   2           HA       SER   2 -14.744   8.135 -10.693
    6    HB2  SER   2           1HB      SER   2 -14.566   5.703 -11.168
    7    HB3  SER   2           2HB      SER   2 -14.622   6.059 -12.894
    8    HG   SER   2           HG       SER   2 -12.479   5.853 -12.208
    9    H    SER   3           H        SER   3 -16.348   9.873 -12.110
   10    HA   SER   3           HA       SER   3 -15.575  10.386 -14.752
   11    HB2  SER   3           1HB      SER   3 -17.482  11.421 -13.258
   12    HB3  SER   3           2HB      SER   3 -16.261  12.646 -12.910
   13    HG   SER   3           HG       SER   3 -17.733  12.943 -14.811
   14    H    GLY   4           H        GLY   4 -14.044  11.745 -15.665
   15    HA2  GLY   4           1HA      GLY   4 -11.867  12.558 -13.838
   16    HA3  GLY   4           2HA      GLY   4 -11.595  11.958 -15.467
   17    H    SER   5           H        SER   5 -10.710  14.464 -14.306
   18    HA   SER   5           HA       SER   5 -11.987  16.283 -16.230
   19    HB2  SER   5           1HB      SER   5 -11.190  16.999 -13.397
   20    HB3  SER   5           2HB      SER   5 -11.807  18.127 -14.604
   21    HG   SER   5           HG       SER   5 -13.378  15.903 -14.202
   22    H    SER   6           H        SER   6 -10.553  18.390 -16.331
   23    HA   SER   6           HA       SER   6  -7.921  17.477 -17.120
   24    HB2  SER   6           1HB      SER   6  -9.102  18.957 -18.636
   25    HB3  SER   6           2HB      SER   6  -9.274  20.173 -17.371
   26    HG   SER   6           HG       SER   6  -6.867  20.102 -17.339
   27    H    GLY   7           H        GLY   7  -5.972  18.155 -16.279
   28    HA2  GLY   7           1HA      GLY   7  -4.891  19.919 -14.835
   29    HA3  GLY   7           2HA      GLY   7  -6.151  19.533 -13.672
   30    H    GLN   8           H        GLN   8  -4.690  18.922 -12.074
   31    HA   GLN   8           HA       GLN   8  -3.069  17.653 -11.038
   32    HB2  GLN   8           1HB      GLN   8  -4.915  15.606 -12.272
   33    HB3  GLN   8           2HB      GLN   8  -3.701  15.217 -11.060
   34    HG2  GLN   8           1HG      GLN   8  -5.862  17.252 -10.606
   35    HG3  GLN   8           2HG      GLN   8  -6.057  15.541 -10.228
   36   HE21  GLN   8          1HE2      GLN   8  -5.874  18.099  -8.605
   37   HE22  GLN   8          2HE2      GLN   8  -4.713  17.731  -7.380
   38    H    HIS   9           H        HIS   9  -2.084  18.542 -13.483
   39    HA   HIS   9           HA       HIS   9  -0.805  16.227 -14.727
   40    HB2  HIS   9           1HB      HIS   9   0.163  18.161 -16.213
   41    HB3  HIS   9           2HB      HIS   9  -1.505  17.636 -16.425
   42    HD1  HIS   9           1HD      HIS   9  -2.307  19.899 -17.305
   43    HD2  HIS   9           2HD      HIS   9  -0.578  20.100 -13.532
   44    HE1  HIS   9           1HE      HIS   9  -2.850  22.196 -16.437
   45    H    GLN  10           H        GLN  10   0.979  15.520 -13.758
   46    HA   GLN  10           HA       GLN  10   3.053  15.468 -12.828
   47    HB2  GLN  10           1HB      GLN  10   3.264  18.336 -13.759
   48    HB3  GLN  10           2HB      GLN  10   4.599  17.285 -13.305
   49    HG2  GLN  10           1HG      GLN  10   2.777  16.976 -15.678
   50    HG3  GLN  10           2HG      GLN  10   4.480  17.430 -15.692
   51   HE21  GLN  10          1HE2      GLN  10   3.010  15.170 -16.929
   52   HE22  GLN  10          2HE2      GLN  10   3.837  13.749 -16.398
   53    H    GLU  11           H        GLU  11   0.949  15.938 -11.112
   54    HA   GLU  11           HA       GLU  11   0.836  18.043  -9.447
   55    HB2  GLU  11           1HB      GLU  11  -0.410  15.901  -9.166
   56    HB3  GLU  11           2HB      GLU  11   1.036  15.193  -8.462
   57    HG2  GLU  11           1HG      GLU  11   0.935  17.044  -6.739
   58    HG3  GLU  11           2HG      GLU  11  -0.677  17.394  -7.358
   59    H    ALA  12           H        ALA  12   3.351  15.544  -9.344
   60    HA   ALA  12           HA       ALA  12   5.224  17.433  -8.223
   61    HB1  ALA  12           1HB      ALA  12   4.895  16.890  -6.091
   62    HB2  ALA  12           2HB      ALA  12   3.835  15.548  -6.523
   63    HB3  ALA  12           3HB      ALA  12   5.582  15.311  -6.474
   64    H    GLY  13           H        GLY  13   6.986  17.126  -9.408
   65    HA2  GLY  13           1HA      GLY  13   7.554  15.128 -11.158
   66    HA3  GLY  13           2HA      GLY  13   8.805  16.038 -10.325
   67    H    ALA  14           H        ALA  14   9.841  15.141  -8.538
   68    HA   ALA  14           HA       ALA  14  10.240  12.381  -8.569
   69    HB1  ALA  14           1HB      ALA  14  11.977  13.640  -7.660
   70    HB2  ALA  14           2HB      ALA  14  10.901  14.509  -6.564
   71    HB3  ALA  14           3HB      ALA  14  11.285  12.814  -6.263
   72    H    GLY  15           H        GLY  15   9.192  10.707  -7.693
   73    HA2  GLY  15           1HA      GLY  15   6.662  11.003  -6.494
   74    HA3  GLY  15           2HA      GLY  15   7.597   9.516  -6.552
   75    H    ASP  16           H        ASP  16   8.373   8.733  -4.699
   76    HA   ASP  16           HA       ASP  16   8.859   8.527  -2.486
   77    HB2  ASP  16           1HB      ASP  16   9.596  11.397  -2.988
   78    HB3  ASP  16           2HB      ASP  16   9.701  10.715  -1.368
   79    H    LEU  17           H        LEU  17   6.155   8.913  -3.205
   80    HA   LEU  17           HA       LEU  17   5.151  10.253  -0.782
   81    HB2  LEU  17           1HB      LEU  17   3.489  10.061  -3.255
   82    HB3  LEU  17           2HB      LEU  17   3.365  11.193  -1.910
   83    HG   LEU  17           HG       LEU  17   5.558  11.241  -3.980
   84   HD11  LEU  17          1HD1      LEU  17   3.927  12.004  -5.320
   85   HD12  LEU  17          2HD1      LEU  17   4.107  13.489  -4.387
   86   HD13  LEU  17          3HD1      LEU  17   2.834  12.339  -3.977
   87   HD21  LEU  17          1HD2      LEU  17   5.919  12.207  -1.628
   88   HD22  LEU  17          2HD2      LEU  17   4.761  13.447  -2.110
   89   HD23  LEU  17          3HD2      LEU  17   6.263  13.243  -3.013
   90    H    CYS  18           H        CYS  18   3.716   9.142   0.436
   91    HA   CYS  18           HA       CYS  18   3.557   6.450   0.508
   92    HB2  CYS  18           1HB      CYS  18   2.632   7.672   2.320
   93    HB3  CYS  18           2HB      CYS  18   1.471   8.486   1.276
   94    H    ALA  19           H        ALA  19   1.759   4.944   0.033
   95    HA   ALA  19           HA       ALA  19   0.781   5.402  -2.692
   96    HB1  ALA  19           1HB      ALA  19   0.284   2.743  -1.750
   97    HB2  ALA  19           2HB      ALA  19   1.319   3.284  -3.072
   98    HB3  ALA  19           3HB      ALA  19   1.962   3.187  -1.433
   99    H    LEU  20           H        LEU  20  -0.315   4.477   0.537
  100    HA   LEU  20           HA       LEU  20  -2.963   3.872   0.000
  101    HB2  LEU  20           1HB      LEU  20  -1.449   4.831   2.341
  102    HB3  LEU  20           2HB      LEU  20  -3.191   5.094   2.394
  103    HG   LEU  20           HG       LEU  20  -3.194   2.509   1.738
  104   HD11  LEU  20          1HD1      LEU  20  -1.001   1.884   1.658
  105   HD12  LEU  20          2HD1      LEU  20  -1.335   1.583   3.363
  106   HD13  LEU  20          3HD1      LEU  20  -0.504   3.060   2.876
  107   HD21  LEU  20          1HD2      LEU  20  -4.415   3.070   3.598
  108   HD22  LEU  20          2HD2      LEU  20  -3.066   3.903   4.370
  109   HD23  LEU  20          3HD2      LEU  20  -3.108   2.140   4.331
  110    H    CYS  21           H        CYS  21  -1.834   7.016   1.258
  111    HA   CYS  21           HA       CYS  21  -4.226   8.278   0.160
  112    HB2  CYS  21           1HB      CYS  21  -3.432  10.276   1.442
  113    HB3  CYS  21           2HB      CYS  21  -3.728   8.857   2.441
  114    H    GLY  22           H        GLY  22  -0.695   8.772   0.105
  115    HA2  GLY  22           1HA      GLY  22   0.420   9.134  -2.016
  116    HA3  GLY  22           2HA      GLY  22  -1.022   9.973  -2.569
  117    H    GLU  23           H        GLU  23   0.735  10.341   0.488
  118    HA   GLU  23           HA       GLU  23   1.128  13.176  -0.199
  119    HB2  GLU  23           1HB      GLU  23   1.146  11.971   2.568
  120    HB3  GLU  23           2HB      GLU  23   1.088  13.676   2.144
  121    HG2  GLU  23           1HG      GLU  23  -1.096  11.910   1.181
  122    HG3  GLU  23           2HG      GLU  23  -1.065  12.360   2.885
  123    H    HIS  24           H        HIS  24   3.047  14.136   1.119
  124    HA   HIS  24           HA       HIS  24   5.414  13.046   0.114
  125    HB2  HIS  24           1HB      HIS  24   4.776  15.431   1.168
  126    HB3  HIS  24           2HB      HIS  24   5.594  14.725   2.559
  127    HD1  HIS  24           1HD      HIS  24   6.328  16.820  -0.139
  128    HD2  HIS  24           2HD      HIS  24   8.241  13.516   1.498
  129    HE1  HIS  24           1HE      HIS  24   8.719  16.982  -0.901
  130    H    LEU  25           H        LEU  25   7.165  12.000   1.126
  131    HA   LEU  25           HA       LEU  25   6.468  10.572   3.608
  132    HB2  LEU  25           1HB      LEU  25   8.000   9.571   1.215
  133    HB3  LEU  25           2HB      LEU  25   7.871   8.705   2.745
  134    HG   LEU  25           HG       LEU  25   5.439   9.447   1.146
  135   HD11  LEU  25          1HD1      LEU  25   7.432   7.331   0.625
  136   HD12  LEU  25          2HD1      LEU  25   6.326   8.149  -0.478
  137   HD13  LEU  25          3HD1      LEU  25   5.735   6.854   0.563
  138   HD21  LEU  25          1HD2      LEU  25   4.858   8.792   3.318
  139   HD22  LEU  25          2HD2      LEU  25   6.072   7.513   3.353
  140   HD23  LEU  25          3HD2      LEU  25   4.636   7.340   2.343
  141    H    TYR  26           H        TYR  26   8.367   9.805   4.850
  142    HA   TYR  26           HA       TYR  26  10.573  11.749   4.663
  143    HB2  TYR  26           1HB      TYR  26   8.973  11.721   6.713
  144    HB3  TYR  26           2HB      TYR  26   9.866  10.280   7.186
  145    HD1  TYR  26           1HD      TYR  26  10.854  13.596   5.758
  146    HD2  TYR  26           2HD      TYR  26  11.364  10.742   8.872
  147    HE1  TYR  26           1HE      TYR  26  12.595  15.013   6.762
  148    HE2  TYR  26           2HE      TYR  26  13.106  12.152   9.886
  149    HH   TYR  26           HH       TYR  26  13.925  15.322   8.530
  150    H    VAL  27           H        VAL  27  12.684  10.996   5.411
  151    HA   VAL  27           HA       VAL  27  13.467   8.605   4.164
  152    HB   VAL  27           HB       VAL  27  15.648   8.935   5.290
  153   HG11  VAL  27          1HG1      VAL  27  16.250  10.864   4.092
  154   HG12  VAL  27          2HG1      VAL  27  14.879  10.189   3.209
  155   HG13  VAL  27          3HG1      VAL  27  14.647  11.578   4.271
  156   HG21  VAL  27          1HG2      VAL  27  15.513  11.395   6.475
  157   HG22  VAL  27          2HG2      VAL  27  14.004  10.648   7.000
  158   HG23  VAL  27          3HG2      VAL  27  15.544   9.854   7.333
  159    H    LEU  28           H        LEU  28  12.031   9.137   7.188
  160    HA   LEU  28           HA       LEU  28  12.850   6.457   8.099
  161    HB2  LEU  28           1HB      LEU  28  12.057   8.854   9.746
  162    HB3  LEU  28           2HB      LEU  28  12.375   7.246  10.393
  163    HG   LEU  28           HG       LEU  28  14.506   8.638   8.832
  164   HD11  LEU  28          1HD1      LEU  28  14.635   9.071  11.714
  165   HD12  LEU  28          2HD1      LEU  28  13.315   9.936  10.927
  166   HD13  LEU  28          3HD1      LEU  28  14.975  10.176  10.382
  167   HD21  LEU  28          1HD2      LEU  28  15.783   7.425  10.781
  168   HD22  LEU  28          2HD2      LEU  28  15.215   6.527   9.373
  169   HD23  LEU  28          3HD2      LEU  28  14.295   6.482  10.877
  170    H    GLU  29           H        GLU  29  10.203   8.831   8.367
  171    HA   GLU  29           HA       GLU  29   8.223   7.163   9.318
  172    HB2  GLU  29           1HB      GLU  29   7.838   9.382   7.303
  173    HB3  GLU  29           2HB      GLU  29   6.616   8.731   8.386
  174    HG2  GLU  29           1HG      GLU  29   8.192   9.466  10.274
  175    HG3  GLU  29           2HG      GLU  29   8.984  10.439   9.036
  176    H    ARG  30           H        ARG  30   9.387   7.558   6.024
  177    HA   ARG  30           HA       ARG  30   7.358   6.152   4.692
  178    HB2  ARG  30           1HB      ARG  30   8.802   6.089   2.827
  179    HB3  ARG  30           2HB      ARG  30   9.216   7.571   3.679
  180    HG2  ARG  30           1HG      ARG  30  11.110   6.356   4.740
  181    HG3  ARG  30           2HG      ARG  30  10.734   4.974   3.709
  182    HD2  ARG  30           1HD      ARG  30  11.321   6.119   1.760
  183    HD3  ARG  30           2HD      ARG  30  11.206   7.694   2.543
  184    HE   ARG  30           HE       ARG  30  13.223   6.306   3.837
  185   HH11  ARG  30          2HH1      ARG  30  12.562   7.498   0.634
  186   HH12  ARG  30          1HH1      ARG  30  14.232   7.734   0.236
  187   HH21  ARG  30          2HH2      ARG  30  15.425   6.612   3.325
  188   HH22  ARG  30          1HH2      ARG  30  15.859   7.228   1.767
  189    H    LEU  31           H        LEU  31   7.038   4.022   4.228
  190    HA   LEU  31           HA       LEU  31   8.786   2.109   5.627
  191    HB2  LEU  31           1HB      LEU  31   5.856   2.295   5.280
  192    HB3  LEU  31           2HB      LEU  31   6.556   0.679   5.207
  193    HG   LEU  31           HG       LEU  31   7.563   1.089   7.452
  194   HD11  LEU  31          1HD1      LEU  31   6.648   3.739   6.925
  195   HD12  LEU  31          2HD1      LEU  31   7.609   3.142   8.278
  196   HD13  LEU  31          3HD1      LEU  31   5.848   3.127   8.373
  197   HD21  LEU  31          1HD2      LEU  31   4.651   0.956   6.898
  198   HD22  LEU  31          2HD2      LEU  31   5.157   1.211   8.568
  199   HD23  LEU  31          3HD2      LEU  31   5.711  -0.213   7.686
  200    H    CYS  32           H        CYS  32  10.184   1.379   4.130
  201    HA   CYS  32           HA       CYS  32   9.553   1.040   1.385
  202    HB2  CYS  32           1HB      CYS  32  11.869   1.284   2.651
  203    HB3  CYS  32           2HB      CYS  32  11.800  -0.474   2.640
  204    HG   CYS  32           HG       CYS  32  11.097   0.157  -0.363
  205    H    VAL  33           H        VAL  33   8.120  -0.408   0.697
  206    HA   VAL  33           HA       VAL  33   8.342  -3.165   1.699
  207    HB   VAL  33           HB       VAL  33   5.739  -1.751   1.107
  208   HG11  VAL  33          1HG1      VAL  33   6.431  -4.514   1.194
  209   HG12  VAL  33          2HG1      VAL  33   5.377  -4.147   2.561
  210   HG13  VAL  33          3HG1      VAL  33   4.854  -3.776   0.918
  211   HG21  VAL  33          1HG2      VAL  33   7.256  -2.228   3.612
  212   HG22  VAL  33          2HG2      VAL  33   6.210  -0.881   3.160
  213   HG23  VAL  33          3HG2      VAL  33   5.503  -2.414   3.669
  214    H    ASN  34           H        ASN  34   9.269  -4.116  -0.032
  215    HA   ASN  34           HA       ASN  34   9.502  -4.998  -2.115
  216    HB2  ASN  34           1HB      ASN  34   6.561  -4.319  -2.185
  217    HB3  ASN  34           2HB      ASN  34   7.377  -5.142  -3.511
  218   HD21  ASN  34          1HD2      ASN  34   5.255  -5.935  -1.530
  219   HD22  ASN  34          2HD2      ASN  34   5.818  -7.434  -0.880
  220    H    GLY  35           H        GLY  35  10.078  -2.187  -1.653
  221    HA2  GLY  35           1HA      GLY  35  11.125  -0.752  -3.242
  222    HA3  GLY  35           2HA      GLY  35   9.985  -1.314  -4.455
  223    H    HIS  36           H        HIS  36   7.624  -0.987  -2.876
  224    HA   HIS  36           HA       HIS  36   7.174   1.805  -3.340
  225    HB2  HIS  36           1HB      HIS  36   5.313  -0.134  -1.962
  226    HB3  HIS  36           2HB      HIS  36   4.885   1.364  -2.784
  227    HD1  HIS  36           1HD      HIS  36   5.944   1.171  -5.490
  228    HD2  HIS  36           2HD      HIS  36   4.556  -2.204  -3.504
  229    HE1  HIS  36           1HE      HIS  36   5.401  -0.494  -7.294
  230    H    PHE  37           H        PHE  37   5.967   3.106  -1.622
  231    HA   PHE  37           HA       PHE  37   7.132   2.643   1.039
  232    HB2  PHE  37           1HB      PHE  37   7.093   5.227  -0.524
  233    HB3  PHE  37           2HB      PHE  37   7.410   5.152   1.206
  234    HD1  PHE  37           2HD      PHE  37   9.423   3.945   2.031
  235    HD2  PHE  37           1HD      PHE  37   8.763   4.708  -2.104
  236    HE1  PHE  37           2HE      PHE  37  11.805   3.524   1.577
  237    HE2  PHE  37           1HE      PHE  37  11.143   4.287  -2.565
  238    HZ   PHE  37           HZ       PHE  37  12.667   3.695  -0.723
  239    H    PHE  38           H        PHE  38   5.911   3.351   2.796
  240    HA   PHE  38           HA       PHE  38   3.316   4.573   2.290
  241    HB2  PHE  38           1HB      PHE  38   3.512   1.984   3.834
  242    HB3  PHE  38           2HB      PHE  38   2.049   2.858   3.393
  243    HD1  PHE  38           1HD      PHE  38   4.903   0.955   2.001
  244    HD2  PHE  38           2HD      PHE  38   0.969   2.447   1.358
  245    HE1  PHE  38           1HE      PHE  38   4.740  -0.375  -0.062
  246    HE2  PHE  38           2HE      PHE  38   0.799   1.119  -0.705
  247    HZ   PHE  38           HZ       PHE  38   2.685  -0.296  -1.418
  248    H    HIS  39           H        HIS  39   2.293   5.393   4.205
  249    HA   HIS  39           HA       HIS  39   4.167   6.443   6.084
  250    HB2  HIS  39           1HB      HIS  39   1.149   6.571   5.965
  251    HB3  HIS  39           2HB      HIS  39   2.120   7.429   7.158
  252    HD2  HIS  39           2HD      HIS  39   4.192   9.101   5.629
  253    HE1  HIS  39           1HE      HIS  39   1.214  10.018   2.750
  254    HE2  HIS  39           2HE      HIS  39   3.502  10.594   3.632
  255    H    ARG  40           H        ARG  40   4.109   6.185   8.386
  256    HA   ARG  40           HA       ARG  40   4.092   3.518   9.234
  257    HB2  ARG  40           1HB      ARG  40   4.139   6.142  10.698
  258    HB3  ARG  40           2HB      ARG  40   4.076   4.621  11.578
  259    HG2  ARG  40           1HG      ARG  40   6.146   3.916  10.420
  260    HG3  ARG  40           2HG      ARG  40   6.224   5.509   9.665
  261    HD2  ARG  40           1HD      ARG  40   6.758   6.565  11.632
  262    HD3  ARG  40           2HD      ARG  40   5.974   5.339  12.627
  263    HE   ARG  40           HE       ARG  40   8.691   5.313  11.644
  264   HH11  ARG  40          2HH1      ARG  40   6.061   3.453  12.966
  265   HH12  ARG  40          1HH1      ARG  40   7.083   2.187  13.560
  266   HH21  ARG  40          2HH2      ARG  40  10.047   3.653  12.422
  267   HH22  ARG  40          1HH2      ARG  40   9.351   2.302  13.252
  268    H    SER  41           H        SER  41   1.598   5.960   9.245
  269    HA   SER  41           HA       SER  41  -0.164   4.409  10.942
  270    HB2  SER  41           1HB      SER  41  -0.727   6.933   9.367
  271    HB3  SER  41           2HB      SER  41  -1.757   6.235  10.617
  272    HG   SER  41           HG       SER  41  -0.045   6.593  12.102
  273    H    CYS  42           H        CYS  42  -0.178   5.531   7.561
  274    HA   CYS  42           HA       CYS  42  -2.491   4.293   6.699
  275    HB2  CYS  42           1HB      CYS  42   0.049   5.106   5.355
  276    HB3  CYS  42           2HB      CYS  42  -1.092   4.113   4.454
  277    H    PHE  43           H        PHE  43   0.788   2.959   6.875
  278    HA   PHE  43           HA       PHE  43   0.054   0.423   5.789
  279    HB2  PHE  43           1HB      PHE  43   2.391   1.525   5.867
  280    HB3  PHE  43           2HB      PHE  43   2.474   0.897   7.510
  281    HD1  PHE  43           2HD      PHE  43   1.478  -0.361   4.137
  282    HD2  PHE  43           1HD      PHE  43   3.608  -1.072   7.752
  283    HE1  PHE  43           2HE      PHE  43   2.230  -2.534   3.262
  284    HE2  PHE  43           1HE      PHE  43   4.365  -3.246   6.883
  285    HZ   PHE  43           HZ       PHE  43   3.675  -3.980   4.636
  286    H    ARG  44           H        ARG  44  -1.403  -0.777   6.847
  287    HA   ARG  44           HA       ARG  44  -0.736  -1.852   9.418
  288    HB2  ARG  44           1HB      ARG  44  -3.186  -1.122  10.198
  289    HB3  ARG  44           2HB      ARG  44  -1.759  -0.152  10.536
  290    HG2  ARG  44           1HG      ARG  44  -3.259   1.408   9.741
  291    HG3  ARG  44           2HG      ARG  44  -2.312   1.021   8.303
  292    HD2  ARG  44           1HD      ARG  44  -4.162  -0.767   7.902
  293    HD3  ARG  44           2HD      ARG  44  -5.109   0.232   9.003
  294    HE   ARG  44           HE       ARG  44  -4.266   2.052   7.251
  295   HH11  ARG  44          2HH1      ARG  44  -5.635  -1.112   6.767
  296   HH12  ARG  44          1HH1      ARG  44  -6.367  -0.707   5.250
  297   HH21  ARG  44          2HH2      ARG  44  -5.225   2.598   5.255
  298   HH22  ARG  44          1HH2      ARG  44  -6.132   1.404   4.390
  299    H    CYS  45           H        CYS  45  -2.510  -3.383  10.178
  300    HA   CYS  45           HA       CYS  45  -3.009  -5.317   8.295
  301    HB2  CYS  45           1HB      CYS  45  -3.228  -5.520  10.807
  302    HB3  CYS  45           2HB      CYS  45  -4.821  -4.786  10.653
  303    H    HIS  46           H        HIS  46  -5.146  -6.109   7.498
  304    HA   HIS  46           HA       HIS  46  -6.685  -3.845   6.433
  305    HB2  HIS  46           1HB      HIS  46  -5.761  -5.138   4.662
  306    HB3  HIS  46           2HB      HIS  46  -6.251  -6.652   5.417
  307    HD1  HIS  46           1HD      HIS  46  -7.410  -4.022   3.120
  308    HD2  HIS  46           2HD      HIS  46  -9.071  -7.185   5.240
  309    HE1  HIS  46           1HE      HIS  46  -9.677  -4.398   2.100
  310    H    THR  47           H        THR  47  -6.851  -6.108   8.821
  311    HA   THR  47           HA       THR  47  -9.793  -6.241   8.688
  312    HB   THR  47           HB       THR  47  -7.807  -8.189   9.845
  313    HG1  THR  47           1HG      THR  47 -10.027  -8.893   8.286
  314   HG21  THR  47          1HG2      THR  47  -9.580  -7.811  11.510
  315   HG22  THR  47          2HG2      THR  47  -9.676  -9.425  10.805
  316   HG23  THR  47          3HG2      THR  47 -10.795  -8.166  10.283
  317    H    CYS  48           H        CYS  48  -6.997  -5.540  10.674
  318    HA   CYS  48           HA       CYS  48  -8.799  -4.494  12.759
  319    HB2  CYS  48           1HB      CYS  48  -6.891  -4.863  14.345
  320    HB3  CYS  48           2HB      CYS  48  -7.574  -6.343  13.678
  321    H    GLU  49           H        GLU  49  -6.595  -3.702  10.377
  322    HA   GLU  49           HA       GLU  49  -5.484  -1.801   9.802
  323    HB2  GLU  49           1HB      GLU  49  -7.370  -0.538  11.800
  324    HB3  GLU  49           2HB      GLU  49  -6.430   0.328  10.593
  325    HG2  GLU  49           1HG      GLU  49  -7.648  -0.782   8.813
  326    HG3  GLU  49           2HG      GLU  49  -8.560  -1.714   9.999
  327    H    ALA  50           H        ALA  50  -4.305  -3.397  11.820
  328    HA   ALA  50           HA       ALA  50  -3.191  -1.507  13.748
  329    HB1  ALA  50           1HB      ALA  50  -3.917  -3.689  14.573
  330    HB2  ALA  50           2HB      ALA  50  -2.774  -4.483  13.489
  331    HB3  ALA  50           3HB      ALA  50  -2.183  -3.462  14.801
  332    H    THR  51           H        THR  51  -1.283  -0.556  13.478
  333    HA   THR  51           HA       THR  51   0.190  -0.429  11.225
  334    HB   THR  51           HB       THR  51   1.338  -0.364  14.022
  335    HG1  THR  51           1HG      THR  51   0.840   1.794  13.960
  336   HG21  THR  51          1HG2      THR  51   2.467   1.137  11.697
  337   HG22  THR  51          2HG2      THR  51   2.893  -0.559  11.924
  338   HG23  THR  51          3HG2      THR  51   3.255   0.617  13.187
  339    H    LEU  52           H        LEU  52   1.037  -1.972   9.998
  340    HA   LEU  52           HA       LEU  52   1.839  -4.512  11.094
  341    HB2  LEU  52           1HB      LEU  52   2.058  -3.410   8.297
  342    HB3  LEU  52           2HB      LEU  52   2.389  -5.077   8.761
  343    HG   LEU  52           HG       LEU  52  -0.299  -3.729   9.004
  344   HD11  LEU  52          1HD1      LEU  52   0.705  -5.675   6.931
  345   HD12  LEU  52          2HD1      LEU  52   0.363  -3.965   6.667
  346   HD13  LEU  52          3HD1      LEU  52  -0.947  -5.073   7.077
  347   HD21  LEU  52          1HD2      LEU  52  -1.159  -5.837   9.586
  348   HD22  LEU  52          2HD2      LEU  52   0.298  -5.651  10.562
  349   HD23  LEU  52          3HD2      LEU  52   0.326  -6.666   9.120
  350    H    TRP  53           H        TRP  53   3.634  -4.301  12.352
  351    HA   TRP  53           HA       TRP  53   5.861  -2.680  11.748
  352    HB2  TRP  53           1HB      TRP  53   6.040  -5.180  13.414
  353    HB3  TRP  53           2HB      TRP  53   6.910  -3.661  13.610
  354    HD1  TRP  53           HD       TRP  53   3.498  -5.265  14.308
  355    HE1  TRP  53           1HE      TRP  53   2.266  -3.837  16.059
  356    HE3  TRP  53           3HE      TRP  53   6.740  -1.320  14.563
  357    HZ2  TRP  53           2HZ      TRP  53   2.621  -1.364  17.374
  358    HZ3  TRP  53           3HZ      TRP  53   6.220   0.536  16.092
  359    HH2  TRP  53           HH       TRP  53   4.202   0.513  17.467
  360    HA   PRO  54           HA       PRO  54   8.140  -4.994   8.796
  361    HB2  PRO  54           1HB      PRO  54  10.690  -4.411   9.524
  362    HB3  PRO  54           2HB      PRO  54   9.623  -3.239   8.742
  363    HG2  PRO  54           1HG      PRO  54  10.296  -3.548  11.643
  364    HG3  PRO  54           2HG      PRO  54  10.165  -2.067  10.676
  365    HD2  PRO  54           1HD      PRO  54   8.190  -2.911  12.325
  366    HD3  PRO  54           2HD      PRO  54   7.865  -2.027  10.820
  367    H    GLY  55           H        GLY  55   7.594  -6.154  11.679
  368    HA2  GLY  55           1HA      GLY  55   9.183  -8.551  11.213
  369    HA3  GLY  55           2HA      GLY  55   9.468  -7.722  12.736
  370    H    GLY  56           H        GLY  56   6.391  -8.109  11.028
  371    HA2  GLY  56           1HA      GLY  56   5.425 -10.289  12.519
  372    HA3  GLY  56           2HA      GLY  56   4.960  -8.806  13.338
  373    H    TYR  57           H        TYR  57   5.156  -9.679   9.892
  374    HA   TYR  57           HA       TYR  57   2.291  -9.623   9.606
  375    HB2  TYR  57           1HB      TYR  57   2.012  -7.659   8.426
  376    HB3  TYR  57           2HB      TYR  57   3.249  -7.172   9.579
  377    HD1  TYR  57           2HD      TYR  57   5.618  -6.991   8.841
  378    HD2  TYR  57           1HD      TYR  57   2.458  -7.717   6.086
  379    HE1  TYR  57           2HE      TYR  57   7.087  -6.317   6.988
  380    HE2  TYR  57           1HE      TYR  57   3.919  -7.046   4.225
  381    HH   TYR  57           HH       TYR  57   5.906  -5.757   3.816
  382    H    GLU  58           H        GLU  58   1.595 -10.192   7.444
  383    HA   GLU  58           HA       GLU  58   3.653 -11.130   5.609
  384    HB2  GLU  58           1HB      GLU  58   1.833 -12.896   7.170
  385    HB3  GLU  58           2HB      GLU  58   2.143 -13.322   5.493
  386    HG2  GLU  58           1HG      GLU  58   4.436 -12.718   7.297
  387    HG3  GLU  58           2HG      GLU  58   3.630 -14.283   7.402
  388    H    GLN  59           H        GLN  59   2.760 -11.793   3.514
  389    HA   GLN  59           HA       GLN  59   0.275 -10.329   2.932
  390    HB2  GLN  59           1HB      GLN  59   2.147  -9.378   1.766
  391    HB3  GLN  59           2HB      GLN  59   2.659 -10.959   1.190
  392    HG2  GLN  59           1HG      GLN  59   0.269 -10.965   0.094
  393    HG3  GLN  59           2HG      GLN  59   0.448  -9.217   0.244
  394   HE21  GLN  59          1HE2      GLN  59   0.198 -10.074  -2.217
  395   HE22  GLN  59          2HE2      GLN  59   1.703 -10.078  -3.066
  396    H    HIS  60           H        HIS  60  -1.408 -11.658   2.795
  397    HA   HIS  60           HA       HIS  60  -1.292 -14.417   2.354
  398    HB2  HIS  60           1HB      HIS  60  -3.208 -13.114   3.368
  399    HB3  HIS  60           2HB      HIS  60  -3.663 -12.651   1.730
  400    HD1  HIS  60           1HD      HIS  60  -5.253 -14.175   0.600
  401    HD2  HIS  60           2HD      HIS  60  -3.224 -16.067   3.692
  402    HE1  HIS  60           1HE      HIS  60  -6.272 -16.468   0.768
  403    HA   PRO  61           HA       PRO  61  -0.595 -14.645  -2.004
  404    HB2  PRO  61           1HB      PRO  61  -1.251 -17.259  -2.335
  405    HB3  PRO  61           2HB      PRO  61   0.265 -16.735  -1.592
  406    HG2  PRO  61           1HG      PRO  61  -2.264 -17.662  -0.285
  407    HG3  PRO  61           2HG      PRO  61  -0.584 -18.067   0.115
  408    HD2  PRO  61           1HD      PRO  61  -2.009 -16.229   1.502
  409    HD3  PRO  61           2HD      PRO  61  -0.253 -16.102   1.272
  410    H    GLY  62           H        GLY  62  -3.603 -15.879  -0.590
  411    HA2  GLY  62           1HA      GLY  62  -5.103 -16.205  -2.909
  412    HA3  GLY  62           2HA      GLY  62  -5.771 -15.795  -1.336
  413    H    ASP  63           H        ASP  63  -6.346 -13.695  -0.886
  414    HA   ASP  63           HA       ASP  63  -7.254 -12.078  -2.915
  415    HB2  ASP  63           1HB      ASP  63  -7.652 -11.980  -0.335
  416    HB3  ASP  63           2HB      ASP  63  -6.305 -10.845  -0.349
  417    H    GLY  64           H        GLY  64  -4.217 -11.687  -1.088
  418    HA2  GLY  64           1HA      GLY  64  -2.168 -11.095  -2.181
  419    HA3  GLY  64           2HA      GLY  64  -3.109 -10.284  -3.425
  420    H    HIS  65           H        HIS  65  -3.454  -9.995   0.084
  421    HA   HIS  65           HA       HIS  65  -2.607  -7.182  -0.145
  422    HB2  HIS  65           1HB      HIS  65  -4.996  -8.377   1.213
  423    HB3  HIS  65           2HB      HIS  65  -4.283  -6.898   1.850
  424    HD1  HIS  65           1HD      HIS  65  -4.356  -4.788   0.272
  425    HD2  HIS  65           2HD      HIS  65  -6.520  -8.073  -1.067
  426    HE1  HIS  65           1HE      HIS  65  -5.868  -3.907  -1.534
  427    H    PHE  66           H        PHE  66  -2.504  -6.372   2.378
  428    HA   PHE  66           HA       PHE  66  -0.540  -8.185   3.608
  429    HB2  PHE  66           1HB      PHE  66  -0.793  -5.188   3.579
  430    HB3  PHE  66           2HB      PHE  66   0.163  -6.005   4.811
  431    HD1  PHE  66           1HD      PHE  66   1.766  -7.905   3.719
  432    HD2  PHE  66           2HD      PHE  66   0.377  -4.370   1.797
  433    HE1  PHE  66           1HE      PHE  66   3.679  -7.996   2.174
  434    HE2  PHE  66           2HE      PHE  66   2.287  -4.456   0.249
  435    HZ   PHE  66           HZ       PHE  66   3.941  -6.272   0.435
  436    H    TYR  67           H        TYR  67  -1.154  -9.187   5.396
  437    HA   TYR  67           HA       TYR  67  -3.048  -7.839   7.198
  438    HB2  TYR  67           1HB      TYR  67  -3.075 -10.798   6.583
  439    HB3  TYR  67           2HB      TYR  67  -4.210  -9.918   7.601
  440    HD1  TYR  67           2HD      TYR  67  -3.098 -10.451   4.121
  441    HD2  TYR  67           1HD      TYR  67  -6.058  -8.746   6.658
  442    HE1  TYR  67           2HE      TYR  67  -4.546 -10.076   2.169
  443    HE2  TYR  67           1HE      TYR  67  -7.515  -8.368   4.713
  444    HH   TYR  67           HH       TYR  67  -7.850  -9.077   2.498
  445    H    CYS  68           H        CYS  68  -2.984  -8.647   9.425
  446    HA   CYS  68           HA       CYS  68  -0.297  -8.886  10.346
  447    HB2  CYS  68           1HB      CYS  68  -1.262  -8.909  12.578
  448    HB3  CYS  68           2HB      CYS  68  -2.053  -7.675  11.603
  449    H    LEU  69           H        LEU  69   0.274 -10.588  12.029
  450    HA   LEU  69           HA       LEU  69  -0.027 -13.174  10.799
  451    HB2  LEU  69           1HB      LEU  69   1.339 -12.534  13.402
  452    HB3  LEU  69           2HB      LEU  69   1.600 -13.934  12.364
  453    HG   LEU  69           HG       LEU  69   2.376 -11.085  11.744
  454   HD11  LEU  69          1HD1      LEU  69   4.677 -12.040  11.847
  455   HD12  LEU  69          2HD1      LEU  69   3.979 -13.517  12.510
  456   HD13  LEU  69          3HD1      LEU  69   3.837 -11.999  13.397
  457   HD21  LEU  69          1HD2      LEU  69   1.646 -12.588   9.807
  458   HD22  LEU  69          2HD2      LEU  69   3.100 -13.525  10.152
  459   HD23  LEU  69          3HD2      LEU  69   3.232 -11.825   9.697
  460    H    GLN  70           H        GLN  70  -2.271 -11.702  12.299
  461    HA   GLN  70           HA       GLN  70  -3.048 -13.991  13.982
  462    HB2  GLN  70           1HB      GLN  70  -2.569 -12.048  15.385
  463    HB3  GLN  70           2HB      GLN  70  -3.683 -11.071  14.438
  464    HG2  GLN  70           1HG      GLN  70  -4.943 -11.603  16.285
  465    HG3  GLN  70           2HG      GLN  70  -5.440 -12.836  15.127
  466   HE21  GLN  70          1HE2      GLN  70  -5.374 -12.742  18.113
  467   HE22  GLN  70          2HE2      GLN  70  -4.516 -14.167  18.578
  468    H    HIS  71           H        HIS  71  -3.861 -11.807  11.458
  469    HA   HIS  71           HA       HIS  71  -6.584 -12.926  11.332
  470    HB2  HIS  71           1HB      HIS  71  -5.471 -10.259  10.522
  471    HB3  HIS  71           2HB      HIS  71  -6.933 -10.878   9.760
  472    HD2  HIS  71           2HD      HIS  71  -7.569 -12.102  13.086
  473    HE1  HIS  71           1HE      HIS  71  -8.621  -8.004  13.396
  474    HE2  HIS  71           2HE      HIS  71  -8.721 -10.266  14.498
  475    H    LEU  72           H        LEU  72  -3.548 -12.677   9.761
  476    HA   LEU  72           HA       LEU  72  -4.083 -12.939   7.091
  477    HB2  LEU  72           1HB      LEU  72  -1.834 -12.849   8.169
  478    HB3  LEU  72           2HB      LEU  72  -2.019 -14.553   8.578
  479    HG   LEU  72           HG       LEU  72  -2.388 -14.722   5.939
  480   HD11  LEU  72          1HD1      LEU  72  -0.211 -12.940   5.540
  481   HD12  LEU  72          2HD1      LEU  72  -1.531 -12.050   6.297
  482   HD13  LEU  72          3HD1      LEU  72  -1.807 -12.922   4.789
  483   HD21  LEU  72          1HD2      LEU  72   0.423 -14.463   6.920
  484   HD22  LEU  72          2HD2      LEU  72  -0.281 -15.662   5.836
  485   HD23  LEU  72          3HD2      LEU  72  -0.625 -15.726   7.565
  486    HA   PRO  73           HA       PRO  73  -6.589 -16.652   7.111
  487    HB2  PRO  73           1HB      PRO  73  -7.211 -16.538   4.471
  488    HB3  PRO  73           2HB      PRO  73  -8.008 -15.536   5.690
  489    HG2  PRO  73           1HG      PRO  73  -5.784 -14.828   3.815
  490    HG3  PRO  73           2HG      PRO  73  -7.216 -13.882   4.260
  491    HD2  PRO  73           1HD      PRO  73  -4.777 -13.429   5.345
  492    HD3  PRO  73           2HD      PRO  73  -6.285 -13.170   6.245
  493    H    GLN  74           H        GLN  74  -6.669 -18.596   5.547
  494    HA   GLN  74           HA       GLN  74  -4.207 -19.158   4.144
  495    HB2  GLN  74           1HB      GLN  74  -4.806 -20.271   6.829
  496    HB3  GLN  74           2HB      GLN  74  -4.168 -21.392   5.633
  497    HG2  GLN  74           1HG      GLN  74  -2.216 -20.007   5.320
  498    HG3  GLN  74           2HG      GLN  74  -2.866 -18.797   6.425
  499   HE21  GLN  74          1HE2      GLN  74  -2.690 -19.095   8.595
  500   HE22  GLN  74          2HE2      GLN  74  -1.820 -20.401   9.316
  501    H    THR  75           H        THR  75  -5.099 -19.827   2.297
  502    HA   THR  75           HA       THR  75  -7.568 -20.961   1.883
  503    HB   THR  75           HB       THR  75  -6.196 -20.165   0.034
  504    HG1  THR  75           1HG      THR  75  -7.685 -21.552  -0.740
  505   HG21  THR  75          1HG2      THR  75  -4.080 -21.282   1.095
  506   HG22  THR  75          2HG2      THR  75  -4.202 -21.109  -0.656
  507   HG23  THR  75          3HG2      THR  75  -4.553 -22.661   0.103
  508    H    ASP  76           H        ASP  76  -4.515 -22.605   2.590
  509    HA   ASP  76           HA       ASP  76  -4.975 -25.204   2.174
  510    HB2  ASP  76           1HB      ASP  76  -4.032 -24.345   4.902
  511    HB3  ASP  76           2HB      ASP  76  -3.519 -25.738   3.953
  512    H    SER  77           H        SER  77  -6.783 -26.345   2.375
  513    HA   SER  77           HA       SER  77  -8.383 -26.021   4.827
  514    HB2  SER  77           1HB      SER  77  -9.221 -26.836   2.038
  515    HB3  SER  77           2HB      SER  77 -10.276 -26.952   3.446
  516    HG   SER  77           HG       SER  77 -10.214 -24.744   3.660
  517    H    GLY  78           H        GLY  78  -9.404 -27.938   5.693
  518    HA2  GLY  78           1HA      GLY  78  -7.785 -30.014   6.303
  519    HA3  GLY  78           2HA      GLY  78  -9.531 -30.189   6.211
  520    HA   PRO  79           HA       PRO  79  -9.285 -32.835   2.726
  521    HB2  PRO  79           1HB      PRO  79 -11.005 -31.799   0.900
  522    HB3  PRO  79           2HB      PRO  79 -11.543 -32.579   2.391
  523    HG2  PRO  79           1HG      PRO  79 -11.254 -29.664   1.776
  524    HG3  PRO  79           2HG      PRO  79 -12.563 -30.503   2.629
  525    HD2  PRO  79           1HD      PRO  79 -10.611 -29.148   3.928
  526    HD3  PRO  79           2HD      PRO  79 -11.385 -30.594   4.608
  527    H    SER  80           H        SER  80  -8.014 -33.197   0.984
  528    HA   SER  80           HA       SER  80  -6.793 -30.845  -0.292
  529    HB2  SER  80           1HB      SER  80  -5.737 -33.680  -0.176
  530    HB3  SER  80           2HB      SER  80  -4.889 -32.271  -0.811
  531    HG   SER  80           HG       SER  80  -4.882 -31.400   1.278
  532    H    SER  81           H        SER  81  -8.200 -30.448  -1.956
  533    HA   SER  81           HA       SER  81  -9.374 -32.418  -3.594
  534    HB2  SER  81           1HB      SER  81  -9.945 -29.876  -3.288
  535    HB3  SER  81           2HB      SER  81  -8.813 -29.658  -4.623
  536    HG   SER  81           HG       SER  81 -11.253 -31.074  -4.583
  537    H    GLY  82           H        GLY  82  -8.522 -33.643  -5.136
  538    HA2  GLY  82           1HA      GLY  82  -7.277 -33.648  -7.265
  539    HA3  GLY  82           2HA      GLY  82  -6.041 -32.709  -6.442
  Start of MODEL   15
    1    H1   GLY   1           H        GLY   1 -24.376   0.500 -18.983
    2    HA2  GLY   1           1HA      GLY   1 -24.204   2.778 -19.288
    3    HA3  GLY   1           2HA      GLY   1 -24.819   2.991 -17.655
    4    H    SER   2           H        SER   2 -22.432   4.014 -19.384
    5    HA   SER   2           HA       SER   2 -20.698   4.522 -17.214
    6    HB2  SER   2           1HB      SER   2 -18.704   3.275 -18.048
    7    HB3  SER   2           2HB      SER   2 -19.995   2.217 -17.479
    8    HG   SER   2           HG       SER   2 -19.037   1.617 -19.535
    9    H    SER   3           H        SER   3 -18.700   5.679 -17.924
   10    HA   SER   3           HA       SER   3 -19.144   7.021 -20.511
   11    HB2  SER   3           1HB      SER   3 -18.111   9.046 -19.439
   12    HB3  SER   3           2HB      SER   3 -19.664   8.578 -18.748
   13    HG   SER   3           HG       SER   3 -18.287   8.957 -17.056
   14    H    GLY   4           H        GLY   4 -16.645   6.338 -18.060
   15    HA2  GLY   4           1HA      GLY   4 -14.660   5.101 -18.738
   16    HA3  GLY   4           2HA      GLY   4 -14.744   5.935 -20.283
   17    H    SER   5           H        SER   5 -15.022   7.247 -16.999
   18    HA   SER   5           HA       SER   5 -12.765   9.025 -17.627
   19    HB2  SER   5           1HB      SER   5 -15.209   9.351 -15.914
   20    HB3  SER   5           2HB      SER   5 -13.773  10.326 -15.598
   21    HG   SER   5           HG       SER   5 -14.362  11.532 -17.200
   22    H    SER   6           H        SER   6 -10.969   8.032 -16.899
   23    HA   SER   6           HA       SER   6 -10.646   7.734 -14.051
   24    HB2  SER   6           1HB      SER   6 -10.266   5.303 -15.815
   25    HB3  SER   6           2HB      SER   6  -9.985   5.393 -14.077
   26    HG   SER   6           HG       SER   6 -12.277   5.952 -13.925
   27    H    GLY   7           H        GLY   7  -8.480   7.700 -13.402
   28    HA2  GLY   7           1HA      GLY   7  -6.128   7.306 -14.114
   29    HA3  GLY   7           2HA      GLY   7  -6.546   8.164 -15.589
   30    H    GLN   8           H        GLN   8  -4.956   8.479 -12.763
   31    HA   GLN   8           HA       GLN   8  -5.084  11.391 -12.909
   32    HB2  GLN   8           1HB      GLN   8  -5.905   9.741 -10.577
   33    HB3  GLN   8           2HB      GLN   8  -4.971  11.193 -10.245
   34    HG2  GLN   8           1HG      GLN   8  -6.622  12.597 -11.003
   35    HG3  GLN   8           2HG      GLN   8  -7.345  11.364 -12.035
   36   HE21  GLN   8          1HE2      GLN   8  -9.110  10.396 -11.326
   37   HE22  GLN   8          2HE2      GLN   8  -9.683  10.404  -9.696
   38    H    HIS   9           H        HIS   9  -3.121  12.280 -12.799
   39    HA   HIS   9           HA       HIS   9  -0.990  11.044 -11.284
   40    HB2  HIS   9           1HB      HIS   9   0.485  10.583 -13.048
   41    HB3  HIS   9           2HB      HIS   9  -1.062   9.974 -13.630
   42    HD1  HIS   9           1HD      HIS   9   1.712  11.867 -14.751
   43    HD2  HIS   9           2HD      HIS   9  -2.399  12.159 -15.279
   44    HE1  HIS   9           1HE      HIS   9   1.397  13.284 -16.804
   45    H    GLN  10           H        GLN  10   1.030  12.387 -11.383
   46    HA   GLN  10           HA       GLN  10   0.285  15.225 -11.568
   47    HB2  GLN  10           1HB      GLN  10   1.016  14.253  -9.342
   48    HB3  GLN  10           2HB      GLN  10   2.618  14.069 -10.045
   49    HG2  GLN  10           1HG      GLN  10   3.018  16.320 -10.080
   50    HG3  GLN  10           2HG      GLN  10   1.306  16.734 -10.161
   51   HE21  GLN  10          1HE2      GLN  10   3.959  16.756  -8.231
   52   HE22  GLN  10          2HE2      GLN  10   3.194  16.822  -6.684
   53    H    GLU  11           H        GLU  11   1.340  16.568 -12.907
   54    HA   GLU  11           HA       GLU  11   2.763  15.734 -15.084
   55    HB2  GLU  11           1HB      GLU  11   1.859  17.976 -14.935
   56    HB3  GLU  11           2HB      GLU  11   2.974  18.378 -13.637
   57    HG2  GLU  11           1HG      GLU  11   4.832  17.892 -15.312
   58    HG3  GLU  11           2HG      GLU  11   3.569  17.943 -16.541
   59    H    ALA  12           H        ALA  12   4.206  17.144 -12.142
   60    HA   ALA  12           HA       ALA  12   6.658  15.621 -12.736
   61    HB1  ALA  12           1HB      ALA  12   8.025  17.412 -12.388
   62    HB2  ALA  12           2HB      ALA  12   6.618  18.247 -13.049
   63    HB3  ALA  12           3HB      ALA  12   6.886  18.215 -11.307
   64    H    GLY  13           H        GLY  13   5.733  14.015 -11.290
   65    HA2  GLY  13           1HA      GLY  13   5.428  14.753  -8.495
   66    HA3  GLY  13           2HA      GLY  13   5.156  13.163  -9.191
   67    H    ALA  14           H        ALA  14   6.429  13.186  -6.862
   68    HA   ALA  14           HA       ALA  14   9.300  13.008  -7.460
   69    HB1  ALA  14           1HB      ALA  14   9.315  12.737  -4.837
   70    HB2  ALA  14           2HB      ALA  14   9.195  14.325  -5.596
   71    HB3  ALA  14           3HB      ALA  14   7.746  13.531  -4.980
   72    H    GLY  15           H        GLY  15   6.916  11.260  -5.449
   73    HA2  GLY  15           1HA      GLY  15   6.517   8.886  -5.998
   74    HA3  GLY  15           2HA      GLY  15   8.247   8.754  -6.278
   75    H    ASP  16           H        ASP  16   8.970  10.364  -3.967
   76    HA   ASP  16           HA       ASP  16   8.900   8.266  -2.001
   77    HB2  ASP  16           1HB      ASP  16  10.135  11.021  -2.025
   78    HB3  ASP  16           2HB      ASP  16  10.240   9.937  -0.640
   79    H    LEU  17           H        LEU  17   6.326   8.979  -2.413
   80    HA   LEU  17           HA       LEU  17   5.635  10.338   0.102
   81    HB2  LEU  17           1HB      LEU  17   4.004  10.581  -2.411
   82    HB3  LEU  17           2HB      LEU  17   3.824  11.484  -0.908
   83    HG   LEU  17           HG       LEU  17   6.221  11.742  -2.715
   84   HD11  LEU  17          1HD1      LEU  17   4.910  14.044  -3.082
   85   HD12  LEU  17          2HD1      LEU  17   3.534  12.961  -2.875
   86   HD13  LEU  17          3HD1      LEU  17   4.720  12.647  -4.143
   87   HD21  LEU  17          1HD2      LEU  17   5.152  13.405  -0.438
   88   HD22  LEU  17          2HD2      LEU  17   6.500  13.866  -1.478
   89   HD23  LEU  17          3HD2      LEU  17   6.630  12.442  -0.445
   90    H    CYS  18           H        CYS  18   4.186   9.305   1.348
   91    HA   CYS  18           HA       CYS  18   3.611   6.719   1.341
   92    HB2  CYS  18           1HB      CYS  18   2.813   8.383   3.036
   93    HB3  CYS  18           2HB      CYS  18   1.472   8.765   1.960
   94    H    ALA  19           H        ALA  19   2.545   5.243   0.178
   95    HA   ALA  19           HA       ALA  19   1.160   6.111  -2.224
   96    HB1  ALA  19           1HB      ALA  19   1.365   3.233  -1.553
   97    HB2  ALA  19           2HB      ALA  19   1.608   4.062  -3.092
   98    HB3  ALA  19           3HB      ALA  19   2.870   4.102  -1.861
   99    H    LEU  20           H        LEU  20   0.222   5.797   0.853
  100    HA   LEU  20           HA       LEU  20  -2.346   4.510   0.253
  101    HB2  LEU  20           1HB      LEU  20  -0.788   5.004   2.739
  102    HB3  LEU  20           2HB      LEU  20  -2.543   4.898   2.857
  103    HG   LEU  20           HG       LEU  20  -1.019   2.716   1.498
  104   HD11  LEU  20          1HD1      LEU  20  -0.420   1.657   3.458
  105   HD12  LEU  20          2HD1      LEU  20  -1.537   2.607   4.438
  106   HD13  LEU  20          3HD1      LEU  20  -0.056   3.343   3.826
  107   HD21  LEU  20          1HD2      LEU  20  -3.595   3.021   1.635
  108   HD22  LEU  20          2HD2      LEU  20  -3.397   2.441   3.289
  109   HD23  LEU  20          3HD2      LEU  20  -2.889   1.432   1.934
  110    H    CYS  21           H        CYS  21  -1.026   7.428   1.803
  111    HA   CYS  21           HA       CYS  21  -3.637   8.730   1.444
  112    HB2  CYS  21           1HB      CYS  21  -2.785  10.410   3.068
  113    HB3  CYS  21           2HB      CYS  21  -2.852   8.781   3.733
  114    H    GLY  22           H        GLY  22  -0.172   9.130   0.855
  115    HA2  GLY  22           1HA      GLY  22   0.659  10.092  -1.161
  116    HA3  GLY  22           2HA      GLY  22  -0.841  10.995  -1.313
  117    H    GLU  23           H        GLU  23   1.150  10.742   1.587
  118    HA   GLU  23           HA       GLU  23   1.637  13.641   1.393
  119    HB2  GLU  23           1HB      GLU  23   1.265  11.859   3.799
  120    HB3  GLU  23           2HB      GLU  23   1.896  13.496   3.914
  121    HG2  GLU  23           1HG      GLU  23  -0.253  14.164   2.650
  122    HG3  GLU  23           2HG      GLU  23  -0.844  12.582   3.154
  123    H    HIS  24           H        HIS  24   3.588  14.199   2.982
  124    HA   HIS  24           HA       HIS  24   5.909  13.226   1.733
  125    HB2  HIS  24           1HB      HIS  24   5.426  15.416   3.151
  126    HB3  HIS  24           2HB      HIS  24   6.084  14.434   4.457
  127    HD1  HIS  24           1HD      HIS  24   8.566  13.439   3.949
  128    HD2  HIS  24           2HD      HIS  24   7.303  16.630   1.608
  129    HE1  HIS  24           1HE      HIS  24  10.657  14.391   2.925
  130    H    LEU  25           H        LEU  25   7.653  11.994   2.607
  131    HA   LEU  25           HA       LEU  25   6.840  10.121   4.731
  132    HB2  LEU  25           1HB      LEU  25   8.205   9.617   2.113
  133    HB3  LEU  25           2HB      LEU  25   8.425   8.515   3.471
  134    HG   LEU  25           HG       LEU  25   5.675   9.200   2.497
  135   HD11  LEU  25          1HD1      LEU  25   6.892   8.495   0.517
  136   HD12  LEU  25          2HD1      LEU  25   5.764   7.241   1.029
  137   HD13  LEU  25          3HD1      LEU  25   7.486   7.070   1.369
  138   HD21  LEU  25          1HD2      LEU  25   4.998   7.455   3.766
  139   HD22  LEU  25          2HD2      LEU  25   6.482   7.819   4.648
  140   HD23  LEU  25          3HD2      LEU  25   6.460   6.518   3.456
  141    H    TYR  26           H        TYR  26   8.852   8.907   5.594
  142    HA   TYR  26           HA       TYR  26  11.098  10.793   5.859
  143    HB2  TYR  26           1HB      TYR  26   9.395  10.549   7.854
  144    HB3  TYR  26           2HB      TYR  26  10.295   9.070   8.170
  145    HD1  TYR  26           1HD      TYR  26  11.279  12.530   7.137
  146    HD2  TYR  26           2HD      TYR  26  11.760   9.350   9.923
  147    HE1  TYR  26           1HE      TYR  26  12.996  13.835   8.321
  148    HE2  TYR  26           2HE      TYR  26  13.478  10.646  11.115
  149    HH   TYR  26           HH       TYR  26  14.929  12.446  10.864
  150    H    VAL  27           H        VAL  27  13.144   9.849   6.331
  151    HA   VAL  27           HA       VAL  27  13.757   7.556   4.875
  152    HB   VAL  27           HB       VAL  27  15.390   9.324   5.544
  153   HG11  VAL  27          1HG1      VAL  27  14.531   8.744   8.109
  154   HG12  VAL  27          2HG1      VAL  27  16.151   8.048   8.036
  155   HG13  VAL  27          3HG1      VAL  27  15.906   9.756   7.669
  156   HG21  VAL  27          1HG2      VAL  27  15.785   6.486   5.383
  157   HG22  VAL  27          2HG2      VAL  27  16.815   7.791   4.794
  158   HG23  VAL  27          3HG2      VAL  27  16.993   7.205   6.447
  159    H    LEU  28           H        LEU  28  12.400   7.842   7.984
  160    HA   LEU  28           HA       LEU  28  13.105   5.060   8.634
  161    HB2  LEU  28           1HB      LEU  28  12.188   7.331  10.385
  162    HB3  LEU  28           2HB      LEU  28  12.333   5.665  10.942
  163    HG   LEU  28           HG       LEU  28  14.672   7.173   9.807
  164   HD11  LEU  28          1HD1      LEU  28  13.330   7.996  12.049
  165   HD12  LEU  28          2HD1      LEU  28  15.032   8.295  11.702
  166   HD13  LEU  28          3HD1      LEU  28  14.566   6.925  12.710
  167   HD21  LEU  28          1HD2      LEU  28  15.214   5.258  11.876
  168   HD22  LEU  28          2HD2      LEU  28  15.793   5.300  10.211
  169   HD23  LEU  28          3HD2      LEU  28  14.259   4.516  10.592
  170    H    GLU  29           H        GLU  29  10.377   7.322   9.073
  171    HA   GLU  29           HA       GLU  29   8.382   5.531   9.624
  172    HB2  GLU  29           1HB      GLU  29   8.059   7.941   7.831
  173    HB3  GLU  29           2HB      GLU  29   6.804   7.165   8.788
  174    HG2  GLU  29           1HG      GLU  29   8.137   7.765  10.830
  175    HG3  GLU  29           2HG      GLU  29   9.163   8.740   9.779
  176    H    ARG  30           H        ARG  30   9.224   6.711   6.364
  177    HA   ARG  30           HA       ARG  30   7.551   5.425   4.741
  178    HB2  ARG  30           1HB      ARG  30   9.208   5.382   3.056
  179    HB3  ARG  30           2HB      ARG  30   9.638   6.729   4.102
  180    HG2  ARG  30           1HG      ARG  30  11.415   5.530   5.083
  181    HG3  ARG  30           2HG      ARG  30  10.859   4.002   4.397
  182    HD2  ARG  30           1HD      ARG  30  12.827   4.974   3.230
  183    HD3  ARG  30           2HD      ARG  30  11.432   4.717   2.183
  184    HE   ARG  30           HE       ARG  30  11.130   7.282   2.935
  185   HH11  ARG  30          2HH1      ARG  30  13.837   5.512   1.647
  186   HH12  ARG  30          1HH1      ARG  30  14.522   6.887   0.846
  187   HH21  ARG  30          2HH2      ARG  30  12.022   9.100   1.885
  188   HH22  ARG  30          1HH2      ARG  30  13.489   8.927   0.983
  189    H    LEU  31           H        LEU  31   7.022   3.405   4.091
  190    HA   LEU  31           HA       LEU  31   8.382   1.182   5.454
  191    HB2  LEU  31           1HB      LEU  31   5.578   1.716   4.674
  192    HB3  LEU  31           2HB      LEU  31   6.133   0.048   4.546
  193    HG   LEU  31           HG       LEU  31   6.643   1.460   7.106
  194   HD11  LEU  31          1HD1      LEU  31   4.434   2.186   6.889
  195   HD12  LEU  31          2HD1      LEU  31   4.309   0.695   7.822
  196   HD13  LEU  31          3HD1      LEU  31   3.923   0.693   6.102
  197   HD21  LEU  31          1HD2      LEU  31   7.032  -0.617   7.785
  198   HD22  LEU  31          2HD2      LEU  31   6.810  -1.153   6.119
  199   HD23  LEU  31          3HD2      LEU  31   5.443  -1.150   7.235
  200    H    CYS  32           H        CYS  32   9.999   0.663   4.041
  201    HA   CYS  32           HA       CYS  32   9.701   0.555   1.230
  202    HB2  CYS  32           1HB      CYS  32  11.735  -1.003   2.822
  203    HB3  CYS  32           2HB      CYS  32  11.884  -0.387   1.180
  204    HG   CYS  32           HG       CYS  32  12.336   1.207   4.116
  205    H    VAL  33           H        VAL  33   7.875  -0.666   0.741
  206    HA   VAL  33           HA       VAL  33   8.246  -3.569   1.038
  207    HB   VAL  33           HB       VAL  33   5.494  -2.383   1.119
  208   HG11  VAL  33          1HG1      VAL  33   6.729  -4.971   2.042
  209   HG12  VAL  33          2HG1      VAL  33   5.065  -4.497   2.392
  210   HG13  VAL  33          3HG1      VAL  33   5.583  -4.735   0.723
  211   HG21  VAL  33          1HG2      VAL  33   7.493  -2.475   3.323
  212   HG22  VAL  33          2HG2      VAL  33   6.249  -1.273   2.977
  213   HG23  VAL  33          3HG2      VAL  33   5.805  -2.821   3.696
  214    H    ASN  34           H        ASN  34   8.533  -4.349  -0.940
  215    HA   ASN  34           HA       ASN  34   8.271  -4.778  -3.158
  216    HB2  ASN  34           1HB      ASN  34   5.532  -3.657  -2.554
  217    HB3  ASN  34           2HB      ASN  34   5.970  -4.325  -4.123
  218   HD21  ASN  34          1HD2      ASN  34   3.904  -5.373  -2.676
  219   HD22  ASN  34          2HD2      ASN  34   4.329  -6.950  -2.112
  220    H    GLY  35           H        GLY  35   9.398  -2.233  -2.279
  221    HA2  GLY  35           1HA      GLY  35  10.394  -0.540  -3.546
  222    HA3  GLY  35           2HA      GLY  35   9.251  -0.866  -4.840
  223    H    HIS  36           H        HIS  36   6.942  -0.708  -3.016
  224    HA   HIS  36           HA       HIS  36   6.598   2.158  -3.146
  225    HB2  HIS  36           1HB      HIS  36   4.711  -0.036  -2.262
  226    HB3  HIS  36           2HB      HIS  36   4.271   1.660  -2.436
  227    HD1  HIS  36           1HD      HIS  36   4.472   2.623  -4.951
  228    HD2  HIS  36           2HD      HIS  36   4.489  -1.511  -4.542
  229    HE1  HIS  36           1HE      HIS  36   3.946   1.719  -7.238
  230    H    PHE  37           H        PHE  37   6.438   3.564  -1.467
  231    HA   PHE  37           HA       PHE  37   7.126   2.500   1.186
  232    HB2  PHE  37           1HB      PHE  37   7.517   5.254  -0.001
  233    HB3  PHE  37           2HB      PHE  37   7.869   4.843   1.674
  234    HD1  PHE  37           2HD      PHE  37   8.627   1.975  -0.026
  235    HD2  PHE  37           1HD      PHE  37  10.060   5.952   0.468
  236    HE1  PHE  37           2HE      PHE  37  10.882   1.241  -0.683
  237    HE2  PHE  37           1HE      PHE  37  12.317   5.225  -0.189
  238    HZ   PHE  37           HZ       PHE  37  12.731   2.866  -0.764
  239    H    PHE  38           H        PHE  38   5.813   2.800   2.892
  240    HA   PHE  38           HA       PHE  38   3.538   4.635   2.611
  241    HB2  PHE  38           1HB      PHE  38   3.198   1.925   3.871
  242    HB3  PHE  38           2HB      PHE  38   1.956   3.035   3.299
  243    HD1  PHE  38           1HD      PHE  38   4.830   1.036   2.021
  244    HD2  PHE  38           2HD      PHE  38   0.954   2.625   1.271
  245    HE1  PHE  38           1HE      PHE  38   4.760  -0.160  -0.128
  246    HE2  PHE  38           2HE      PHE  38   0.877   1.432  -0.879
  247    HZ   PHE  38           HZ       PHE  38   2.781   0.037  -1.581
  248    H    HIS  39           H        HIS  39   2.505   5.161   4.686
  249    HA   HIS  39           HA       HIS  39   4.487   5.718   6.679
  250    HB2  HIS  39           1HB      HIS  39   1.551   6.301   6.408
  251    HB3  HIS  39           2HB      HIS  39   2.392   6.613   7.923
  252    HD2  HIS  39           2HD      HIS  39   5.105   7.994   6.744
  253    HE1  HIS  39           1HE      HIS  39   2.429  10.670   4.827
  254    HE2  HIS  39           2HE      HIS  39   4.819  10.240   5.494
  255    H    ARG  40           H        ARG  40   4.689   4.885   8.727
  256    HA   ARG  40           HA       ARG  40   4.063   2.195   9.136
  257    HB2  ARG  40           1HB      ARG  40   4.798   4.343  11.130
  258    HB3  ARG  40           2HB      ARG  40   4.722   2.628  11.512
  259    HG2  ARG  40           1HG      ARG  40   6.425   2.275   9.680
  260    HG3  ARG  40           2HG      ARG  40   6.619   4.029   9.654
  261    HD2  ARG  40           1HD      ARG  40   6.865   2.461  12.200
  262    HD3  ARG  40           2HD      ARG  40   8.231   2.648  11.101
  263    HE   ARG  40           HE       ARG  40   7.001   5.143  11.770
  264   HH11  ARG  40          2HH1      ARG  40   9.269   2.729  12.842
  265   HH12  ARG  40          1HH1      ARG  40  10.171   3.828  13.832
  266   HH21  ARG  40          2HH2      ARG  40   8.179   6.600  13.071
  267   HH22  ARG  40          1HH2      ARG  40   9.549   6.030  13.962
  268    H    SER  41           H        SER  41   2.202   5.041   9.683
  269    HA   SER  41           HA       SER  41   0.359   3.748  11.513
  270    HB2  SER  41           1HB      SER  41   1.020   6.230  11.571
  271    HB3  SER  41           2HB      SER  41  -0.053   6.424  10.185
  272    HG   SER  41           HG       SER  41  -0.786   6.549  12.625
  273    H    CYS  42           H        CYS  42   0.328   4.994   8.189
  274    HA   CYS  42           HA       CYS  42  -2.342   4.307   7.611
  275    HB2  CYS  42           1HB      CYS  42   0.044   4.662   5.787
  276    HB3  CYS  42           2HB      CYS  42  -1.613   4.479   5.220
  277    H    PHE  43           H        PHE  43   0.707   2.582   7.032
  278    HA   PHE  43           HA       PHE  43  -0.481   0.340   5.774
  279    HB2  PHE  43           1HB      PHE  43   1.998   1.106   5.788
  280    HB3  PHE  43           2HB      PHE  43   2.108   0.202   7.295
  281    HD1  PHE  43           1HD      PHE  43   0.879  -2.228   7.048
  282    HD2  PHE  43           2HD      PHE  43   2.754  -0.003   3.942
  283    HE1  PHE  43           1HE      PHE  43   1.230  -4.305   5.777
  284    HE2  PHE  43           2HE      PHE  43   3.108  -2.076   2.666
  285    HZ   PHE  43           HZ       PHE  43   2.345  -4.231   3.582
  286    H    ARG  44           H        ARG  44  -2.193  -0.417   6.998
  287    HA   ARG  44           HA       ARG  44  -1.430  -1.777   9.495
  288    HB2  ARG  44           1HB      ARG  44  -4.063  -0.394   8.947
  289    HB3  ARG  44           2HB      ARG  44  -3.651  -1.283  10.407
  290    HG2  ARG  44           1HG      ARG  44  -2.055   0.338  11.056
  291    HG3  ARG  44           2HG      ARG  44  -2.116   1.127   9.479
  292    HD2  ARG  44           1HD      ARG  44  -4.325   1.925   9.878
  293    HD3  ARG  44           2HD      ARG  44  -4.484   0.935  11.328
  294    HE   ARG  44           HE       ARG  44  -2.408   2.487  11.969
  295   HH11  ARG  44          2HH1      ARG  44  -5.503   3.254  10.571
  296   HH12  ARG  44          1HH1      ARG  44  -5.571   4.839  11.269
  297   HH21  ARG  44          2HH2      ARG  44  -2.486   4.571  12.893
  298   HH22  ARG  44          1HH2      ARG  44  -3.855   5.587  12.588
  299    H    CYS  45           H        CYS  45  -3.363  -3.358  10.090
  300    HA   CYS  45           HA       CYS  45  -3.340  -5.401   8.178
  301    HB2  CYS  45           1HB      CYS  45  -3.730  -5.671  10.649
  302    HB3  CYS  45           2HB      CYS  45  -5.365  -5.070  10.397
  303    H    HIS  46           H        HIS  46  -5.293  -6.424   7.203
  304    HA   HIS  46           HA       HIS  46  -6.968  -4.346   5.981
  305    HB2  HIS  46           1HB      HIS  46  -5.714  -5.646   4.376
  306    HB3  HIS  46           2HB      HIS  46  -6.297  -7.152   5.077
  307    HD1  HIS  46           1HD      HIS  46  -7.184  -4.503   2.664
  308    HD2  HIS  46           2HD      HIS  46  -9.036  -7.737   4.501
  309    HE1  HIS  46           1HE      HIS  46  -9.292  -4.905   1.353
  310    H    THR  47           H        THR  47  -7.135  -6.440   8.470
  311    HA   THR  47           HA       THR  47 -10.027  -6.884   8.100
  312    HB   THR  47           HB       THR  47  -7.968  -8.643   9.417
  313    HG1  THR  47           1HG      THR  47  -9.986  -9.056   7.445
  314   HG21  THR  47          1HG2      THR  47  -9.867  -8.356  10.975
  315   HG22  THR  47          2HG2      THR  47  -9.762  -9.997  10.336
  316   HG23  THR  47          3HG2      THR  47 -10.966  -8.877   9.699
  317    H    CYS  48           H        CYS  48  -7.444  -6.092  10.365
  318    HA   CYS  48           HA       CYS  48  -9.481  -5.048  12.222
  319    HB2  CYS  48           1HB      CYS  48  -7.797  -5.388  14.022
  320    HB3  CYS  48           2HB      CYS  48  -8.295  -6.890  13.248
  321    H    GLU  49           H        GLU  49  -7.151  -4.185  10.035
  322    HA   GLU  49           HA       GLU  49  -5.958  -2.292   9.601
  323    HB2  GLU  49           1HB      GLU  49  -8.119  -1.022  11.291
  324    HB3  GLU  49           2HB      GLU  49  -7.069  -0.183  10.158
  325    HG2  GLU  49           1HG      GLU  49  -8.036  -1.442   8.311
  326    HG3  GLU  49           2HG      GLU  49  -9.077  -2.307   9.440
  327    H    ALA  50           H        ALA  50  -4.782  -3.713  11.582
  328    HA   ALA  50           HA       ALA  50  -4.150  -1.846  13.744
  329    HB1  ALA  50           1HB      ALA  50  -3.698  -4.778  13.340
  330    HB2  ALA  50           2HB      ALA  50  -2.785  -3.882  14.555
  331    HB3  ALA  50           3HB      ALA  50  -4.545  -3.948  14.646
  332    H    THR  51           H        THR  51  -2.064  -1.124  14.168
  333    HA   THR  51           HA       THR  51  -0.467  -0.436  12.006
  334    HB   THR  51           HB       THR  51   0.429  -0.710  14.882
  335    HG1  THR  51           1HG      THR  51  -0.043   1.801  14.244
  336   HG21  THR  51          1HG2      THR  51   2.399  -0.378  13.715
  337   HG22  THR  51          2HG2      THR  51   1.902   1.281  14.046
  338   HG23  THR  51          3HG2      THR  51   1.614   0.575  12.457
  339    H    LEU  52           H        LEU  52   0.244  -2.021  10.668
  340    HA   LEU  52           HA       LEU  52   1.315  -4.498  11.604
  341    HB2  LEU  52           1HB      LEU  52   1.497  -3.210   8.884
  342    HB3  LEU  52           2HB      LEU  52   1.901  -4.884   9.257
  343    HG   LEU  52           HG       LEU  52  -0.852  -3.672   9.498
  344   HD11  LEU  52          1HD1      LEU  52  -0.413  -3.757   7.200
  345   HD12  LEU  52          2HD1      LEU  52  -1.280  -5.254   7.543
  346   HD13  LEU  52          3HD1      LEU  52   0.471  -5.278   7.335
  347   HD21  LEU  52          1HD2      LEU  52  -0.224  -5.609  11.014
  348   HD22  LEU  52          2HD2      LEU  52  -0.089  -6.579   9.547
  349   HD23  LEU  52          3HD2      LEU  52  -1.632  -5.841   9.977
  350    H    TRP  53           H        TRP  53   3.097  -4.293  12.860
  351    HA   TRP  53           HA       TRP  53   5.208  -2.458  12.316
  352    HB2  TRP  53           1HB      TRP  53   5.664  -4.879  14.003
  353    HB3  TRP  53           2HB      TRP  53   6.175  -3.215  14.268
  354    HD1  TRP  53           HD       TRP  53   3.085  -5.477  14.646
  355    HE1  TRP  53           1HE      TRP  53   1.504  -4.405  16.371
  356    HE3  TRP  53           3HE      TRP  53   5.548  -1.055  15.366
  357    HZ2  TRP  53           2HZ      TRP  53   1.325  -2.002  17.842
  358    HZ3  TRP  53           3HZ      TRP  53   4.605   0.576  16.949
  359    HH2  TRP  53           HH       TRP  53   2.537   0.110  18.160
  360    HA   PRO  54           HA       PRO  54   7.717  -4.678   9.481
  361    HB2  PRO  54           1HB      PRO  54  10.211  -3.999  10.310
  362    HB3  PRO  54           2HB      PRO  54   9.131  -2.867   9.487
  363    HG2  PRO  54           1HG      PRO  54   9.700  -3.155  12.412
  364    HG3  PRO  54           2HG      PRO  54   9.550  -1.678  11.441
  365    HD2  PRO  54           1HD      PRO  54   7.545  -2.600  13.010
  366    HD3  PRO  54           2HD      PRO  54   7.247  -1.728  11.493
  367    H    GLY  55           H        GLY  55   7.113  -5.853  12.355
  368    HA2  GLY  55           1HA      GLY  55   8.851  -8.168  11.961
  369    HA3  GLY  55           2HA      GLY  55   8.960  -7.348  13.512
  370    H    GLY  56           H        GLY  56   5.997  -7.730  11.653
  371    HA2  GLY  56           1HA      GLY  56   5.057 -10.050  12.974
  372    HA3  GLY  56           2HA      GLY  56   4.473  -8.619  13.811
  373    H    TYR  57           H        TYR  57   4.924  -9.369  10.359
  374    HA   TYR  57           HA       TYR  57   2.082  -9.408   9.893
  375    HB2  TYR  57           1HB      TYR  57   1.818  -7.431   8.716
  376    HB3  TYR  57           2HB      TYR  57   2.925  -6.929   9.989
  377    HD1  TYR  57           2HD      TYR  57   5.406  -6.824   9.448
  378    HD2  TYR  57           1HD      TYR  57   2.408  -7.210   6.453
  379    HE1  TYR  57           2HE      TYR  57   7.006  -6.038   7.753
  380    HE2  TYR  57           1HE      TYR  57   4.000  -6.426   4.750
  381    HH   TYR  57           HH       TYR  57   7.254  -5.354   5.632
  382    H    GLU  58           H        GLU  58   1.554  -9.877   7.637
  383    HA   GLU  58           HA       GLU  58   3.740 -10.700   5.914
  384    HB2  GLU  58           1HB      GLU  58   1.977 -12.601   7.367
  385    HB3  GLU  58           2HB      GLU  58   2.336 -12.967   5.685
  386    HG2  GLU  58           1HG      GLU  58   4.550 -12.309   7.574
  387    HG3  GLU  58           2HG      GLU  58   3.838 -13.921   7.568
  388    H    GLN  59           H        GLN  59   3.070 -11.169   3.749
  389    HA   GLN  59           HA       GLN  59   0.447 -10.000   3.106
  390    HB2  GLN  59           1HB      GLN  59   2.258  -8.685   2.207
  391    HB3  GLN  59           2HB      GLN  59   2.999 -10.112   1.495
  392    HG2  GLN  59           1HG      GLN  59   0.702 -10.281   0.237
  393    HG3  GLN  59           2HG      GLN  59   0.629  -8.558   0.603
  394   HE21  GLN  59          1HE2      GLN  59   0.619  -8.927  -1.918
  395   HE22  GLN  59          2HE2      GLN  59   2.161  -8.705  -2.665
  396    H    HIS  60           H        HIS  60  -1.008 -11.528   2.699
  397    HA   HIS  60           HA       HIS  60  -0.356 -14.165   1.881
  398    HB2  HIS  60           1HB      HIS  60  -2.455 -13.287   3.140
  399    HB3  HIS  60           2HB      HIS  60  -3.086 -12.960   1.529
  400    HD1  HIS  60           1HD      HIS  60  -3.890 -14.942   0.158
  401    HD2  HIS  60           2HD      HIS  60  -2.105 -16.045   3.743
  402    HE1  HIS  60           1HE      HIS  60  -4.385 -17.393   0.429
  403    HA   PRO  61           HA       PRO  61   0.140 -13.306  -2.454
  404    HB2  PRO  61           1HB      PRO  61   0.490 -15.887  -3.220
  405    HB3  PRO  61           2HB      PRO  61   1.756 -14.939  -2.431
  406    HG2  PRO  61           1HG      PRO  61  -0.115 -16.957  -1.251
  407    HG3  PRO  61           2HG      PRO  61   1.621 -16.739  -0.964
  408    HD2  PRO  61           1HD      PRO  61  -0.265 -15.826   0.752
  409    HD3  PRO  61           2HD      PRO  61   1.287 -14.998   0.511
  410    H    GLY  62           H        GLY  62  -2.016 -15.859  -1.251
  411    HA2  GLY  62           1HA      GLY  62  -3.487 -16.558  -3.402
  412    HA3  GLY  62           2HA      GLY  62  -4.219 -16.278  -1.828
  413    H    ASP  63           H        ASP  63  -4.135 -13.625  -1.484
  414    HA   ASP  63           HA       ASP  63  -5.880 -12.666  -3.634
  415    HB2  ASP  63           1HB      ASP  63  -5.470 -11.622  -0.823
  416    HB3  ASP  63           2HB      ASP  63  -6.606 -10.960  -1.995
  417    H    GLY  64           H        GLY  64  -3.231 -11.470  -1.565
  418    HA2  GLY  64           1HA      GLY  64  -1.315 -10.425  -2.674
  419    HA3  GLY  64           2HA      GLY  64  -2.455  -9.698  -3.797
  420    H    HIS  65           H        HIS  65  -2.877  -9.907  -0.308
  421    HA   HIS  65           HA       HIS  65  -2.524  -6.986  -0.151
  422    HB2  HIS  65           1HB      HIS  65  -4.635  -8.655   1.231
  423    HB3  HIS  65           2HB      HIS  65  -4.363  -6.938   1.510
  424    HD1  HIS  65           1HD      HIS  65  -5.556  -5.349  -0.004
  425    HD2  HIS  65           2HD      HIS  65  -5.558  -9.237  -1.471
  426    HE1  HIS  65           1HE      HIS  65  -7.068  -5.309  -2.013
  427    H    PHE  66           H        PHE  66  -2.556  -6.402   2.370
  428    HA   PHE  66           HA       PHE  66  -0.537  -8.154   3.607
  429    HB2  PHE  66           1HB      PHE  66  -0.913  -5.166   3.704
  430    HB3  PHE  66           2HB      PHE  66   0.077  -6.016   4.886
  431    HD1  PHE  66           1HD      PHE  66   2.169  -7.067   4.235
  432    HD2  PHE  66           2HD      PHE  66  -0.192  -4.908   1.427
  433    HE1  PHE  66           1HE      PHE  66   4.084  -6.986   2.692
  434    HE2  PHE  66           2HE      PHE  66   1.719  -4.825  -0.120
  435    HZ   PHE  66           HZ       PHE  66   3.860  -5.865   0.511
  436    H    TYR  67           H        TYR  67  -1.109  -9.169   5.405
  437    HA   TYR  67           HA       TYR  67  -3.209  -7.987   7.094
  438    HB2  TYR  67           1HB      TYR  67  -2.926 -10.946   6.558
  439    HB3  TYR  67           2HB      TYR  67  -4.213 -10.141   7.448
  440    HD1  TYR  67           2HD      TYR  67  -2.812 -10.772   4.104
  441    HD2  TYR  67           1HD      TYR  67  -6.039  -9.082   6.303
  442    HE1  TYR  67           2HE      TYR  67  -4.123 -10.594   2.031
  443    HE2  TYR  67           1HE      TYR  67  -7.359  -8.900   4.236
  444    HH   TYR  67           HH       TYR  67  -7.147 -10.390   1.781
  445    H    CYS  68           H        CYS  68  -3.206  -8.846   9.328
  446    HA   CYS  68           HA       CYS  68  -0.549  -8.801  10.390
  447    HB2  CYS  68           1HB      CYS  68  -1.621  -8.881  12.569
  448    HB3  CYS  68           2HB      CYS  68  -2.467  -7.733  11.536
  449    H    LEU  69           H        LEU  69  -0.008 -10.437  12.198
  450    HA   LEU  69           HA       LEU  69   0.050 -13.042  10.969
  451    HB2  LEU  69           1HB      LEU  69   1.096 -12.274  13.683
  452    HB3  LEU  69           2HB      LEU  69   1.579 -13.649  12.692
  453    HG   LEU  69           HG       LEU  69   2.178 -10.740  12.164
  454   HD11  LEU  69          1HD1      LEU  69   3.711 -13.040  13.262
  455   HD12  LEU  69          2HD1      LEU  69   3.732 -11.339  13.728
  456   HD13  LEU  69          3HD1      LEU  69   4.556 -11.860  12.259
  457   HD21  LEU  69          1HD2      LEU  69   3.272 -11.381  10.176
  458   HD22  LEU  69          2HD2      LEU  69   1.688 -12.155  10.121
  459   HD23  LEU  69          3HD2      LEU  69   3.116 -13.098  10.551
  460    H    GLN  70           H        GLN  70  -2.429 -11.735  12.293
  461    HA   GLN  70           HA       GLN  70  -3.187 -14.121  13.843
  462    HB2  GLN  70           1HB      GLN  70  -2.911 -12.218  15.352
  463    HB3  GLN  70           2HB      GLN  70  -4.011 -11.261  14.370
  464    HG2  GLN  70           1HG      GLN  70  -5.828 -12.811  14.901
  465    HG3  GLN  70           2HG      GLN  70  -4.723 -13.752  15.901
  466   HE21  GLN  70          1HE2      GLN  70  -7.136 -11.639  16.086
  467   HE22  GLN  70          2HE2      GLN  70  -6.731 -10.810  17.546
  468    H    HIS  71           H        HIS  71  -3.790 -12.159  11.187
  469    HA   HIS  71           HA       HIS  71  -6.480 -13.321  10.874
  470    HB2  HIS  71           1HB      HIS  71  -5.489 -10.555  10.269
  471    HB3  HIS  71           2HB      HIS  71  -6.823 -11.233   9.340
  472    HD2  HIS  71           2HD      HIS  71  -7.631 -12.634  12.581
  473    HE1  HIS  71           1HE      HIS  71  -9.100  -8.664  12.866
  474    HE2  HIS  71           2HE      HIS  71  -9.074 -10.953  13.917
  475    H    LEU  72           H        LEU  72  -3.350 -12.844   9.579
  476    HA   LEU  72           HA       LEU  72  -3.681 -13.044   6.856
  477    HB2  LEU  72           1HB      LEU  72  -1.527 -12.764   8.057
  478    HB3  LEU  72           2HB      LEU  72  -1.579 -14.476   8.475
  479    HG   LEU  72           HG       LEU  72  -1.758 -14.688   5.815
  480   HD11  LEU  72          1HD1      LEU  72  -1.147 -12.900   4.653
  481   HD12  LEU  72          2HD1      LEU  72   0.283 -12.663   5.657
  482   HD13  LEU  72          3HD1      LEU  72  -1.261 -11.963   6.143
  483   HD21  LEU  72          1HD2      LEU  72   0.594 -15.193   5.807
  484   HD22  LEU  72          2HD2      LEU  72  -0.102 -15.732   7.335
  485   HD23  LEU  72          3HD2      LEU  72   0.844 -14.244   7.272
  486    HA   PRO  73           HA       PRO  73  -5.809 -16.968   6.581
  487    HB2  PRO  73           1HB      PRO  73  -6.160 -16.873   3.890
  488    HB3  PRO  73           2HB      PRO  73  -7.164 -15.960   5.022
  489    HG2  PRO  73           1HG      PRO  73  -4.826 -15.039   3.394
  490    HG3  PRO  73           2HG      PRO  73  -6.374 -14.225   3.689
  491    HD2  PRO  73           1HD      PRO  73  -4.109 -13.578   5.025
  492    HD3  PRO  73           2HD      PRO  73  -5.720 -13.461   5.763
  493    H    GLN  74           H        GLN  74  -5.582 -18.782   4.741
  494    HA   GLN  74           HA       GLN  74  -2.869 -19.134   3.814
  495    HB2  GLN  74           1HB      GLN  74  -4.006 -20.738   6.085
  496    HB3  GLN  74           2HB      GLN  74  -2.788 -21.423   5.018
  497    HG2  GLN  74           1HG      GLN  74  -1.471 -20.604   6.688
  498    HG3  GLN  74           2HG      GLN  74  -1.489 -19.227   5.588
  499   HE21  GLN  74          1HE2      GLN  74  -0.943 -17.933   7.420
  500   HE22  GLN  74          2HE2      GLN  74  -2.168 -17.434   8.531
  501    H    THR  75           H        THR  75  -3.056 -19.959   1.850
  502    HA   THR  75           HA       THR  75  -5.461 -21.069   0.856
  503    HB   THR  75           HB       THR  75  -3.929 -19.922  -0.640
  504    HG1  THR  75           1HG      THR  75  -4.150 -22.700  -1.251
  505   HG21  THR  75          1HG2      THR  75  -1.767 -20.303   0.082
  506   HG22  THR  75          2HG2      THR  75  -1.849 -21.350  -1.335
  507   HG23  THR  75          3HG2      THR  75  -2.027 -22.035   0.280
  508    H    ASP  76           H        ASP  76  -5.962 -23.179   0.240
  509    HA   ASP  76           HA       ASP  76  -4.403 -25.250   1.633
  510    HB2  ASP  76           1HB      ASP  76  -6.635 -26.568   1.221
  511    HB3  ASP  76           2HB      ASP  76  -6.528 -25.402   2.537
  512    H    SER  77           H        SER  77  -3.774 -27.107   0.582
  513    HA   SER  77           HA       SER  77  -3.274 -26.903  -2.194
  514    HB2  SER  77           1HB      SER  77  -2.969 -29.150  -0.207
  515    HB3  SER  77           2HB      SER  77  -2.571 -29.357  -1.912
  516    HG   SER  77           HG       SER  77  -1.184 -28.081   0.053
  517    H    GLY  78           H        GLY  78  -5.300 -29.242  -0.408
  518    HA2  GLY  78           1HA      GLY  78  -7.611 -29.558  -1.192
  519    HA3  GLY  78           2HA      GLY  78  -6.983 -29.440  -2.829
  520    HA   PRO  79           HA       PRO  79  -7.260 -33.923  -1.363
  521    HB2  PRO  79           1HB      PRO  79  -9.185 -34.721  -3.103
  522    HB3  PRO  79           2HB      PRO  79  -9.548 -34.074  -1.499
  523    HG2  PRO  79           1HG      PRO  79  -9.612 -32.697  -4.157
  524    HG3  PRO  79           2HG      PRO  79 -10.771 -32.599  -2.818
  525    HD2  PRO  79           1HD      PRO  79  -8.905 -30.690  -3.271
  526    HD3  PRO  79           2HD      PRO  79  -9.477 -31.099  -1.641
  527    H    SER  80           H        SER  80  -6.504 -35.737  -2.535
  528    HA   SER  80           HA       SER  80  -4.771 -35.089  -4.706
  529    HB2  SER  80           1HB      SER  80  -4.054 -37.380  -4.602
  530    HB3  SER  80           2HB      SER  80  -4.305 -36.831  -2.945
  531    HG   SER  80           HG       SER  80  -6.285 -37.907  -2.933
  532    H    SER  81           H        SER  81  -5.216 -35.062  -6.801
  533    HA   SER  81           HA       SER  81  -7.446 -36.703  -7.799
  534    HB2  SER  81           1HB      SER  81  -6.840 -33.816  -8.457
  535    HB3  SER  81           2HB      SER  81  -7.928 -34.819  -9.417
  536    HG   SER  81           HG       SER  81  -9.381 -34.229  -8.025
  537    H    GLY  82           H        GLY  82  -5.960 -38.261  -8.530
  538    HA2  GLY  82           1HA      GLY  82  -4.619 -39.262 -10.101
  539    HA3  GLY  82           2HA      GLY  82  -5.074 -37.948 -11.175
  Start of MODEL   16
    1    H1   GLY   1           H        GLY   1 -29.301  13.313 -19.759
    2    HA2  GLY   1           1HA      GLY   1 -28.442  15.191 -17.721
    3    HA3  GLY   1           2HA      GLY   1 -27.587  13.745 -18.238
    4    H    SER   2           H        SER   2 -26.064  15.875 -17.818
    5    HA   SER   2           HA       SER   2 -25.052  16.462 -20.461
    6    HB2  SER   2           1HB      SER   2 -26.822  18.266 -19.697
    7    HB3  SER   2           2HB      SER   2 -25.474  18.869 -18.734
    8    HG   SER   2           HG       SER   2 -25.100  19.876 -20.575
    9    H    SER   3           H        SER   3 -22.926  16.234 -20.372
   10    HA   SER   3           HA       SER   3 -21.506  17.031 -17.925
   11    HB2  SER   3           1HB      SER   3 -21.246  14.421 -19.421
   12    HB3  SER   3           2HB      SER   3 -20.005  15.008 -18.313
   13    HG   SER   3           HG       SER   3 -21.784  13.550 -17.499
   14    H    GLY   4           H        GLY   4 -19.260  17.544 -18.229
   15    HA2  GLY   4           1HA      GLY   4 -18.141  17.665 -20.870
   16    HA3  GLY   4           2HA      GLY   4 -18.680  19.236 -20.297
   17    H    SER   5           H        SER   5 -15.980  17.770 -20.790
   18    HA   SER   5           HA       SER   5 -14.753  18.585 -18.236
   19    HB2  SER   5           1HB      SER   5 -14.164  16.274 -20.054
   20    HB3  SER   5           2HB      SER   5 -12.872  16.960 -19.069
   21    HG   SER   5           HG       SER   5 -14.299  16.630 -17.242
   22    H    SER   6           H        SER   6 -13.440  20.273 -18.357
   23    HA   SER   6           HA       SER   6 -12.631  21.275 -20.963
   24    HB2  SER   6           1HB      SER   6 -11.813  23.246 -19.630
   25    HB3  SER   6           2HB      SER   6 -13.537  22.916 -19.455
   26    HG   SER   6           HG       SER   6 -13.133  21.985 -17.465
   27    H    GLY   7           H        GLY   7 -10.558  21.429 -21.700
   28    HA2  GLY   7           1HA      GLY   7  -8.655  19.574 -20.819
   29    HA3  GLY   7           2HA      GLY   7  -8.332  20.915 -21.907
   30    H    GLN   8           H        GLN   8  -8.306  19.835 -18.588
   31    HA   GLN   8           HA       GLN   8  -6.912  22.298 -17.796
   32    HB2  GLN   8           1HB      GLN   8  -8.400  20.210 -16.217
   33    HB3  GLN   8           2HB      GLN   8  -7.320  21.363 -15.443
   34    HG2  GLN   8           1HG      GLN   8  -8.655  23.208 -16.221
   35    HG3  GLN   8           2HG      GLN   8  -9.686  22.115 -17.143
   36   HE21  GLN   8          1HE2      GLN   8 -11.592  22.415 -16.153
   37   HE22  GLN   8          2HE2      GLN   8 -11.892  22.098 -14.481
   38    H    HIS   9           H        HIS   9  -4.885  22.244 -16.898
   39    HA   HIS   9           HA       HIS   9  -3.282  19.938 -17.528
   40    HB2  HIS   9           1HB      HIS   9  -2.720  22.689 -16.478
   41    HB3  HIS   9           2HB      HIS   9  -1.477  21.445 -16.383
   42    HD1  HIS   9           1HD      HIS   9  -1.837  20.096 -19.105
   43    HD2  HIS   9           2HD      HIS   9  -1.835  24.213 -18.546
   44    HE1  HIS   9           1HE      HIS   9  -1.204  21.077 -21.333
   45    H    GLN  10           H        GLN  10  -1.503  19.428 -15.759
   46    HA   GLN  10           HA       GLN  10  -2.833  19.080 -13.160
   47    HB2  GLN  10           1HB      GLN  10  -2.717  17.019 -14.813
   48    HB3  GLN  10           2HB      GLN  10  -1.071  16.908 -14.204
   49    HG2  GLN  10           1HG      GLN  10  -1.858  16.650 -11.955
   50    HG3  GLN  10           2HG      GLN  10  -3.520  16.949 -12.459
   51   HE21  GLN  10          1HE2      GLN  10  -2.927  14.711 -11.046
   52   HE22  GLN  10          2HE2      GLN  10  -3.060  13.316 -12.055
   53    H    GLU  11           H        GLU  11  -1.272  18.463 -11.417
   54    HA   GLU  11           HA       GLU  11   1.132  20.096 -11.694
   55    HB2  GLU  11           1HB      GLU  11   1.253  20.020  -9.266
   56    HB3  GLU  11           2HB      GLU  11  -0.356  20.508  -9.778
   57    HG2  GLU  11           1HG      GLU  11  -0.876  17.956  -9.544
   58    HG3  GLU  11           2HG      GLU  11   0.539  17.979  -8.492
   59    H    ALA  12           H        ALA  12   3.116  19.286 -10.518
   60    HA   ALA  12           HA       ALA  12   3.485  16.413 -11.068
   61    HB1  ALA  12           1HB      ALA  12   5.555  18.597 -11.273
   62    HB2  ALA  12           2HB      ALA  12   5.793  16.888 -11.642
   63    HB3  ALA  12           3HB      ALA  12   4.707  17.861 -12.634
   64    H    GLY  13           H        GLY  13   4.948  15.254  -9.700
   65    HA2  GLY  13           1HA      GLY  13   6.016  16.473  -7.331
   66    HA3  GLY  13           2HA      GLY  13   4.575  15.522  -7.004
   67    H    ALA  14           H        ALA  14   7.456  15.177  -6.250
   68    HA   ALA  14           HA       ALA  14   8.559  12.999  -7.652
   69    HB1  ALA  14           1HB      ALA  14   9.420  12.809  -4.989
   70    HB2  ALA  14           2HB      ALA  14  10.252  13.579  -6.341
   71    HB3  ALA  14           3HB      ALA  14   9.184  14.527  -5.307
   72    H    GLY  15           H        GLY  15   8.887  10.797  -6.734
   73    HA2  GLY  15           1HA      GLY  15   6.307   9.756  -5.835
   74    HA3  GLY  15           2HA      GLY  15   7.629   8.814  -6.509
   75    H    ASP  16           H        ASP  16   7.573  11.114  -3.802
   76    HA   ASP  16           HA       ASP  16   8.496   8.923  -2.059
   77    HB2  ASP  16           1HB      ASP  16   9.240  11.854  -1.940
   78    HB3  ASP  16           2HB      ASP  16   9.746  10.632  -0.776
   79    H    LEU  17           H        LEU  17   5.802   9.334  -2.361
   80    HA   LEU  17           HA       LEU  17   5.077  10.472   0.253
   81    HB2  LEU  17           1HB      LEU  17   3.328  10.622  -2.190
   82    HB3  LEU  17           2HB      LEU  17   3.067  11.395  -0.627
   83    HG   LEU  17           HG       LEU  17   5.332  12.103  -2.485
   84   HD11  LEU  17          1HD1      LEU  17   3.411  14.169  -2.326
   85   HD12  LEU  17          2HD1      LEU  17   2.559  12.684  -2.750
   86   HD13  LEU  17          3HD1      LEU  17   3.908  13.240  -3.741
   87   HD21  LEU  17          1HD2      LEU  17   5.383  12.574   0.059
   88   HD22  LEU  17          2HD2      LEU  17   4.178  13.808  -0.312
   89   HD23  LEU  17          3HD2      LEU  17   5.774  13.878  -1.062
   90    H    CYS  18           H        CYS  18   3.870   9.191   1.517
   91    HA   CYS  18           HA       CYS  18   3.607   6.536   1.303
   92    HB2  CYS  18           1HB      CYS  18   2.883   7.378   3.341
   93    HB3  CYS  18           2HB      CYS  18   1.824   8.567   2.590
   94    H    ALA  19           H        ALA  19   1.978   5.040   0.667
   95    HA   ALA  19           HA       ALA  19   0.766   5.717  -1.859
   96    HB1  ALA  19           1HB      ALA  19   1.884   3.521  -1.351
   97    HB2  ALA  19           2HB      ALA  19   0.484   3.127  -0.351
   98    HB3  ALA  19           3HB      ALA  19   0.282   3.405  -2.081
   99    H    LEU  20           H        LEU  20  -0.388   4.753   1.358
  100    HA   LEU  20           HA       LEU  20  -3.106   4.626   0.845
  101    HB2  LEU  20           1HB      LEU  20  -1.426   5.112   3.218
  102    HB3  LEU  20           2HB      LEU  20  -3.102   5.640   3.345
  103    HG   LEU  20           HG       LEU  20  -3.612   3.202   2.524
  104   HD11  LEU  20          1HD1      LEU  20  -1.125   2.793   2.183
  105   HD12  LEU  20          2HD1      LEU  20  -2.025   1.563   3.070
  106   HD13  LEU  20          3HD1      LEU  20  -1.010   2.713   3.941
  107   HD21  LEU  20          1HD2      LEU  20  -3.333   4.466   5.075
  108   HD22  LEU  20          2HD2      LEU  20  -2.887   2.765   5.209
  109   HD23  LEU  20          3HD2      LEU  20  -4.469   3.214   4.570
  110    H    CYS  21           H        CYS  21  -1.536   7.411   2.426
  111    HA   CYS  21           HA       CYS  21  -3.625   9.133   1.293
  112    HB2  CYS  21           1HB      CYS  21  -2.952  10.763   3.011
  113    HB3  CYS  21           2HB      CYS  21  -3.397   9.216   3.725
  114    H    GLY  22           H        GLY  22  -0.103   9.035   1.803
  115    HA2  GLY  22           1HA      GLY  22   1.568   9.737   0.350
  116    HA3  GLY  22           2HA      GLY  22   0.327  10.303  -0.758
  117    H    GLU  23           H        GLU  23   1.235  11.113   2.595
  118    HA   GLU  23           HA       GLU  23   0.917  13.938   1.955
  119    HB2  GLU  23           1HB      GLU  23   1.365  12.485   4.564
  120    HB3  GLU  23           2HB      GLU  23   1.275  14.236   4.429
  121    HG2  GLU  23           1HG      GLU  23  -0.950  12.578   3.348
  122    HG3  GLU  23           2HG      GLU  23  -0.826  12.837   5.087
  123    H    HIS  24           H        HIS  24   3.343  12.018   3.736
  124    HA   HIS  24           HA       HIS  24   5.537  13.002   2.248
  125    HB2  HIS  24           1HB      HIS  24   4.685  14.966   3.829
  126    HB3  HIS  24           2HB      HIS  24   5.651  14.098   5.018
  127    HD1  HIS  24           1HD      HIS  24   8.240  13.823   4.414
  128    HD2  HIS  24           2HD      HIS  24   6.110  16.530   2.092
  129    HE1  HIS  24           1HE      HIS  24   9.976  15.238   3.270
  130    H    LEU  25           H        LEU  25   7.091  11.527   2.424
  131    HA   LEU  25           HA       LEU  25   7.027   9.708   4.726
  132    HB2  LEU  25           1HB      LEU  25   8.281   9.407   2.002
  133    HB3  LEU  25           2HB      LEU  25   8.393   8.215   3.295
  134    HG   LEU  25           HG       LEU  25   5.763   9.090   2.126
  135   HD11  LEU  25          1HD1      LEU  25   5.898   7.603   0.431
  136   HD12  LEU  25          2HD1      LEU  25   6.934   6.498   1.333
  137   HD13  LEU  25          3HD1      LEU  25   7.623   7.938   0.583
  138   HD21  LEU  25          1HD2      LEU  25   6.664   6.754   3.799
  139   HD22  LEU  25          2HD2      LEU  25   5.089   6.844   3.011
  140   HD23  LEU  25          3HD2      LEU  25   5.527   8.028   4.244
  141    H    TYR  26           H        TYR  26   8.880   9.225   5.899
  142    HA   TYR  26           HA       TYR  26  11.114  11.109   5.522
  143    HB2  TYR  26           1HB      TYR  26   9.740  11.398   7.611
  144    HB3  TYR  26           2HB      TYR  26  10.280   9.801   8.116
  145    HD1  TYR  26           1HD      TYR  26  11.977  12.800   6.652
  146    HD2  TYR  26           2HD      TYR  26  11.864   9.918   9.780
  147    HE1  TYR  26           1HE      TYR  26  13.995  13.802   7.640
  148    HE2  TYR  26           2HE      TYR  26  13.881  10.912  10.777
  149    HH   TYR  26           HH       TYR  26  15.109  13.932   9.817
  150    H    VAL  27           H        VAL  27  13.239  10.359   5.969
  151    HA   VAL  27           HA       VAL  27  14.053   8.057   4.807
  152    HB   VAL  27           HB       VAL  27  16.111   8.147   6.167
  153   HG11  VAL  27          1HG1      VAL  27  15.895   9.615   4.248
  154   HG12  VAL  27          2HG1      VAL  27  15.091  10.831   5.242
  155   HG13  VAL  27          3HG1      VAL  27  16.782  10.427   5.537
  156   HG21  VAL  27          1HG2      VAL  27  16.175  10.196   7.771
  157   HG22  VAL  27          2HG2      VAL  27  14.426   9.972   7.832
  158   HG23  VAL  27          3HG2      VAL  27  15.501   8.667   8.335
  159    H    LEU  28           H        LEU  28  12.588   8.360   7.928
  160    HA   LEU  28           HA       LEU  28  13.126   5.522   8.489
  161    HB2  LEU  28           1HB      LEU  28  12.521   7.871  10.241
  162    HB3  LEU  28           2HB      LEU  28  12.198   6.233  10.805
  163    HG   LEU  28           HG       LEU  28  14.916   7.083   9.843
  164   HD11  LEU  28          1HD1      LEU  28  14.247   8.582  11.657
  165   HD12  LEU  28          2HD1      LEU  28  15.527   7.479  12.162
  166   HD13  LEU  28          3HD1      LEU  28  13.863   7.187  12.666
  167   HD21  LEU  28          1HD2      LEU  28  14.222   4.957  11.840
  168   HD22  LEU  28          2HD2      LEU  28  15.690   5.142  10.880
  169   HD23  LEU  28          3HD2      LEU  28  14.187   4.637  10.106
  170    H    GLU  29           H        GLU  29  10.516   7.751   9.434
  171    HA   GLU  29           HA       GLU  29   8.446   6.124   9.790
  172    HB2  GLU  29           1HB      GLU  29   8.187   8.555   8.017
  173    HB3  GLU  29           2HB      GLU  29   6.940   7.844   9.031
  174    HG2  GLU  29           1HG      GLU  29   8.592   8.348  10.967
  175    HG3  GLU  29           2HG      GLU  29   9.314   9.470   9.815
  176    H    ARG  30           H        ARG  30   9.795   6.912   6.635
  177    HA   ARG  30           HA       ARG  30   7.827   5.719   5.034
  178    HB2  ARG  30           1HB      ARG  30   9.282   6.010   3.259
  179    HB3  ARG  30           2HB      ARG  30   9.878   7.206   4.403
  180    HG2  ARG  30           1HG      ARG  30  11.640   5.679   5.102
  181    HG3  ARG  30           2HG      ARG  30  11.032   4.456   3.984
  182    HD2  ARG  30           1HD      ARG  30  13.007   5.813   3.181
  183    HD3  ARG  30           2HD      ARG  30  11.617   5.752   2.098
  184    HE   ARG  30           HE       ARG  30  12.586   8.062   3.574
  185   HH11  ARG  30          2HH1      ARG  30  10.092   6.650   1.598
  186   HH12  ARG  30          1HH1      ARG  30   9.422   8.176   1.124
  187   HH21  ARG  30          2HH2      ARG  30  11.712  10.077   2.958
  188   HH22  ARG  30          1HH2      ARG  30  10.344  10.125   1.898
  189    H    LEU  31           H        LEU  31   7.382   3.666   4.493
  190    HA   LEU  31           HA       LEU  31   9.199   1.570   5.487
  191    HB2  LEU  31           1HB      LEU  31   6.265   1.884   5.613
  192    HB3  LEU  31           2HB      LEU  31   6.861   0.264   5.259
  193    HG   LEU  31           HG       LEU  31   8.148   0.287   7.345
  194   HD11  LEU  31          1HD1      LEU  31   8.431   2.085   8.655
  195   HD12  LEU  31          2HD1      LEU  31   6.774   2.643   8.424
  196   HD13  LEU  31          3HD1      LEU  31   7.999   2.992   7.205
  197   HD21  LEU  31          1HD2      LEU  31   5.593  -0.297   7.095
  198   HD22  LEU  31          2HD2      LEU  31   5.402   1.094   8.162
  199   HD23  LEU  31          3HD2      LEU  31   6.376  -0.284   8.675
  200    H    CYS  32           H        CYS  32  10.345   1.064   3.690
  201    HA   CYS  32           HA       CYS  32   9.256   0.963   1.074
  202    HB2  CYS  32           1HB      CYS  32  11.753   1.132   1.943
  203    HB3  CYS  32           2HB      CYS  32  11.687  -0.620   1.788
  204    HG   CYS  32           HG       CYS  32  12.838   0.941  -0.460
  205    H    VAL  33           H        VAL  33   7.814  -0.468   0.393
  206    HA   VAL  33           HA       VAL  33   8.160  -3.287   1.156
  207    HB   VAL  33           HB       VAL  33   5.482  -1.901   0.985
  208   HG11  VAL  33          1HG1      VAL  33   5.973  -4.601   2.169
  209   HG12  VAL  33          2HG1      VAL  33   4.488  -3.924   1.496
  210   HG13  VAL  33          3HG1      VAL  33   5.798  -4.421   0.424
  211   HG21  VAL  33          1HG2      VAL  33   5.396  -2.304   3.444
  212   HG22  VAL  33          2HG2      VAL  33   7.101  -2.751   3.382
  213   HG23  VAL  33          3HG2      VAL  33   6.602  -1.114   2.953
  214    H    ASN  34           H        ASN  34   8.772  -4.191  -0.713
  215    HA   ASN  34           HA       ASN  34   8.797  -4.833  -2.896
  216    HB2  ASN  34           1HB      ASN  34   5.846  -4.313  -2.510
  217    HB3  ASN  34           2HB      ASN  34   6.510  -5.027  -3.977
  218   HD21  ASN  34          1HD2      ASN  34   4.709  -6.481  -2.729
  219   HD22  ASN  34          2HD2      ASN  34   5.425  -7.802  -1.876
  220    H    GLY  35           H        GLY  35   9.531  -2.171  -2.466
  221    HA2  GLY  35           1HA      GLY  35  10.178  -0.521  -4.003
  222    HA3  GLY  35           2HA      GLY  35   8.917  -1.074  -5.094
  223    H    HIS  36           H        HIS  36   6.797  -0.985  -3.142
  224    HA   HIS  36           HA       HIS  36   6.260   1.864  -3.270
  225    HB2  HIS  36           1HB      HIS  36   4.445  -0.315  -2.232
  226    HB3  HIS  36           2HB      HIS  36   3.984   1.301  -2.756
  227    HD1  HIS  36           1HD      HIS  36   5.356   1.454  -5.467
  228    HD2  HIS  36           2HD      HIS  36   3.314  -1.902  -4.117
  229    HE1  HIS  36           1HE      HIS  36   4.703   0.186  -7.539
  230    H    PHE  37           H        PHE  37   6.236   3.237  -1.591
  231    HA   PHE  37           HA       PHE  37   7.043   2.190   1.016
  232    HB2  PHE  37           1HB      PHE  37   6.989   5.007  -0.081
  233    HB3  PHE  37           2HB      PHE  37   7.499   4.588   1.552
  234    HD1  PHE  37           1HD      PHE  37   8.254   3.884  -2.019
  235    HD2  PHE  37           2HD      PHE  37   9.713   4.062   1.975
  236    HE1  PHE  37           1HE      PHE  37  10.540   3.494  -2.841
  237    HE2  PHE  37           2HE      PHE  37  12.002   3.673   1.160
  238    HZ   PHE  37           HZ       PHE  37  12.418   3.389  -1.250
  239    H    PHE  38           H        PHE  38   6.038   2.999   2.969
  240    HA   PHE  38           HA       PHE  38   3.365   4.124   2.689
  241    HB2  PHE  38           1HB      PHE  38   3.909   1.469   4.031
  242    HB3  PHE  38           2HB      PHE  38   2.394   2.356   4.154
  243    HD1  PHE  38           1HD      PHE  38   4.596   0.468   1.900
  244    HD2  PHE  38           2HD      PHE  38   0.815   2.366   2.368
  245    HE1  PHE  38           1HE      PHE  38   3.797  -0.626  -0.154
  246    HE2  PHE  38           2HE      PHE  38   0.009   1.274   0.315
  247    HZ   PHE  38           HZ       PHE  38   1.500  -0.224  -0.948
  248    H    HIS  39           H        HIS  39   2.505   4.969   4.659
  249    HA   HIS  39           HA       HIS  39   4.488   6.124   6.340
  250    HB2  HIS  39           1HB      HIS  39   1.501   6.192   6.221
  251    HB3  HIS  39           2HB      HIS  39   2.308   6.781   7.671
  252    HD2  HIS  39           2HD      HIS  39   4.788   8.343   6.080
  253    HE1  HIS  39           1HE      HIS  39   1.602  10.550   4.355
  254    HE2  HIS  39           2HE      HIS  39   4.089  10.440   4.738
  255    H    ARG  40           H        ARG  40   5.085   5.651   8.406
  256    HA   ARG  40           HA       ARG  40   4.955   3.021   9.312
  257    HB2  ARG  40           1HB      ARG  40   6.430   5.154  10.006
  258    HB3  ARG  40           2HB      ARG  40   5.290   5.158  11.345
  259    HG2  ARG  40           1HG      ARG  40   6.560   2.573  10.661
  260    HG3  ARG  40           2HG      ARG  40   7.576   3.808  11.407
  261    HD2  ARG  40           1HD      ARG  40   6.010   3.992  13.264
  262    HD3  ARG  40           2HD      ARG  40   4.955   2.800  12.508
  263    HE   ARG  40           HE       ARG  40   7.242   1.434  12.726
  264   HH11  ARG  40          2HH1      ARG  40   5.510   3.405  15.013
  265   HH12  ARG  40          1HH1      ARG  40   6.047   2.506  16.393
  266   HH21  ARG  40          2HH2      ARG  40   7.955   0.241  14.535
  267   HH22  ARG  40          1HH2      ARG  40   7.438   0.707  16.120
  268    H    SER  41           H        SER  41   2.603   5.462   9.460
  269    HA   SER  41           HA       SER  41   1.210   4.203  11.710
  270    HB2  SER  41           1HB      SER  41   1.535   6.740  11.537
  271    HB3  SER  41           2HB      SER  41   0.332   6.692  10.249
  272    HG   SER  41           HG       SER  41  -0.172   6.884  12.764
  273    H    CYS  42           H        CYS  42   0.630   5.222   8.353
  274    HA   CYS  42           HA       CYS  42  -1.949   4.213   8.070
  275    HB2  CYS  42           1HB      CYS  42   0.278   4.610   6.077
  276    HB3  CYS  42           2HB      CYS  42  -1.320   4.046   5.598
  277    H    PHE  43           H        PHE  43   1.147   2.646   7.269
  278    HA   PHE  43           HA       PHE  43   0.277   0.249   6.293
  279    HB2  PHE  43           1HB      PHE  43   2.682   1.085   6.672
  280    HB3  PHE  43           2HB      PHE  43   2.541   0.370   8.274
  281    HD1  PHE  43           2HD      PHE  43   1.363  -0.813   4.945
  282    HD2  PHE  43           1HD      PHE  43   3.871  -1.509   8.312
  283    HE1  PHE  43           2HE      PHE  43   1.994  -3.003   4.017
  284    HE2  PHE  43           1HE      PHE  43   4.507  -3.700   7.389
  285    HZ   PHE  43           HZ       PHE  43   3.567  -4.450   5.240
  286    H    ARG  44           H        ARG  44  -1.599  -0.526   7.213
  287    HA   ARG  44           HA       ARG  44  -1.255  -1.826   9.815
  288    HB2  ARG  44           1HB      ARG  44  -3.604  -0.090   9.039
  289    HB3  ARG  44           2HB      ARG  44  -3.586  -1.161  10.434
  290    HG2  ARG  44           1HG      ARG  44  -1.945   0.117  11.528
  291    HG3  ARG  44           2HG      ARG  44  -1.543   1.003  10.056
  292    HD2  ARG  44           1HD      ARG  44  -3.862   1.944  10.094
  293    HD3  ARG  44           2HD      ARG  44  -4.077   1.193  11.675
  294    HE   ARG  44           HE       ARG  44  -1.758   2.747  11.759
  295   HH11  ARG  44          2HH1      ARG  44  -5.199   3.157  11.427
  296   HH12  ARG  44          1HH1      ARG  44  -5.214   4.729  12.155
  297   HH21  ARG  44          2HH2      ARG  44  -1.764   4.815  12.720
  298   HH22  ARG  44          1HH2      ARG  44  -3.259   5.672  12.890
  299    H    CYS  45           H        CYS  45  -3.109  -3.394  10.226
  300    HA   CYS  45           HA       CYS  45  -3.192  -5.312   8.222
  301    HB2  CYS  45           1HB      CYS  45  -3.682  -5.676  10.658
  302    HB3  CYS  45           2HB      CYS  45  -5.268  -4.958  10.391
  303    H    HIS  46           H        HIS  46  -5.128  -6.166   7.100
  304    HA   HIS  46           HA       HIS  46  -6.640  -3.949   5.919
  305    HB2  HIS  46           1HB      HIS  46  -5.440  -5.252   4.295
  306    HB3  HIS  46           2HB      HIS  46  -6.086  -6.756   4.946
  307    HD1  HIS  46           1HD      HIS  46  -6.815  -4.049   2.557
  308    HD2  HIS  46           2HD      HIS  46  -8.858  -7.197   4.340
  309    HE1  HIS  46           1HE      HIS  46  -8.917  -4.336   1.208
  310    H    THR  47           H        THR  47  -7.037  -6.101   8.330
  311    HA   THR  47           HA       THR  47  -9.940  -6.311   7.860
  312    HB   THR  47           HB       THR  47  -8.074  -8.301   9.139
  313    HG1  THR  47           1HG      THR  47  -8.848  -9.621   7.544
  314   HG21  THR  47          1HG2      THR  47 -10.054  -7.928  10.602
  315   HG22  THR  47          2HG2      THR  47  -9.982  -9.552   9.920
  316   HG23  THR  47          3HG2      THR  47 -11.091  -8.360   9.243
  317    H    CYS  48           H        CYS  48  -7.373  -5.952  10.265
  318    HA   CYS  48           HA       CYS  48  -9.366  -4.870  12.145
  319    HB2  CYS  48           1HB      CYS  48  -7.766  -5.413  13.934
  320    HB3  CYS  48           2HB      CYS  48  -8.209  -6.843  13.008
  321    H    GLU  49           H        GLU  49  -6.992  -3.970  10.018
  322    HA   GLU  49           HA       GLU  49  -5.715  -2.106   9.707
  323    HB2  GLU  49           1HB      GLU  49  -7.846  -0.834  11.432
  324    HB3  GLU  49           2HB      GLU  49  -6.761   0.007  10.334
  325    HG2  GLU  49           1HG      GLU  49  -7.876  -0.701   8.464
  326    HG3  GLU  49           2HG      GLU  49  -8.511  -2.143   9.255
  327    H    ALA  50           H        ALA  50  -4.565  -3.639  11.574
  328    HA   ALA  50           HA       ALA  50  -3.904  -1.894  13.839
  329    HB1  ALA  50           1HB      ALA  50  -3.013  -4.743  13.514
  330    HB2  ALA  50           2HB      ALA  50  -3.147  -3.790  14.992
  331    HB3  ALA  50           3HB      ALA  50  -4.603  -4.328  14.155
  332    H    THR  51           H        THR  51  -1.868  -1.134  14.197
  333    HA   THR  51           HA       THR  51  -0.174  -0.571  12.111
  334    HB   THR  51           HB       THR  51   0.727  -0.936  14.973
  335    HG1  THR  51           1HG      THR  51   0.064   1.200  15.262
  336   HG21  THR  51          1HG2      THR  51   1.803   1.223  13.279
  337   HG22  THR  51          2HG2      THR  51   2.270  -0.412  12.813
  338   HG23  THR  51          3HG2      THR  51   2.621   0.176  14.438
  339    H    LEU  52           H        LEU  52   0.482  -2.175  10.769
  340    HA   LEU  52           HA       LEU  52   1.389  -4.719  11.673
  341    HB2  LEU  52           1HB      LEU  52   1.771  -3.372   9.003
  342    HB3  LEU  52           2HB      LEU  52   2.051  -5.078   9.344
  343    HG   LEU  52           HG       LEU  52  -0.628  -3.698   9.502
  344   HD11  LEU  52          1HD1      LEU  52   0.855  -4.710   7.260
  345   HD12  LEU  52          2HD1      LEU  52  -0.710  -3.899   7.295
  346   HD13  LEU  52          3HD1      LEU  52  -0.619  -5.648   7.498
  347   HD21  LEU  52          1HD2      LEU  52  -0.133  -5.749  10.963
  348   HD22  LEU  52          2HD2      LEU  52  -0.109  -6.652   9.449
  349   HD23  LEU  52          3HD2      LEU  52  -1.568  -5.789   9.939
  350    H    TRP  53           H        TRP  53   3.104  -4.579  13.052
  351    HA   TRP  53           HA       TRP  53   5.330  -2.876  12.684
  352    HB2  TRP  53           1HB      TRP  53   5.529  -5.446  14.215
  353    HB3  TRP  53           2HB      TRP  53   6.234  -3.874  14.582
  354    HD1  TRP  53           HD       TRP  53   2.888  -5.761  14.794
  355    HE1  TRP  53           1HE      TRP  53   1.412  -4.597  16.552
  356    HE3  TRP  53           3HE      TRP  53   5.846  -1.711  15.783
  357    HZ2  TRP  53           2HZ      TRP  53   1.491  -2.270  18.147
  358    HZ3  TRP  53           3HZ      TRP  53   5.073  -0.062  17.437
  359    HH2  TRP  53           HH       TRP  53   2.940  -0.337  18.594
  360    HA   PRO  54           HA       PRO  54   7.851  -5.003   9.789
  361    HB2  PRO  54           1HB      PRO  54  10.337  -4.499  10.755
  362    HB3  PRO  54           2HB      PRO  54   9.340  -3.264   9.977
  363    HG2  PRO  54           1HG      PRO  54   9.780  -3.783  12.892
  364    HG3  PRO  54           2HG      PRO  54   9.733  -2.237  12.026
  365    HD2  PRO  54           1HD      PRO  54   7.629  -3.174  13.450
  366    HD3  PRO  54           2HD      PRO  54   7.429  -2.184  11.990
  367    H    GLY  55           H        GLY  55   7.095  -6.339  12.561
  368    HA2  GLY  55           1HA      GLY  55   8.695  -8.721  12.043
  369    HA3  GLY  55           2HA      GLY  55   8.866  -8.001  13.637
  370    H    GLY  56           H        GLY  56   5.823  -7.896  11.945
  371    HA2  GLY  56           1HA      GLY  56   4.770 -10.277  13.171
  372    HA3  GLY  56           2HA      GLY  56   4.236  -8.804  13.966
  373    H    TYR  57           H        TYR  57   4.747  -9.631  10.541
  374    HA   TYR  57           HA       TYR  57   1.920  -9.545   9.993
  375    HB2  TYR  57           1HB      TYR  57   1.792  -7.581   8.761
  376    HB3  TYR  57           2HB      TYR  57   2.852  -7.107  10.083
  377    HD1  TYR  57           2HD      TYR  57   5.380  -7.186   9.654
  378    HD2  TYR  57           1HD      TYR  57   2.483  -7.335   6.541
  379    HE1  TYR  57           2HE      TYR  57   7.093  -6.487   8.034
  380    HE2  TYR  57           1HE      TYR  57   4.188  -6.638   4.912
  381    HH   TYR  57           HH       TYR  57   7.433  -5.718   5.930
  382    H    GLU  58           H        GLU  58   1.467  -9.916   7.663
  383    HA   GLU  58           HA       GLU  58   3.659 -10.918   6.056
  384    HB2  GLU  58           1HB      GLU  58   1.710 -12.689   7.433
  385    HB3  GLU  58           2HB      GLU  58   2.117 -13.087   5.770
  386    HG2  GLU  58           1HG      GLU  58   4.219 -12.623   7.856
  387    HG3  GLU  58           2HG      GLU  58   3.474 -14.199   7.602
  388    H    GLN  59           H        GLN  59   3.061 -11.337   3.864
  389    HA   GLN  59           HA       GLN  59   0.565  -9.982   3.101
  390    HB2  GLN  59           1HB      GLN  59   2.489  -8.831   2.244
  391    HB3  GLN  59           2HB      GLN  59   3.172 -10.327   1.620
  392    HG2  GLN  59           1HG      GLN  59   0.938 -10.387   0.239
  393    HG3  GLN  59           2HG      GLN  59   0.968  -8.650   0.544
  394   HE21  GLN  59          1HE2      GLN  59   1.154  -9.812  -1.999
  395   HE22  GLN  59          2HE2      GLN  59   2.714  -9.452  -2.649
  396    H    HIS  60           H        HIS  60  -1.006 -11.361   2.616
  397    HA   HIS  60           HA       HIS  60  -0.596 -14.071   1.927
  398    HB2  HIS  60           1HB      HIS  60  -2.676 -12.977   2.969
  399    HB3  HIS  60           2HB      HIS  60  -3.113 -12.532   1.322
  400    HD1  HIS  60           1HD      HIS  60  -4.262 -14.276  -0.056
  401    HD2  HIS  60           2HD      HIS  60  -2.542 -15.849   3.384
  402    HE1  HIS  60           1HE      HIS  60  -5.048 -16.662   0.059
  403    HA   PRO  61           HA       PRO  61   0.336 -13.602  -2.377
  404    HB2  PRO  61           1HB      PRO  61   0.134 -16.226  -3.046
  405    HB3  PRO  61           2HB      PRO  61   1.517 -15.562  -2.167
  406    HG2  PRO  61           1HG      PRO  61  -0.866 -17.037  -1.114
  407    HG3  PRO  61           2HG      PRO  61   0.844 -17.214  -0.676
  408    HD2  PRO  61           1HD      PRO  61  -0.912 -15.815   0.839
  409    HD3  PRO  61           2HD      PRO  61   0.805 -15.380   0.720
  410    H    GLY  62           H        GLY  62  -2.476 -15.452  -1.272
  411    HA2  GLY  62           1HA      GLY  62  -3.882 -15.914  -3.546
  412    HA3  GLY  62           2HA      GLY  62  -4.650 -15.404  -2.050
  413    H    ASP  63           H        ASP  63  -4.987 -13.126  -1.702
  414    HA   ASP  63           HA       ASP  63  -5.907 -11.808  -4.051
  415    HB2  ASP  63           1HB      ASP  63  -5.736 -11.039  -1.149
  416    HB3  ASP  63           2HB      ASP  63  -6.228  -9.865  -2.367
  417    H    GLY  64           H        GLY  64  -3.426 -10.855  -1.662
  418    HA2  GLY  64           1HA      GLY  64  -1.207 -10.265  -2.639
  419    HA3  GLY  64           2HA      GLY  64  -2.107  -9.338  -3.830
  420    H    HIS  65           H        HIS  65  -2.770  -9.514  -0.369
  421    HA   HIS  65           HA       HIS  65  -1.998  -6.678  -0.152
  422    HB2  HIS  65           1HB      HIS  65  -4.344  -8.039   1.189
  423    HB3  HIS  65           2HB      HIS  65  -3.862  -6.362   1.424
  424    HD1  HIS  65           1HD      HIS  65  -4.079  -4.801  -0.754
  425    HD2  HIS  65           2HD      HIS  65  -6.023  -8.469  -0.921
  426    HE1  HIS  65           1HE      HIS  65  -5.723  -4.605  -2.647
  427    H    PHE  66           H        PHE  66  -2.164  -6.195   2.448
  428    HA   PHE  66           HA       PHE  66  -0.354  -8.172   3.670
  429    HB2  PHE  66           1HB      PHE  66  -0.477  -5.172   4.002
  430    HB3  PHE  66           2HB      PHE  66   0.485  -6.224   5.035
  431    HD1  PHE  66           1HD      PHE  66   2.468  -7.329   4.184
  432    HD2  PHE  66           2HD      PHE  66   0.161  -4.734   1.722
  433    HE1  PHE  66           1HE      PHE  66   4.320  -7.221   2.569
  434    HE2  PHE  66           2HE      PHE  66   2.009  -4.622   0.102
  435    HZ   PHE  66           HZ       PHE  66   4.092  -5.867   0.524
  436    H    TYR  67           H        TYR  67  -1.084  -9.197   5.405
  437    HA   TYR  67           HA       TYR  67  -3.162  -7.904   7.041
  438    HB2  TYR  67           1HB      TYR  67  -3.062 -10.856   6.401
  439    HB3  TYR  67           2HB      TYR  67  -4.318 -10.007   7.294
  440    HD1  TYR  67           2HD      TYR  67  -2.870 -10.589   3.963
  441    HD2  TYR  67           1HD      TYR  67  -6.032  -8.768   6.152
  442    HE1  TYR  67           2HE      TYR  67  -4.107 -10.230   1.867
  443    HE2  TYR  67           1HE      TYR  67  -7.277  -8.405   4.063
  444    HH   TYR  67           HH       TYR  67  -5.886  -9.272   0.920
  445    H    CYS  68           H        CYS  68  -3.334  -8.840   9.244
  446    HA   CYS  68           HA       CYS  68  -0.731  -9.013  10.428
  447    HB2  CYS  68           1HB      CYS  68  -1.898  -9.049  12.549
  448    HB3  CYS  68           2HB      CYS  68  -2.641  -7.841  11.505
  449    H    LEU  69           H        LEU  69  -0.386 -10.733  12.198
  450    HA   LEU  69           HA       LEU  69  -0.467 -13.301  10.897
  451    HB2  LEU  69           1HB      LEU  69   0.501 -12.708  13.681
  452    HB3  LEU  69           2HB      LEU  69   0.946 -14.064  12.647
  453    HG   LEU  69           HG       LEU  69   1.773 -11.181  12.351
  454   HD11  LEU  69          1HD1      LEU  69   4.005 -12.044  12.668
  455   HD12  LEU  69          2HD1      LEU  69   3.389 -13.693  12.756
  456   HD13  LEU  69          3HD1      LEU  69   2.984 -12.533  14.021
  457   HD21  LEU  69          1HD2      LEU  69   2.785 -11.673  10.304
  458   HD22  LEU  69          2HD2      LEU  69   1.190 -12.416  10.183
  459   HD23  LEU  69          3HD2      LEU  69   2.604 -13.413  10.526
  460    H    GLN  70           H        GLN  70  -2.897 -11.843  12.163
  461    HA   GLN  70           HA       GLN  70  -3.904 -14.214  13.590
  462    HB2  GLN  70           1HB      GLN  70  -3.560 -12.430  15.203
  463    HB3  GLN  70           2HB      GLN  70  -4.477 -11.311  14.204
  464    HG2  GLN  70           1HG      GLN  70  -6.506 -12.436  14.637
  465    HG3  GLN  70           2HG      GLN  70  -5.671 -13.818  15.345
  466   HE21  GLN  70          1HE2      GLN  70  -7.324 -13.281  17.039
  467   HE22  GLN  70          2HE2      GLN  70  -6.846 -12.177  18.279
  468    H    HIS  71           H        HIS  71  -4.209 -12.197  10.953
  469    HA   HIS  71           HA       HIS  71  -6.976 -13.098  10.505
  470    HB2  HIS  71           1HB      HIS  71  -5.753 -10.398  10.059
  471    HB3  HIS  71           2HB      HIS  71  -7.077 -10.936   9.029
  472    HD2  HIS  71           2HD      HIS  71  -8.154 -12.389  12.176
  473    HE1  HIS  71           1HE      HIS  71  -9.376  -8.341  12.516
  474    HE2  HIS  71           2HE      HIS  71  -9.555 -10.656  13.490
  475    H    LEU  72           H        LEU  72  -3.766 -12.807   9.349
  476    HA   LEU  72           HA       LEU  72  -3.995 -12.896   6.613
  477    HB2  LEU  72           1HB      LEU  72  -1.881 -12.830   7.931
  478    HB3  LEU  72           2HB      LEU  72  -2.077 -14.554   8.243
  479    HG   LEU  72           HG       LEU  72  -2.123 -14.674   5.605
  480   HD11  LEU  72          1HD1      LEU  72  -0.400 -13.008   4.761
  481   HD12  LEU  72          2HD1      LEU  72  -0.754 -12.071   6.211
  482   HD13  LEU  72          3HD1      LEU  72  -2.030 -12.397   5.039
  483   HD21  LEU  72          1HD2      LEU  72   0.311 -15.049   5.657
  484   HD22  LEU  72          2HD2      LEU  72  -0.519 -15.823   7.007
  485   HD23  LEU  72          3HD2      LEU  72   0.372 -14.322   7.263
  486    HA   PRO  73           HA       PRO  73  -6.403 -16.635   6.123
  487    HB2  PRO  73           1HB      PRO  73  -6.664 -16.409   3.430
  488    HB3  PRO  73           2HB      PRO  73  -7.633 -15.470   4.572
  489    HG2  PRO  73           1HG      PRO  73  -5.188 -14.659   3.047
  490    HG3  PRO  73           2HG      PRO  73  -6.681 -13.746   3.334
  491    HD2  PRO  73           1HD      PRO  73  -4.417 -13.320   4.757
  492    HD3  PRO  73           2HD      PRO  73  -6.036 -13.115   5.455
  493    H    GLN  74           H        GLN  74  -6.252 -18.427   4.297
  494    HA   GLN  74           HA       GLN  74  -3.598 -18.925   3.304
  495    HB2  GLN  74           1HB      GLN  74  -4.600 -20.234   5.777
  496    HB3  GLN  74           2HB      GLN  74  -3.750 -21.250   4.621
  497    HG2  GLN  74           1HG      GLN  74  -1.871 -19.596   4.689
  498    HG3  GLN  74           2HG      GLN  74  -2.710 -18.804   6.022
  499   HE21  GLN  74          1HE2      GLN  74  -0.835 -19.260   7.289
  500   HE22  GLN  74          2HE2      GLN  74  -0.610 -20.827   7.979
  501    H    THR  75           H        THR  75  -3.886 -19.830   1.388
  502    HA   THR  75           HA       THR  75  -6.166 -20.576   0.174
  503    HB   THR  75           HB       THR  75  -4.836 -22.140  -1.260
  504    HG1  THR  75           1HG      THR  75  -3.234 -22.995  -0.115
  505   HG21  THR  75          1HG2      THR  75  -2.947 -20.029  -1.339
  506   HG22  THR  75          2HG2      THR  75  -4.502 -19.332  -0.883
  507   HG23  THR  75          3HG2      THR  75  -4.357 -20.270  -2.369
  508    H    ASP  76           H        ASP  76  -7.170 -22.617  -0.357
  509    HA   ASP  76           HA       ASP  76  -6.703 -24.798   1.537
  510    HB2  ASP  76           1HB      ASP  76  -8.588 -23.134   2.260
  511    HB3  ASP  76           2HB      ASP  76  -9.528 -23.942   1.009
  512    H    SER  77           H        SER  77  -7.232 -26.826   0.772
  513    HA   SER  77           HA       SER  77  -7.412 -28.436  -0.833
  514    HB2  SER  77           1HB      SER  77  -9.821 -27.613  -0.499
  515    HB3  SER  77           2HB      SER  77  -9.612 -26.749  -2.022
  516    HG   SER  77           HG       SER  77  -8.879 -29.424  -2.016
  517    H    GLY  78           H        GLY  78  -5.447 -26.527  -1.389
  518    HA2  GLY  78           1HA      GLY  78  -5.679 -25.660  -4.127
  519    HA3  GLY  78           2HA      GLY  78  -4.253 -25.532  -3.107
  520    HA   PRO  79           HA       PRO  79  -2.911 -28.602  -6.125
  521    HB2  PRO  79           1HB      PRO  79  -0.269 -28.301  -5.578
  522    HB3  PRO  79           2HB      PRO  79  -1.165 -27.196  -6.627
  523    HG2  PRO  79           1HG      PRO  79  -0.416 -26.883  -3.746
  524    HG3  PRO  79           2HG      PRO  79  -0.347 -25.690  -5.055
  525    HD2  PRO  79           1HD      PRO  79  -2.355 -25.746  -3.239
  526    HD3  PRO  79           2HD      PRO  79  -2.600 -25.223  -4.918
  527    H    SER  80           H        SER  80  -2.432 -28.398  -2.705
  528    HA   SER  80           HA       SER  80  -1.842 -31.283  -2.638
  529    HB2  SER  80           1HB      SER  80  -0.625 -29.056  -1.019
  530    HB3  SER  80           2HB      SER  80  -0.644 -30.713  -0.418
  531    HG   SER  80           HG       SER  80   0.225 -30.956  -2.825
  532    H    SER  81           H        SER  81  -2.359 -32.218  -0.407
  533    HA   SER  81           HA       SER  81  -5.040 -31.297   0.320
  534    HB2  SER  81           1HB      SER  81  -3.653 -33.880   1.076
  535    HB3  SER  81           2HB      SER  81  -5.360 -33.496   1.299
  536    HG   SER  81           HG       SER  81  -5.009 -34.759  -0.574
  537    H    GLY  82           H        GLY  82  -5.568 -30.557   2.308
  538    HA2  GLY  82           1HA      GLY  82  -3.691 -30.858   4.520
  539    HA3  GLY  82           2HA      GLY  82  -3.986 -29.217   3.966
  Start of MODEL   17
    1    H1   GLY   1           H        GLY   1  -9.486  35.682 -28.718
    2    HA2  GLY   1           1HA      GLY   1  -9.273  35.688 -26.151
    3    HA3  GLY   1           2HA      GLY   1 -10.452  34.389 -26.256
    4    H    SER   2           H        SER   2  -7.687  34.400 -25.221
    5    HA   SER   2           HA       SER   2  -6.741  32.092 -26.750
    6    HB2  SER   2           1HB      SER   2  -4.414  32.916 -26.679
    7    HB3  SER   2           2HB      SER   2  -5.454  33.991 -27.612
    8    HG   SER   2           HG       SER   2  -4.151  34.421 -25.209
    9    H    SER   3           H        SER   3  -6.221  30.448 -25.464
   10    HA   SER   3           HA       SER   3  -6.046  30.943 -22.584
   11    HB2  SER   3           1HB      SER   3  -6.589  28.459 -24.211
   12    HB3  SER   3           2HB      SER   3  -6.273  28.400 -22.477
   13    HG   SER   3           HG       SER   3  -8.181  30.229 -23.315
   14    H    GLY   4           H        GLY   4  -4.318  29.273 -25.196
   15    HA2  GLY   4           1HA      GLY   4  -2.219  28.264 -25.168
   16    HA3  GLY   4           2HA      GLY   4  -1.775  29.891 -24.673
   17    H    SER   5           H        SER   5  -2.957  26.816 -23.330
   18    HA   SER   5           HA       SER   5  -1.477  27.418 -20.860
   19    HB2  SER   5           1HB      SER   5  -2.922  25.783 -19.758
   20    HB3  SER   5           2HB      SER   5  -3.900  26.995 -20.586
   21    HG   SER   5           HG       SER   5  -4.776  25.401 -21.614
   22    H    SER   6           H        SER   6   0.532  26.632 -21.075
   23    HA   SER   6           HA       SER   6   1.244  24.380 -22.613
   24    HB2  SER   6           1HB      SER   6   3.439  24.607 -21.648
   25    HB3  SER   6           2HB      SER   6   2.796  26.229 -21.908
   26    HG   SER   6           HG       SER   6   2.564  24.873 -19.435
   27    H    GLY   7           H        GLY   7   0.671  24.786 -19.136
   28    HA2  GLY   7           1HA      GLY   7  -0.534  22.874 -18.090
   29    HA3  GLY   7           2HA      GLY   7   0.628  21.839 -18.906
   30    H    GLN   8           H        GLN   8  -0.142  23.179 -16.008
   31    HA   GLN   8           HA       GLN   8   2.533  23.717 -15.063
   32    HB2  GLN   8           1HB      GLN   8   0.674  25.007 -14.165
   33    HB3  GLN   8           2HB      GLN   8  -0.104  23.535 -13.597
   34    HG2  GLN   8           1HG      GLN   8   0.915  24.591 -11.731
   35    HG3  GLN   8           2HG      GLN   8   1.855  23.150 -12.114
   36   HE21  GLN   8          1HE2      GLN   8   3.393  24.417 -10.732
   37   HE22  GLN   8          2HE2      GLN   8   4.462  25.505 -11.542
   38    H    HIS   9           H        HIS   9   3.498  21.664 -15.529
   39    HA   HIS   9           HA       HIS   9   3.298  19.839 -13.305
   40    HB2  HIS   9           1HB      HIS   9   3.029  17.846 -14.874
   41    HB3  HIS   9           2HB      HIS   9   1.587  18.811 -14.577
   42    HD1  HIS   9           1HD      HIS   9   4.247  18.306 -17.223
   43    HD2  HIS   9           2HD      HIS   9   0.400  19.823 -16.820
   44    HE1  HIS   9           1HE      HIS   9   3.472  18.804 -19.563
   45    H    GLN  10           H        GLN  10   5.275  19.153 -12.808
   46    HA   GLN  10           HA       GLN  10   7.576  19.958 -14.088
   47    HB2  GLN  10           1HB      GLN  10   7.207  17.481 -12.394
   48    HB3  GLN  10           2HB      GLN  10   8.749  18.240 -12.769
   49    HG2  GLN  10           1HG      GLN  10   6.503  19.520 -11.228
   50    HG3  GLN  10           2HG      GLN  10   7.953  18.804 -10.527
   51   HE21  GLN  10          1HE2      GLN  10   7.228  21.426 -10.054
   52   HE22  GLN  10          2HE2      GLN  10   8.381  22.477 -10.796
   53    H    GLU  11           H        GLU  11   9.305  18.381 -14.945
   54    HA   GLU  11           HA       GLU  11   8.231  17.177 -17.324
   55    HB2  GLU  11           1HB      GLU  11  10.437  18.469 -17.103
   56    HB3  GLU  11           2HB      GLU  11  11.091  16.997 -16.398
   57    HG2  GLU  11           1HG      GLU  11  10.683  15.773 -18.410
   58    HG3  GLU  11           2HG      GLU  11   9.809  17.132 -19.115
   59    H    ALA  12           H        ALA  12  10.217  15.949 -14.627
   60    HA   ALA  12           HA       ALA  12   8.751  13.478 -14.566
   61    HB1  ALA  12           1HB      ALA  12  10.415  13.262 -16.490
   62    HB2  ALA  12           2HB      ALA  12  11.664  13.218 -15.244
   63    HB3  ALA  12           3HB      ALA  12  10.406  11.981 -15.277
   64    H    GLY  13           H        GLY  13   9.667  11.967 -12.897
   65    HA2  GLY  13           1HA      GLY  13  11.654  12.557 -11.087
   66    HA3  GLY  13           2HA      GLY  13  10.249  13.450 -10.524
   67    H    ALA  14           H        ALA  14  10.844  11.894  -8.670
   68    HA   ALA  14           HA       ALA  14   9.485   9.313  -9.064
   69    HB1  ALA  14           1HB      ALA  14  11.235   9.964  -6.718
   70    HB2  ALA  14           2HB      ALA  14  10.794   8.385  -7.371
   71    HB3  ALA  14           3HB      ALA  14  11.916   9.422  -8.252
   72    H    GLY  15           H        GLY  15   8.025   8.562  -7.445
   73    HA2  GLY  15           1HA      GLY  15   6.611  10.770  -6.129
   74    HA3  GLY  15           2HA      GLY  15   5.945   9.181  -6.477
   75    H    ASP  16           H        ASP  16   8.253  10.900  -4.421
   76    HA   ASP  16           HA       ASP  16   8.454   8.688  -2.576
   77    HB2  ASP  16           1HB      ASP  16   9.575  11.480  -2.638
   78    HB3  ASP  16           2HB      ASP  16   9.719  10.472  -1.200
   79    H    LEU  17           H        LEU  17   5.906   8.944  -2.582
   80    HA   LEU  17           HA       LEU  17   5.267  10.271  -0.053
   81    HB2  LEU  17           1HB      LEU  17   3.333  10.436  -2.329
   82    HB3  LEU  17           2HB      LEU  17   3.397  11.396  -0.853
   83    HG   LEU  17           HG       LEU  17   5.564  11.639  -2.905
   84   HD11  LEU  17          1HD1      LEU  17   3.826  12.081  -4.340
   85   HD12  LEU  17          2HD1      LEU  17   4.112  13.678  -3.650
   86   HD13  LEU  17          3HD1      LEU  17   2.777  12.689  -3.059
   87   HD21  LEU  17          1HD2      LEU  17   4.515  13.212  -0.602
   88   HD22  LEU  17          2HD2      LEU  17   5.283  14.066  -1.941
   89   HD23  LEU  17          3HD2      LEU  17   6.179  12.835  -1.049
   90    H    CYS  18           H        CYS  18   3.877   9.154   1.223
   91    HA   CYS  18           HA       CYS  18   3.546   6.480   1.091
   92    HB2  CYS  18           1HB      CYS  18   2.894   7.547   3.093
   93    HB3  CYS  18           2HB      CYS  18   1.728   8.574   2.265
   94    H    ALA  19           H        ALA  19   1.615   5.127   0.693
   95    HA   ALA  19           HA       ALA  19   0.420   5.851  -1.878
   96    HB1  ALA  19           1HB      ALA  19   0.014   3.160  -0.697
   97    HB2  ALA  19           2HB      ALA  19   0.301   3.633  -2.372
   98    HB3  ALA  19           3HB      ALA  19   1.641   3.588  -1.226
   99    H    LEU  20           H        LEU  20  -0.483   4.795   1.375
  100    HA   LEU  20           HA       LEU  20  -3.219   4.507   1.034
  101    HB2  LEU  20           1HB      LEU  20  -1.423   5.096   3.300
  102    HB3  LEU  20           2HB      LEU  20  -3.121   5.507   3.532
  103    HG   LEU  20           HG       LEU  20  -3.450   3.014   2.677
  104   HD11  LEU  20          1HD1      LEU  20  -1.187   2.454   2.254
  105   HD12  LEU  20          2HD1      LEU  20  -1.652   1.611   3.731
  106   HD13  LEU  20          3HD1      LEU  20  -0.669   3.072   3.822
  107   HD21  LEU  20          1HD2      LEU  20  -3.183   2.360   5.173
  108   HD22  LEU  20          2HD2      LEU  20  -4.388   3.565   4.718
  109   HD23  LEU  20          3HD2      LEU  20  -2.845   4.075   5.407
  110    H    CYS  21           H        CYS  21  -1.836   7.339   2.683
  111    HA   CYS  21           HA       CYS  21  -4.100   8.945   1.888
  112    HB2  CYS  21           1HB      CYS  21  -2.948  10.731   3.205
  113    HB3  CYS  21           2HB      CYS  21  -3.252   9.258   4.120
  114    H    GLY  22           H        GLY  22  -0.574   9.081   1.381
  115    HA2  GLY  22           1HA      GLY  22   0.346   9.554  -0.787
  116    HA3  GLY  22           2HA      GLY  22  -1.097  10.491  -1.150
  117    H    GLU  23           H        GLU  23   0.934  10.627   1.748
  118    HA   GLU  23           HA       GLU  23   1.416  13.468   1.155
  119    HB2  GLU  23           1HB      GLU  23   1.455  12.000   3.797
  120    HB3  GLU  23           2HB      GLU  23   1.834  13.704   3.590
  121    HG2  GLU  23           1HG      GLU  23  -0.458  14.038   2.684
  122    HG3  GLU  23           2HG      GLU  23  -0.811  12.361   3.096
  123    H    HIS  24           H        HIS  24   3.509  14.261   2.323
  124    HA   HIS  24           HA       HIS  24   5.700  13.140   1.005
  125    HB2  HIS  24           1HB      HIS  24   5.327  15.482   2.198
  126    HB3  HIS  24           2HB      HIS  24   6.148  14.670   3.528
  127    HD1  HIS  24           1HD      HIS  24   6.748  16.314   0.298
  128    HD2  HIS  24           2HD      HIS  24   8.834  13.834   2.898
  129    HE1  HIS  24           1HE      HIS  24   9.157  16.474  -0.407
  130    H    LEU  25           H        LEU  25   7.402  11.843   1.669
  131    HA   LEU  25           HA       LEU  25   6.881  10.263   4.099
  132    HB2  LEU  25           1HB      LEU  25   8.172   9.542   1.484
  133    HB3  LEU  25           2HB      LEU  25   8.355   8.548   2.929
  134    HG   LEU  25           HG       LEU  25   5.656   9.224   1.788
  135   HD11  LEU  25          1HD1      LEU  25   7.685   7.387   0.755
  136   HD12  LEU  25          2HD1      LEU  25   6.237   8.035  -0.016
  137   HD13  LEU  25          3HD1      LEU  25   6.116   6.639   1.055
  138   HD21  LEU  25          1HD2      LEU  25   4.898   7.381   3.077
  139   HD22  LEU  25          2HD2      LEU  25   5.907   8.364   4.138
  140   HD23  LEU  25          3HD2      LEU  25   6.546   6.873   3.444
  141    H    TYR  26           H        TYR  26   8.606   9.715   5.457
  142    HA   TYR  26           HA       TYR  26  10.940  11.483   5.192
  143    HB2  TYR  26           1HB      TYR  26   9.410  11.630   7.235
  144    HB3  TYR  26           2HB      TYR  26  10.068  10.067   7.708
  145    HD1  TYR  26           1HD      TYR  26  11.735  13.054   6.215
  146    HD2  TYR  26           2HD      TYR  26  11.414  10.444   9.559
  147    HE1  TYR  26           1HE      TYR  26  13.645  14.185   7.273
  148    HE2  TYR  26           2HE      TYR  26  13.322  11.569  10.628
  149    HH   TYR  26           HH       TYR  26  15.302  12.919   9.906
  150    H    VAL  27           H        VAL  27  12.963  10.572   6.272
  151    HA   VAL  27           HA       VAL  27  13.631   8.118   4.956
  152    HB   VAL  27           HB       VAL  27  15.857   8.416   6.051
  153   HG11  VAL  27          1HG1      VAL  27  14.724   9.805   3.959
  154   HG12  VAL  27          2HG1      VAL  27  15.462  11.075   4.937
  155   HG13  VAL  27          3HG1      VAL  27  16.443   9.734   4.346
  156   HG21  VAL  27          1HG2      VAL  27  15.860   9.574   7.963
  157   HG22  VAL  27          2HG2      VAL  27  15.816  11.016   6.948
  158   HG23  VAL  27          3HG2      VAL  27  14.318  10.349   7.597
  159    H    LEU  28           H        LEU  28  12.466   8.956   8.068
  160    HA   LEU  28           HA       LEU  28  13.094   6.250   9.051
  161    HB2  LEU  28           1HB      LEU  28  12.769   8.836  10.555
  162    HB3  LEU  28           2HB      LEU  28  12.789   7.258  11.340
  163    HG   LEU  28           HG       LEU  28  15.068   8.351   9.695
  164   HD11  LEU  28          1HD1      LEU  28  15.744   9.551  11.430
  165   HD12  LEU  28          2HD1      LEU  28  15.617   8.154  12.498
  166   HD13  LEU  28          3HD1      LEU  28  14.216   9.192  12.235
  167   HD21  LEU  28          1HD2      LEU  28  14.996   6.080  11.675
  168   HD22  LEU  28          2HD2      LEU  28  16.342   6.558  10.641
  169   HD23  LEU  28          3HD2      LEU  28  14.880   5.877   9.927
  170    H    GLU  29           H        GLU  29  10.738   7.585   7.542
  171    HA   GLU  29           HA       GLU  29   8.648   6.474   9.295
  172    HB2  GLU  29           1HB      GLU  29   8.444   8.906   7.510
  173    HB3  GLU  29           2HB      GLU  29   7.087   8.161   8.344
  174    HG2  GLU  29           1HG      GLU  29   9.502   9.202   9.790
  175    HG3  GLU  29           2HG      GLU  29   8.098  10.204   9.425
  176    H    ARG  30           H        ARG  30   9.980   6.812   6.109
  177    HA   ARG  30           HA       ARG  30   7.815   5.650   4.676
  178    HB2  ARG  30           1HB      ARG  30   9.203   5.717   2.798
  179    HB3  ARG  30           2HB      ARG  30   9.779   7.059   3.777
  180    HG2  ARG  30           1HG      ARG  30  11.587   5.598   4.633
  181    HG3  ARG  30           2HG      ARG  30  11.041   4.340   3.522
  182    HD2  ARG  30           1HD      ARG  30  11.287   6.275   1.751
  183    HD3  ARG  30           2HD      ARG  30  12.401   6.927   2.952
  184    HE   ARG  30           HE       ARG  30  12.833   4.670   1.243
  185   HH11  ARG  30          2HH1      ARG  30  13.653   6.106   4.307
  186   HH12  ARG  30          1HH1      ARG  30  15.177   5.291   4.428
  187   HH21  ARG  30          2HH2      ARG  30  14.838   3.592   1.391
  188   HH22  ARG  30          1HH2      ARG  30  15.851   3.862   2.769
  189    H    LEU  31           H        LEU  31   7.413   3.562   4.112
  190    HA   LEU  31           HA       LEU  31   9.164   1.514   5.305
  191    HB2  LEU  31           1HB      LEU  31   6.214   1.808   5.211
  192    HB3  LEU  31           2HB      LEU  31   6.872   0.179   5.075
  193    HG   LEU  31           HG       LEU  31   8.012   0.482   7.237
  194   HD11  LEU  31          1HD1      LEU  31   7.542   3.188   6.777
  195   HD12  LEU  31          2HD1      LEU  31   8.229   2.456   8.227
  196   HD13  LEU  31          3HD1      LEU  31   6.495   2.763   8.132
  197   HD21  LEU  31          1HD2      LEU  31   6.138   0.060   8.544
  198   HD22  LEU  31          2HD2      LEU  31   5.599  -0.370   6.920
  199   HD23  LEU  31          3HD2      LEU  31   5.124   1.176   7.627
  200    H    CYS  32           H        CYS  32  10.343   0.666   3.710
  201    HA   CYS  32           HA       CYS  32   9.505   0.562   0.997
  202    HB2  CYS  32           1HB      CYS  32  11.548  -0.854   0.690
  203    HB3  CYS  32           2HB      CYS  32  11.856   0.687   1.482
  204    HG   CYS  32           HG       CYS  32  12.289  -2.424   2.625
  205    H    VAL  33           H        VAL  33   7.738  -0.628   0.547
  206    HA   VAL  33           HA       VAL  33   7.817  -3.479   1.286
  207    HB   VAL  33           HB       VAL  33   5.353  -1.739   1.110
  208   HG11  VAL  33          1HG1      VAL  33   4.042  -3.584   1.298
  209   HG12  VAL  33          2HG1      VAL  33   5.400  -4.320   0.444
  210   HG13  VAL  33          3HG1      VAL  33   5.258  -4.494   2.194
  211   HG21  VAL  33          1HG2      VAL  33   5.933  -3.162   3.601
  212   HG22  VAL  33          2HG2      VAL  33   7.110  -1.913   3.194
  213   HG23  VAL  33          3HG2      VAL  33   5.402  -1.500   3.340
  214    H    ASN  34           H        ASN  34   8.578  -4.250  -0.642
  215    HA   ASN  34           HA       ASN  34   8.492  -5.010  -2.784
  216    HB2  ASN  34           1HB      ASN  34   5.611  -4.088  -2.668
  217    HB3  ASN  34           2HB      ASN  34   6.300  -5.149  -3.893
  218   HD21  ASN  34          1HD2      ASN  34   4.980  -6.865  -3.440
  219   HD22  ASN  34          2HD2      ASN  34   5.091  -7.781  -1.979
  220    H    GLY  35           H        GLY  35   9.164  -2.202  -2.133
  221    HA2  GLY  35           1HA      GLY  35  10.141  -0.710  -3.731
  222    HA3  GLY  35           2HA      GLY  35   8.867  -1.143  -4.861
  223    H    HIS  36           H        HIS  36   6.707  -0.865  -2.972
  224    HA   HIS  36           HA       HIS  36   6.343   1.983  -3.191
  225    HB2  HIS  36           1HB      HIS  36   4.496   0.008  -1.847
  226    HB3  HIS  36           2HB      HIS  36   4.084   1.587  -2.509
  227    HD1  HIS  36           1HD      HIS  36   5.097   1.503  -5.300
  228    HD2  HIS  36           2HD      HIS  36   3.366  -1.810  -3.486
  229    HE1  HIS  36           1HE      HIS  36   4.303   0.042  -7.186
  230    H    PHE  37           H        PHE  37   5.876   3.415  -1.468
  231    HA   PHE  37           HA       PHE  37   7.063   2.580   1.094
  232    HB2  PHE  37           1HB      PHE  37   6.917   5.311  -0.195
  233    HB3  PHE  37           2HB      PHE  37   7.496   5.025   1.443
  234    HD1  PHE  37           2HD      PHE  37   9.400   3.203   1.620
  235    HD2  PHE  37           1HD      PHE  37   8.453   5.410  -1.894
  236    HE1  PHE  37           2HE      PHE  37  11.660   2.775   0.747
  237    HE2  PHE  37           1HE      PHE  37  10.712   4.985  -2.774
  238    HZ   PHE  37           HZ       PHE  37  12.319   3.667  -1.452
  239    H    PHE  38           H        PHE  38   5.981   2.920   2.982
  240    HA   PHE  38           HA       PHE  38   3.377   4.271   2.852
  241    HB2  PHE  38           1HB      PHE  38   3.877   1.587   4.156
  242    HB3  PHE  38           2HB      PHE  38   2.365   2.487   4.212
  243    HD1  PHE  38           1HD      PHE  38   4.634   0.551   2.073
  244    HD2  PHE  38           2HD      PHE  38   0.869   2.518   2.350
  245    HE1  PHE  38           1HE      PHE  38   3.911  -0.547  -0.007
  246    HE2  PHE  38           2HE      PHE  38   0.140   1.422   0.271
  247    HZ   PHE  38           HZ       PHE  38   1.661  -0.113  -0.910
  248    H    HIS  39           H        HIS  39   2.634   5.143   4.829
  249    HA   HIS  39           HA       HIS  39   4.728   6.068   6.541
  250    HB2  HIS  39           1HB      HIS  39   1.727   6.406   6.638
  251    HB3  HIS  39           2HB      HIS  39   2.826   7.162   7.788
  252    HD2  HIS  39           2HD      HIS  39   4.999   8.558   5.985
  253    HE1  HIS  39           1HE      HIS  39   1.791  10.049   3.642
  254    HE2  HIS  39           2HE      HIS  39   4.248  10.236   4.165
  255    H    ARG  40           H        ARG  40   5.320   5.384   8.520
  256    HA   ARG  40           HA       ARG  40   4.974   2.851   9.424
  257    HB2  ARG  40           1HB      ARG  40   5.457   5.394  10.961
  258    HB3  ARG  40           2HB      ARG  40   5.425   3.827  11.758
  259    HG2  ARG  40           1HG      ARG  40   7.330   3.081  10.621
  260    HG3  ARG  40           2HG      ARG  40   7.219   4.369   9.419
  261    HD2  ARG  40           1HD      ARG  40   8.915   5.153  10.762
  262    HD3  ARG  40           2HD      ARG  40   7.511   5.931  11.491
  263    HE   ARG  40           HE       ARG  40   7.792   4.629  13.368
  264   HH11  ARG  40          2HH1      ARG  40   9.824   3.451  10.798
  265   HH12  ARG  40          1HH1      ARG  40  10.712   2.370  11.820
  266   HH21  ARG  40          2HH2      ARG  40   8.955   3.210  14.724
  267   HH22  ARG  40          1HH2      ARG  40  10.216   2.233  14.052
  268    H    SER  41           H        SER  41   2.800   5.554   9.895
  269    HA   SER  41           HA       SER  41   1.132   4.151  11.783
  270    HB2  SER  41           1HB      SER  41  -0.325   6.121  11.635
  271    HB3  SER  41           2HB      SER  41   1.354   6.603  11.878
  272    HG   SER  41           HG       SER  41   0.575   7.871  10.253
  273    H    CYS  42           H        CYS  42   0.605   5.406   8.484
  274    HA   CYS  42           HA       CYS  42  -1.856   4.341   7.957
  275    HB2  CYS  42           1HB      CYS  42   0.522   4.905   6.233
  276    HB3  CYS  42           2HB      CYS  42  -0.861   4.073   5.528
  277    H    PHE  43           H        PHE  43   1.256   2.738   7.277
  278    HA   PHE  43           HA       PHE  43   0.355   0.347   6.292
  279    HB2  PHE  43           1HB      PHE  43   2.770   1.168   6.654
  280    HB3  PHE  43           2HB      PHE  43   2.634   0.450   8.256
  281    HD1  PHE  43           2HD      PHE  43   1.664  -0.593   4.802
  282    HD2  PHE  43           1HD      PHE  43   3.708  -1.562   8.408
  283    HE1  PHE  43           2HE      PHE  43   2.272  -2.785   3.865
  284    HE2  PHE  43           1HE      PHE  43   4.319  -3.755   7.476
  285    HZ   PHE  43           HZ       PHE  43   3.600  -4.370   5.202
  286    H    ARG  44           H        ARG  44  -1.467  -0.513   7.189
  287    HA   ARG  44           HA       ARG  44  -1.132  -1.765   9.809
  288    HB2  ARG  44           1HB      ARG  44  -3.542  -0.104   9.046
  289    HB3  ARG  44           2HB      ARG  44  -3.400  -1.082  10.501
  290    HG2  ARG  44           1HG      ARG  44  -1.813   0.338  11.448
  291    HG3  ARG  44           2HG      ARG  44  -1.434   1.094   9.899
  292    HD2  ARG  44           1HD      ARG  44  -3.664   2.110   9.858
  293    HD3  ARG  44           2HD      ARG  44  -4.029   1.362  11.412
  294    HE   ARG  44           HE       ARG  44  -2.178   3.580  10.938
  295   HH11  ARG  44          2HH1      ARG  44  -3.776   1.414  13.147
  296   HH12  ARG  44          1HH1      ARG  44  -3.396   2.357  14.550
  297   HH21  ARG  44          2HH2      ARG  44  -1.672   4.829  12.778
  298   HH22  ARG  44          1HH2      ARG  44  -2.201   4.299  14.339
  299    H    CYS  45           H        CYS  45  -3.035  -3.302  10.233
  300    HA   CYS  45           HA       CYS  45  -3.107  -5.246   8.249
  301    HB2  CYS  45           1HB      CYS  45  -3.616  -5.586  10.682
  302    HB3  CYS  45           2HB      CYS  45  -5.192  -4.852  10.402
  303    H    HIS  46           H        HIS  46  -5.079  -6.110   7.161
  304    HA   HIS  46           HA       HIS  46  -6.573  -3.888   5.954
  305    HB2  HIS  46           1HB      HIS  46  -5.287  -5.224   4.374
  306    HB3  HIS  46           2HB      HIS  46  -6.068  -6.695   4.945
  307    HD1  HIS  46           1HD      HIS  46  -6.499  -3.860   2.626
  308    HD2  HIS  46           2HD      HIS  46  -8.812  -6.948   4.166
  309    HE1  HIS  46           1HE      HIS  46  -8.538  -3.969   1.158
  310    H    THR  47           H        THR  47  -6.983  -5.987   8.374
  311    HA   THR  47           HA       THR  47  -9.868  -6.286   7.845
  312    HB   THR  47           HB       THR  47  -7.980  -8.204   9.198
  313    HG1  THR  47           1HG      THR  47  -9.743  -8.274   6.983
  314   HG21  THR  47          1HG2      THR  47 -10.998  -8.299   9.277
  315   HG22  THR  47          2HG2      THR  47  -9.965  -7.868  10.640
  316   HG23  THR  47          3HG2      THR  47  -9.889  -9.490   9.954
  317    H    CYS  48           H        CYS  48  -7.346  -5.638  10.204
  318    HA   CYS  48           HA       CYS  48  -9.406  -4.566  12.020
  319    HB2  CYS  48           1HB      CYS  48  -7.819  -5.070  13.882
  320    HB3  CYS  48           2HB      CYS  48  -8.417  -6.504  13.055
  321    H    GLU  49           H        GLU  49  -6.916  -3.792   9.983
  322    HA   GLU  49           HA       GLU  49  -5.596  -1.962   9.665
  323    HB2  GLU  49           1HB      GLU  49  -7.666  -0.576  11.374
  324    HB3  GLU  49           2HB      GLU  49  -6.579   0.182  10.219
  325    HG2  GLU  49           1HG      GLU  49  -7.740  -0.631   8.392
  326    HG3  GLU  49           2HG      GLU  49  -8.500  -1.921   9.322
  327    H    ALA  50           H        ALA  50  -4.586  -3.552  11.610
  328    HA   ALA  50           HA       ALA  50  -3.865  -1.800  13.848
  329    HB1  ALA  50           1HB      ALA  50  -4.644  -4.005  14.469
  330    HB2  ALA  50           2HB      ALA  50  -3.416  -4.755  13.449
  331    HB3  ALA  50           3HB      ALA  50  -2.935  -3.836  14.876
  332    H    THR  51           H        THR  51  -1.897  -0.922  14.048
  333    HA   THR  51           HA       THR  51  -0.128  -0.532  12.046
  334    HB   THR  51           HB       THR  51   0.649  -0.864  14.951
  335    HG1  THR  51           1HG      THR  51  -0.986   0.699  14.664
  336   HG21  THR  51          1HG2      THR  51   2.712  -0.667  14.023
  337   HG22  THR  51          2HG2      THR  51   2.286   1.044  14.001
  338   HG23  THR  51          3HG2      THR  51   2.094   0.069  12.544
  339    H    LEU  52           H        LEU  52   0.612  -2.088  10.725
  340    HA   LEU  52           HA       LEU  52   1.356  -4.693  11.637
  341    HB2  LEU  52           1HB      LEU  52   1.864  -3.327   8.997
  342    HB3  LEU  52           2HB      LEU  52   2.110  -5.042   9.324
  343    HG   LEU  52           HG       LEU  52  -0.555  -3.629   9.421
  344   HD11  LEU  52          1HD1      LEU  52   0.731  -5.323   7.291
  345   HD12  LEU  52          2HD1      LEU  52   0.170  -3.657   7.155
  346   HD13  LEU  52          3HD1      LEU  52  -0.995  -4.967   7.351
  347   HD21  LEU  52          1HD2      LEU  52  -0.129  -5.712  10.858
  348   HD22  LEU  52          2HD2      LEU  52  -0.068  -6.588   9.328
  349   HD23  LEU  52          3HD2      LEU  52  -1.531  -5.716   9.789
  350    H    TRP  53           H        TRP  53   3.011  -4.581  13.105
  351    HA   TRP  53           HA       TRP  53   5.309  -2.975  12.844
  352    HB2  TRP  53           1HB      TRP  53   5.304  -5.595  14.320
  353    HB3  TRP  53           2HB      TRP  53   6.148  -4.102  14.724
  354    HD1  TRP  53           HD       TRP  53   2.812  -5.863  15.149
  355    HE1  TRP  53           1HE      TRP  53   1.354  -4.518  16.790
  356    HE3  TRP  53           3HE      TRP  53   5.699  -1.662  15.544
  357    HZ2  TRP  53           2HZ      TRP  53   1.419  -2.008  18.079
  358    HZ3  TRP  53           3HZ      TRP  53   4.930   0.165  17.001
  359    HH2  TRP  53           HH       TRP  53   2.834  -0.006  18.241
  360    HA   PRO  54           HA       PRO  54   7.863  -5.107   9.982
  361    HB2  PRO  54           1HB      PRO  54  10.328  -4.695  11.042
  362    HB3  PRO  54           2HB      PRO  54   9.393  -3.416  10.259
  363    HG2  PRO  54           1HG      PRO  54   9.719  -4.011  13.175
  364    HG3  PRO  54           2HG      PRO  54   9.743  -2.445  12.343
  365    HD2  PRO  54           1HD      PRO  54   7.568  -3.353  13.675
  366    HD3  PRO  54           2HD      PRO  54   7.444  -2.326  12.232
  367    H    GLY  55           H        GLY  55   7.025  -6.448  12.759
  368    HA2  GLY  55           1HA      GLY  55   8.549  -8.879  12.214
  369    HA3  GLY  55           2HA      GLY  55   8.706  -8.192  13.824
  370    H    GLY  56           H        GLY  56   5.707  -7.972  12.062
  371    HA2  GLY  56           1HA      GLY  56   4.562 -10.333  13.254
  372    HA3  GLY  56           2HA      GLY  56   4.035  -8.841  14.020
  373    H    TYR  57           H        TYR  57   4.660  -9.653  10.613
  374    HA   TYR  57           HA       TYR  57   1.857  -9.552   9.959
  375    HB2  TYR  57           1HB      TYR  57   1.770  -7.567   8.767
  376    HB3  TYR  57           2HB      TYR  57   2.801  -7.117  10.121
  377    HD1  TYR  57           2HD      TYR  57   5.344  -7.229   9.746
  378    HD2  TYR  57           1HD      TYR  57   2.509  -7.266   6.573
  379    HE1  TYR  57           2HE      TYR  57   7.099  -6.515   8.177
  380    HE2  TYR  57           1HE      TYR  57   4.256  -6.554   4.995
  381    HH   TYR  57           HH       TYR  57   6.981  -5.172   5.770
  382    H    GLU  58           H        GLU  58   1.540  -9.769   7.543
  383    HA   GLU  58           HA       GLU  58   3.754 -10.731   5.990
  384    HB2  GLU  58           1HB      GLU  58   1.832 -12.634   7.265
  385    HB3  GLU  58           2HB      GLU  58   2.448 -12.994   5.659
  386    HG2  GLU  58           1HG      GLU  58   4.768 -12.644   6.667
  387    HG3  GLU  58           2HG      GLU  58   3.962 -12.747   8.231
  388    H    GLN  59           H        GLN  59   3.181 -11.175   3.793
  389    HA   GLN  59           HA       GLN  59   0.632  -9.927   3.030
  390    HB2  GLN  59           1HB      GLN  59   2.638  -8.790   2.199
  391    HB3  GLN  59           2HB      GLN  59   3.172 -10.278   1.428
  392    HG2  GLN  59           1HG      GLN  59   1.212 -10.228  -0.028
  393    HG3  GLN  59           2HG      GLN  59   0.681  -8.734   0.742
  394   HE21  GLN  59          1HE2      GLN  59   0.951  -8.660  -1.892
  395   HE22  GLN  59          2HE2      GLN  59   2.365  -7.785  -2.361
  396    H    HIS  60           H        HIS  60  -0.867 -11.458   2.743
  397    HA   HIS  60           HA       HIS  60  -0.391 -14.125   2.034
  398    HB2  HIS  60           1HB      HIS  60  -2.502 -13.049   3.059
  399    HB3  HIS  60           2HB      HIS  60  -2.962 -12.696   1.396
  400    HD1  HIS  60           1HD      HIS  60  -3.954 -14.577   0.046
  401    HD2  HIS  60           2HD      HIS  60  -2.356 -15.858   3.661
  402    HE1  HIS  60           1HE      HIS  60  -4.675 -16.974   0.288
  403    HA   PRO  61           HA       PRO  61   0.551 -13.585  -2.281
  404    HB2  PRO  61           1HB      PRO  61   0.757 -16.229  -2.861
  405    HB3  PRO  61           2HB      PRO  61   2.022 -15.330  -2.015
  406    HG2  PRO  61           1HG      PRO  61  -0.100 -17.121  -0.896
  407    HG3  PRO  61           2HG      PRO  61   1.617 -17.015  -0.465
  408    HD2  PRO  61           1HD      PRO  61  -0.332 -15.856   1.015
  409    HD3  PRO  61           2HD      PRO  61   1.297 -15.163   0.870
  410    H    GLY  62           H        GLY  62  -1.817 -16.033  -1.225
  411    HA2  GLY  62           1HA      GLY  62  -3.169 -16.707  -3.424
  412    HA3  GLY  62           2HA      GLY  62  -4.018 -16.277  -1.947
  413    H    ASP  63           H        ASP  63  -3.889 -13.660  -1.715
  414    HA   ASP  63           HA       ASP  63  -5.267 -12.706  -4.117
  415    HB2  ASP  63           1HB      ASP  63  -5.166 -11.355  -1.419
  416    HB3  ASP  63           2HB      ASP  63  -6.303 -11.059  -2.731
  417    H    GLY  64           H        GLY  64  -3.156 -11.213  -1.651
  418    HA2  GLY  64           1HA      GLY  64  -0.947 -10.418  -2.613
  419    HA3  GLY  64           2HA      GLY  64  -1.943  -9.628  -3.826
  420    H    HIS  65           H        HIS  65  -2.722  -9.861  -0.403
  421    HA   HIS  65           HA       HIS  65  -2.312  -6.951  -0.183
  422    HB2  HIS  65           1HB      HIS  65  -4.613  -8.667   0.632
  423    HB3  HIS  65           2HB      HIS  65  -4.212  -7.280   1.641
  424    HD1  HIS  65           1HD      HIS  65  -5.253  -5.141   0.957
  425    HD2  HIS  65           2HD      HIS  65  -5.048  -7.842  -2.193
  426    HE1  HIS  65           1HE      HIS  65  -6.446  -4.031  -0.958
  427    H    PHE  66           H        PHE  66  -2.303  -6.296   2.245
  428    HA   PHE  66           HA       PHE  66  -0.435  -8.114   3.609
  429    HB2  PHE  66           1HB      PHE  66  -0.771  -5.116   3.785
  430    HB3  PHE  66           2HB      PHE  66   0.270  -6.043   4.860
  431    HD1  PHE  66           1HD      PHE  66   2.289  -7.128   4.004
  432    HD2  PHE  66           2HD      PHE  66  -0.144  -4.669   1.524
  433    HE1  PHE  66           1HE      PHE  66   4.121  -6.970   2.368
  434    HE2  PHE  66           2HE      PHE  66   1.683  -4.508  -0.115
  435    HZ   PHE  66           HZ       PHE  66   3.818  -5.660   0.305
  436    H    TYR  67           H        TYR  67  -1.050  -9.054   5.439
  437    HA   TYR  67           HA       TYR  67  -3.166  -7.804   7.047
  438    HB2  TYR  67           1HB      TYR  67  -3.069 -10.763   6.439
  439    HB3  TYR  67           2HB      TYR  67  -4.315  -9.902   7.336
  440    HD1  TYR  67           2HD      TYR  67  -2.901 -10.513   3.993
  441    HD2  TYR  67           1HD      TYR  67  -6.052  -8.699   6.201
  442    HE1  TYR  67           2HE      TYR  67  -4.165 -10.185   1.909
  443    HE2  TYR  67           1HE      TYR  67  -7.326  -8.367   4.123
  444    HH   TYR  67           HH       TYR  67  -6.840  -8.164   1.679
  445    H    CYS  68           H        CYS  68  -3.297  -8.742   9.259
  446    HA   CYS  68           HA       CYS  68  -0.675  -8.875  10.402
  447    HB2  CYS  68           1HB      CYS  68  -1.831  -8.981  12.547
  448    HB3  CYS  68           2HB      CYS  68  -2.545  -7.731  11.534
  449    H    LEU  69           H        LEU  69  -0.207 -10.587  12.113
  450    HA   LEU  69           HA       LEU  69  -0.284 -13.154  10.825
  451    HB2  LEU  69           1HB      LEU  69   0.751 -12.462  13.568
  452    HB3  LEU  69           2HB      LEU  69   1.128 -13.903  12.625
  453    HG   LEU  69           HG       LEU  69   2.010 -11.074  12.071
  454   HD11  LEU  69          1HD1      LEU  69   3.300 -12.134  13.796
  455   HD12  LEU  69          2HD1      LEU  69   4.259 -12.083  12.317
  456   HD13  LEU  69          3HD1      LEU  69   3.490 -13.590  12.818
  457   HD21  LEU  69          1HD2      LEU  69   2.647 -13.524  10.441
  458   HD22  LEU  69          2HD2      LEU  69   3.065 -11.847  10.088
  459   HD23  LEU  69          3HD2      LEU  69   1.382 -12.372  10.011
  460    H    GLN  70           H        GLN  70  -2.714 -11.743  12.159
  461    HA   GLN  70           HA       GLN  70  -3.627 -14.123  13.635
  462    HB2  GLN  70           1HB      GLN  70  -3.316 -12.179  15.125
  463    HB3  GLN  70           2HB      GLN  70  -4.434 -11.253  14.133
  464    HG2  GLN  70           1HG      GLN  70  -5.802 -11.924  15.835
  465    HG3  GLN  70           2HG      GLN  70  -6.075 -13.207  14.656
  466   HE21  GLN  70          1HE2      GLN  70  -6.745 -13.788  17.138
  467   HE22  GLN  70          2HE2      GLN  70  -5.602 -14.847  17.883
  468    H    HIS  71           H        HIS  71  -4.178 -11.897  11.095
  469    HA   HIS  71           HA       HIS  71  -6.862 -13.026  10.644
  470    HB2  HIS  71           1HB      HIS  71  -5.709 -10.318  10.064
  471    HB3  HIS  71           2HB      HIS  71  -7.054 -10.926   9.104
  472    HD2  HIS  71           2HD      HIS  71  -8.027 -12.276  12.317
  473    HE1  HIS  71           1HE      HIS  71  -9.267  -8.227  12.577
  474    HE2  HIS  71           2HE      HIS  71  -9.403 -10.516  13.620
  475    H    LEU  72           H        LEU  72  -3.676 -12.702   9.432
  476    HA   LEU  72           HA       LEU  72  -3.895 -12.866   6.713
  477    HB2  LEU  72           1HB      LEU  72  -1.789 -12.831   8.057
  478    HB3  LEU  72           2HB      LEU  72  -2.019 -14.552   8.362
  479    HG   LEU  72           HG       LEU  72  -2.052 -14.659   5.722
  480   HD11  LEU  72          1HD1      LEU  72  -1.768 -12.585   4.887
  481   HD12  LEU  72          2HD1      LEU  72  -0.064 -12.932   5.183
  482   HD13  LEU  72          3HD1      LEU  72  -0.987 -11.983   6.349
  483   HD21  LEU  72          1HD2      LEU  72  -0.232 -15.845   6.163
  484   HD22  LEU  72          2HD2      LEU  72  -0.143 -15.100   7.759
  485   HD23  LEU  72          3HD2      LEU  72   0.702 -14.366   6.395
  486    HA   PRO  73           HA       PRO  73  -6.367 -16.559   6.236
  487    HB2  PRO  73           1HB      PRO  73  -6.542 -16.399   3.532
  488    HB3  PRO  73           2HB      PRO  73  -7.518 -15.403   4.618
  489    HG2  PRO  73           1HG      PRO  73  -5.006 -14.701   3.148
  490    HG3  PRO  73           2HG      PRO  73  -6.481 -13.740   3.366
  491    HD2  PRO  73           1HD      PRO  73  -4.249 -13.338   4.844
  492    HD3  PRO  73           2HD      PRO  73  -5.882 -13.070   5.488
  493    H    GLN  74           H        GLN  74  -6.214 -18.429   4.523
  494    HA   GLN  74           HA       GLN  74  -3.496 -19.021   3.700
  495    HB2  GLN  74           1HB      GLN  74  -4.836 -20.321   6.008
  496    HB3  GLN  74           2HB      GLN  74  -3.948 -21.370   4.912
  497    HG2  GLN  74           1HG      GLN  74  -2.752 -18.920   6.173
  498    HG3  GLN  74           2HG      GLN  74  -2.673 -20.524   6.901
  499   HE21  GLN  74          1HE2      GLN  74  -0.388 -19.155   6.297
  500   HE22  GLN  74          2HE2      GLN  74   0.427 -19.926   4.983
  501    H    THR  75           H        THR  75  -3.677 -19.766   1.704
  502    HA   THR  75           HA       THR  75  -6.159 -21.019   0.835
  503    HB   THR  75           HB       THR  75  -5.170 -19.262  -0.578
  504    HG1  THR  75           1HG      THR  75  -5.281 -21.900  -1.635
  505   HG21  THR  75          1HG2      THR  75  -2.934 -19.216  -0.719
  506   HG22  THR  75          2HG2      THR  75  -3.099 -20.493  -1.924
  507   HG23  THR  75          3HG2      THR  75  -2.788 -20.905  -0.238
  508    H    ASP  76           H        ASP  76  -6.299 -23.069  -0.070
  509    HA   ASP  76           HA       ASP  76  -4.285 -24.942   0.859
  510    HB2  ASP  76           1HB      ASP  76  -5.904 -26.673   0.169
  511    HB3  ASP  76           2HB      ASP  76  -6.631 -25.483   1.244
  512    H    SER  77           H        SER  77  -2.545 -24.554  -0.523
  513    HA   SER  77           HA       SER  77  -2.968 -24.974  -3.388
  514    HB2  SER  77           1HB      SER  77  -0.654 -23.902  -1.779
  515    HB3  SER  77           2HB      SER  77  -0.488 -24.324  -3.483
  516    HG   SER  77           HG       SER  77  -2.060 -22.310  -2.296
  517    H    GLY  78           H        GLY  78  -3.330 -27.213  -3.397
  518    HA2  GLY  78           1HA      GLY  78  -1.467 -29.040  -2.202
  519    HA3  GLY  78           2HA      GLY  78  -2.789 -29.456  -3.282
  520    HA   PRO  79           HA       PRO  79   1.158 -30.226  -5.556
  521    HB2  PRO  79           1HB      PRO  79   0.345 -32.588  -6.620
  522    HB3  PRO  79           2HB      PRO  79   1.086 -32.460  -5.021
  523    HG2  PRO  79           1HG      PRO  79  -1.808 -32.677  -5.756
  524    HG3  PRO  79           2HG      PRO  79  -0.919 -33.494  -4.457
  525    HD2  PRO  79           1HD      PRO  79  -2.477 -31.325  -4.015
  526    HD3  PRO  79           2HD      PRO  79  -1.014 -31.659  -3.066
  527    H    SER  80           H        SER  80   1.130 -28.858  -7.244
  528    HA   SER  80           HA       SER  80  -1.110 -28.788  -9.080
  529    HB2  SER  80           1HB      SER  80   1.446 -27.196  -8.870
  530    HB3  SER  80           2HB      SER  80   0.315 -26.999 -10.209
  531    HG   SER  80           HG       SER  80   0.128 -25.628  -8.174
  532    H    SER  81           H        SER  81   2.401 -29.343  -9.357
  533    HA   SER  81           HA       SER  81   3.641 -30.545 -10.837
  534    HB2  SER  81           1HB      SER  81   2.178 -32.396 -10.050
  535    HB3  SER  81           2HB      SER  81   1.058 -32.035 -11.363
  536    HG   SER  81           HG       SER  81   2.787 -33.740 -11.648
  537    H    GLY  82           H        GLY  82   2.742 -28.126 -11.772
  538    HA2  GLY  82           1HA      GLY  82   2.971 -27.088 -13.857
  539    HA3  GLY  82           2HA      GLY  82   2.714 -28.642 -14.634
  Start of MODEL   18
    1    H1   GLY   1           H        GLY   1 -26.603  -0.534 -16.782
    2    HA2  GLY   1           1HA      GLY   1 -26.609   0.868 -14.595
    3    HA3  GLY   1           2HA      GLY   1 -25.087   0.030 -14.330
    4    H    SER   2           H        SER   2 -25.248   2.800 -14.438
    5    HA   SER   2           HA       SER   2 -23.381   3.333 -16.567
    6    HB2  SER   2           1HB      SER   2 -25.464   3.690 -17.777
    7    HB3  SER   2           2HB      SER   2 -26.051   4.759 -16.504
    8    HG   SER   2           HG       SER   2 -23.600   5.426 -17.602
    9    H    SER   3           H        SER   3 -21.816   4.331 -15.500
   10    HA   SER   3           HA       SER   3 -22.476   6.640 -13.836
   11    HB2  SER   3           1HB      SER   3 -22.232   4.510 -12.415
   12    HB3  SER   3           2HB      SER   3 -20.519   4.582 -12.825
   13    HG   SER   3           HG       SER   3 -20.548   6.746 -11.948
   14    H    GLY   4           H        GLY   4 -20.710   8.097 -13.513
   15    HA2  GLY   4           1HA      GLY   4 -18.563   7.732 -15.511
   16    HA3  GLY   4           2HA      GLY   4 -19.270   9.289 -15.109
   17    H    SER   5           H        SER   5 -16.671   9.320 -15.000
   18    HA   SER   5           HA       SER   5 -16.080   9.833 -12.265
   19    HB2  SER   5           1HB      SER   5 -14.371   8.188 -11.867
   20    HB3  SER   5           2HB      SER   5 -15.829   7.329 -12.365
   21    HG   SER   5           HG       SER   5 -14.902   7.319 -14.516
   22    H    SER   6           H        SER   6 -13.639  10.352 -12.032
   23    HA   SER   6           HA       SER   6 -12.960  12.088 -14.266
   24    HB2  SER   6           1HB      SER   6 -11.924  11.837 -11.443
   25    HB3  SER   6           2HB      SER   6 -11.142  12.868 -12.641
   26    HG   SER   6           HG       SER   6 -12.689  14.271 -12.414
   27    H    GLY   7           H        GLY   7 -10.491  12.303 -14.671
   28    HA2  GLY   7           1HA      GLY   7  -9.116   9.726 -14.577
   29    HA3  GLY   7           2HA      GLY   7  -9.473  10.380 -16.168
   30    H    GLN   8           H        GLN   8  -7.016   9.978 -14.200
   31    HA   GLN   8           HA       GLN   8  -5.865  12.654 -14.548
   32    HB2  GLN   8           1HB      GLN   8  -4.265  12.081 -12.878
   33    HB3  GLN   8           2HB      GLN   8  -5.834  11.558 -12.281
   34    HG2  GLN   8           1HG      GLN   8  -5.352   9.281 -12.787
   35    HG3  GLN   8           2HG      GLN   8  -3.878   9.728 -13.644
   36   HE21  GLN   8          1HE2      GLN   8  -2.103  10.530 -12.426
   37   HE22  GLN   8          2HE2      GLN   8  -1.928  10.126 -10.756
   38    H    HIS   9           H        HIS   9  -4.009  13.003 -15.708
   39    HA   HIS   9           HA       HIS   9  -3.035  10.718 -17.295
   40    HB2  HIS   9           1HB      HIS   9  -2.329  12.601 -18.928
   41    HB3  HIS   9           2HB      HIS   9  -4.028  12.141 -18.861
   42    HD1  HIS   9           1HD      HIS   9  -5.669  13.954 -18.343
   43    HD2  HIS   9           2HD      HIS   9  -1.757  15.069 -17.498
   44    HE1  HIS   9           1HE      HIS   9  -5.776  16.400 -17.769
   45    H    GLN  10           H        GLN  10  -2.101  13.750 -15.721
   46    HA   GLN  10           HA       GLN  10   0.516  14.018 -16.133
   47    HB2  GLN  10           1HB      GLN  10  -0.750  13.992 -13.388
   48    HB3  GLN  10           2HB      GLN  10   0.796  14.729 -13.786
   49    HG2  GLN  10           1HG      GLN  10  -1.801  15.541 -15.061
   50    HG3  GLN  10           2HG      GLN  10  -1.143  16.302 -13.613
   51   HE21  GLN  10          1HE2      GLN  10   0.596  17.663 -13.780
   52   HE22  GLN  10          2HE2      GLN  10   1.219  18.219 -15.292
   53    H    GLU  11           H        GLU  11   2.124  12.617 -16.324
   54    HA   GLU  11           HA       GLU  11   2.055   9.998 -15.237
   55    HB2  GLU  11           1HB      GLU  11   3.311  10.890 -17.323
   56    HB3  GLU  11           2HB      GLU  11   4.571  11.339 -16.182
   57    HG2  GLU  11           1HG      GLU  11   3.481   8.550 -16.324
   58    HG3  GLU  11           2HG      GLU  11   4.795   9.100 -17.364
   59    H    ALA  12           H        ALA  12   2.890   9.170 -13.408
   60    HA   ALA  12           HA       ALA  12   3.269  10.537 -11.118
   61    HB1  ALA  12           1HB      ALA  12   5.165   8.495 -10.918
   62    HB2  ALA  12           2HB      ALA  12   3.469   8.432 -10.438
   63    HB3  ALA  12           3HB      ALA  12   3.949   7.901 -12.049
   64    H    GLY  13           H        GLY  13   4.873  11.618 -10.043
   65    HA2  GLY  13           1HA      GLY  13   6.884  12.877 -11.608
   66    HA3  GLY  13           2HA      GLY  13   6.700  13.004  -9.865
   67    H    ALA  14           H        ALA  14   7.799  11.555  -8.513
   68    HA   ALA  14           HA       ALA  14  10.045  10.189  -9.833
   69    HB1  ALA  14           1HB      ALA  14  10.283  12.098  -8.027
   70    HB2  ALA  14           2HB      ALA  14  10.073  10.746  -6.914
   71    HB3  ALA  14           3HB      ALA  14  11.398  10.733  -8.077
   72    H    GLY  15           H        GLY  15   7.666   9.837  -7.219
   73    HA2  GLY  15           1HA      GLY  15   6.487   7.700  -7.068
   74    HA3  GLY  15           2HA      GLY  15   8.009   6.912  -7.456
   75    H    ASP  16           H        ASP  16   7.676   9.588  -5.207
   76    HA   ASP  16           HA       ASP  16   8.404   7.744  -3.026
   77    HB2  ASP  16           1HB      ASP  16   9.128  10.662  -3.369
   78    HB3  ASP  16           2HB      ASP  16   9.526   9.681  -1.961
   79    H    LEU  17           H        LEU  17   5.757   7.983  -3.565
   80    HA   LEU  17           HA       LEU  17   4.799   9.604  -1.305
   81    HB2  LEU  17           1HB      LEU  17   3.090   9.143  -3.713
   82    HB3  LEU  17           2HB      LEU  17   2.957  10.389  -2.475
   83    HG   LEU  17           HG       LEU  17   5.157  10.308  -4.534
   84   HD11  LEU  17          1HD1      LEU  17   3.722  11.064  -6.042
   85   HD12  LEU  17          2HD1      LEU  17   3.378  12.445  -5.001
   86   HD13  LEU  17          3HD1      LEU  17   2.405  10.980  -4.871
   87   HD21  LEU  17          1HD2      LEU  17   4.248  12.748  -3.093
   88   HD22  LEU  17          2HD2      LEU  17   5.843  12.333  -3.722
   89   HD23  LEU  17          3HD2      LEU  17   5.260  11.587  -2.233
   90    H    CYS  18           H        CYS  18   3.351   8.643   0.037
   91    HA   CYS  18           HA       CYS  18   3.238   5.976   0.435
   92    HB2  CYS  18           1HB      CYS  18   2.296   7.536   2.033
   93    HB3  CYS  18           2HB      CYS  18   1.007   7.961   0.911
   94    H    ALA  19           H        ALA  19   1.493   4.382   0.135
   95    HA   ALA  19           HA       ALA  19   0.479   4.512  -2.614
   96    HB1  ALA  19           1HB      ALA  19   1.942   2.590  -1.726
   97    HB2  ALA  19           2HB      ALA  19   0.475   2.045  -0.912
   98    HB3  ALA  19           3HB      ALA  19   0.508   2.185  -2.670
   99    H    LEU  20           H        LEU  20  -0.548   4.000   0.716
  100    HA   LEU  20           HA       LEU  20  -3.228   3.308   0.163
  101    HB2  LEU  20           1HB      LEU  20  -1.648   4.093   2.507
  102    HB3  LEU  20           2HB      LEU  20  -3.359   4.506   2.604
  103    HG   LEU  20           HG       LEU  20  -3.595   1.951   1.865
  104   HD11  LEU  20          1HD1      LEU  20  -1.930   0.570   2.927
  105   HD12  LEU  20          2HD1      LEU  20  -1.053   1.994   3.485
  106   HD13  LEU  20          3HD1      LEU  20  -1.147   1.636   1.760
  107   HD21  LEU  20          1HD2      LEU  20  -4.739   2.620   3.759
  108   HD22  LEU  20          2HD2      LEU  20  -3.282   3.210   4.559
  109   HD23  LEU  20          3HD2      LEU  20  -3.569   1.475   4.418
  110    H    CYS  21           H        CYS  21  -1.970   6.390   1.456
  111    HA   CYS  21           HA       CYS  21  -4.379   7.756   0.595
  112    HB2  CYS  21           1HB      CYS  21  -3.359   9.729   1.702
  113    HB3  CYS  21           2HB      CYS  21  -3.474   8.333   2.769
  114    H    GLY  22           H        GLY  22  -0.882   7.986  -0.035
  115    HA2  GLY  22           1HA      GLY  22   0.022   8.326  -2.207
  116    HA3  GLY  22           2HA      GLY  22  -1.512   9.024  -2.706
  117    H    GLU  23           H        GLU  23   0.152   9.909   0.251
  118    HA   GLU  23           HA       GLU  23   0.442  12.627  -0.813
  119    HB2  GLU  23           1HB      GLU  23   0.295  11.539   1.993
  120    HB3  GLU  23           2HB      GLU  23   0.801  13.188   1.655
  121    HG2  GLU  23           1HG      GLU  23  -1.756  12.248   0.482
  122    HG3  GLU  23           2HG      GLU  23  -1.703  12.579   2.212
  123    H    HIS  24           H        HIS  24   2.345  13.777   0.571
  124    HA   HIS  24           HA       HIS  24   4.742  12.747  -0.520
  125    HB2  HIS  24           1HB      HIS  24   4.080  15.191   0.163
  126    HB3  HIS  24           2HB      HIS  24   4.748  14.731   1.726
  127    HD1  HIS  24           1HD      HIS  24   7.323  13.812   1.583
  128    HD2  HIS  24           2HD      HIS  24   5.930  16.074  -1.611
  129    HE1  HIS  24           1HE      HIS  24   9.380  14.595   0.366
  130    H    LEU  25           H        LEU  25   6.494  11.749   0.439
  131    HA   LEU  25           HA       LEU  25   5.975  10.579   3.092
  132    HB2  LEU  25           1HB      LEU  25   7.497   9.512   0.726
  133    HB3  LEU  25           2HB      LEU  25   7.587   8.794   2.333
  134    HG   LEU  25           HG       LEU  25   4.970   9.099   0.891
  135   HD11  LEU  25          1HD1      LEU  25   6.876   6.769   0.723
  136   HD12  LEU  25          2HD1      LEU  25   6.459   7.866  -0.593
  137   HD13  LEU  25          3HD1      LEU  25   5.228   6.806   0.095
  138   HD21  LEU  25          1HD2      LEU  25   5.985   7.399   3.157
  139   HD22  LEU  25          2HD2      LEU  25   4.454   7.099   2.336
  140   HD23  LEU  25          3HD2      LEU  25   4.711   8.617   3.196
  141    H    TYR  26           H        TYR  26   7.627  10.506   4.609
  142    HA   TYR  26           HA       TYR  26   9.840  12.366   4.088
  143    HB2  TYR  26           1HB      TYR  26   8.208  12.779   6.001
  144    HB3  TYR  26           2HB      TYR  26   8.929  11.380   6.790
  145    HD1  TYR  26           1HD      TYR  26  10.409  14.232   4.878
  146    HD2  TYR  26           2HD      TYR  26  10.232  12.099   8.555
  147    HE1  TYR  26           1HE      TYR  26  12.184  15.669   5.790
  148    HE2  TYR  26           2HE      TYR  26  12.006  13.531   9.478
  149    HH   TYR  26           HH       TYR  26  13.639  15.948   7.485
  150    H    VAL  27           H        VAL  27  11.959  11.822   4.560
  151    HA   VAL  27           HA       VAL  27  12.934   9.374   3.955
  152    HB   VAL  27           HB       VAL  27  14.350  11.363   4.283
  153   HG11  VAL  27          1HG1      VAL  27  14.587  12.436   6.232
  154   HG12  VAL  27          2HG1      VAL  27  13.161  11.533   6.747
  155   HG13  VAL  27          3HG1      VAL  27  14.774  10.935   7.139
  156   HG21  VAL  27          1HG2      VAL  27  16.001   9.880   4.239
  157   HG22  VAL  27          2HG2      VAL  27  15.927   9.769   5.997
  158   HG23  VAL  27          3HG2      VAL  27  14.971   8.670   5.003
  159    H    LEU  28           H        LEU  28  11.514  10.328   6.979
  160    HA   LEU  28           HA       LEU  28  12.284   7.779   8.211
  161    HB2  LEU  28           1HB      LEU  28  11.076  10.275   9.390
  162    HB3  LEU  28           2HB      LEU  28  11.391   8.797  10.298
  163    HG   LEU  28           HG       LEU  28  13.506  10.477   8.952
  164   HD11  LEU  28          1HD1      LEU  28  12.586  10.352  11.816
  165   HD12  LEU  28          2HD1      LEU  28  12.597  11.754  10.745
  166   HD13  LEU  28          3HD1      LEU  28  14.119  11.061  11.305
  167   HD21  LEU  28          1HD2      LEU  28  15.016   9.109  10.404
  168   HD22  LEU  28          2HD2      LEU  28  14.227   8.209   9.108
  169   HD23  LEU  28          3HD2      LEU  28  13.633   8.074  10.764
  170    H    GLU  29           H        GLU  29   9.418   9.830   7.704
  171    HA   GLU  29           HA       GLU  29   7.597   7.778   8.523
  172    HB2  GLU  29           1HB      GLU  29   6.877  10.200   6.887
  173    HB3  GLU  29           2HB      GLU  29   5.867   9.310   8.018
  174    HG2  GLU  29           1HG      GLU  29   7.645  10.069   9.765
  175    HG3  GLU  29           2HG      GLU  29   8.018  11.299   8.559
  176    H    ARG  30           H        ARG  30   9.015   6.427   6.808
  177    HA   ARG  30           HA       ARG  30   7.179   5.938   4.613
  178    HB2  ARG  30           1HB      ARG  30   8.755   6.126   2.860
  179    HB3  ARG  30           2HB      ARG  30   8.932   7.594   3.813
  180    HG2  ARG  30           1HG      ARG  30  10.874   6.551   4.955
  181    HG3  ARG  30           2HG      ARG  30  10.730   5.181   3.852
  182    HD2  ARG  30           1HD      ARG  30  10.841   7.001   2.000
  183    HD3  ARG  30           2HD      ARG  30  11.528   8.006   3.276
  184    HE   ARG  30           HE       ARG  30  12.861   5.514   3.156
  185   HH11  ARG  30          2HH1      ARG  30  12.561   8.545   1.469
  186   HH12  ARG  30          1HH1      ARG  30  14.155   8.475   0.792
  187   HH21  ARG  30          2HH2      ARG  30  14.961   5.411   2.271
  188   HH22  ARG  30          1HH2      ARG  30  15.518   6.691   1.248
  189    H    LEU  31           H        LEU  31   6.933   3.818   4.291
  190    HA   LEU  31           HA       LEU  31   8.927   2.007   5.481
  191    HB2  LEU  31           1HB      LEU  31   5.961   1.934   5.313
  192    HB3  LEU  31           2HB      LEU  31   6.831   0.402   5.269
  193    HG   LEU  31           HG       LEU  31   7.859   0.954   7.443
  194   HD11  LEU  31          1HD1      LEU  31   6.010   3.019   8.211
  195   HD12  LEU  31          2HD1      LEU  31   6.998   3.543   6.848
  196   HD13  LEU  31          3HD1      LEU  31   7.769   2.984   8.332
  197   HD21  LEU  31          1HD2      LEU  31   6.120  -0.370   7.963
  198   HD22  LEU  31          2HD2      LEU  31   4.985   0.558   6.982
  199   HD23  LEU  31          3HD2      LEU  31   5.413   1.115   8.600
  200    H    CYS  32           H        CYS  32  10.232   1.329   3.895
  201    HA   CYS  32           HA       CYS  32   9.373   1.007   1.190
  202    HB2  CYS  32           1HB      CYS  32  11.651   1.611   1.529
  203    HB3  CYS  32           2HB      CYS  32  11.912   0.277   2.646
  204    HG   CYS  32           HG       CYS  32  11.523  -1.662   0.552
  205    H    VAL  33           H        VAL  33   7.959  -0.555   0.714
  206    HA   VAL  33           HA       VAL  33   8.626  -3.299   1.533
  207    HB   VAL  33           HB       VAL  33   5.794  -2.266   1.426
  208   HG11  VAL  33          1HG1      VAL  33   6.669  -4.811   1.225
  209   HG12  VAL  33          2HG1      VAL  33   6.512  -4.664   2.977
  210   HG13  VAL  33          3HG1      VAL  33   5.121  -4.356   1.936
  211   HG21  VAL  33          1HG2      VAL  33   5.769  -2.004   3.748
  212   HG22  VAL  33          2HG2      VAL  33   7.284  -2.882   3.957
  213   HG23  VAL  33          3HG2      VAL  33   7.292  -1.265   3.253
  214    H    ASN  34           H        ASN  34   8.667  -4.701  -0.103
  215    HA   ASN  34           HA       ASN  34   8.662  -5.453  -2.261
  216    HB2  ASN  34           1HB      ASN  34   5.833  -4.418  -1.997
  217    HB3  ASN  34           2HB      ASN  34   6.389  -5.431  -3.326
  218   HD21  ASN  34          1HD2      ASN  34   6.652  -7.586  -3.018
  219   HD22  ASN  34          2HD2      ASN  34   6.229  -8.405  -1.557
  220    H    GLY  35           H        GLY  35   9.436  -2.606  -1.805
  221    HA2  GLY  35           1HA      GLY  35  10.425  -1.206  -3.447
  222    HA3  GLY  35           2HA      GLY  35   9.245  -1.785  -4.613
  223    H    HIS  36           H        HIS  36   6.969  -1.392  -2.849
  224    HA   HIS  36           HA       HIS  36   6.578   1.429  -3.363
  225    HB2  HIS  36           1HB      HIS  36   4.698  -0.650  -2.224
  226    HB3  HIS  36           2HB      HIS  36   4.246   0.993  -2.670
  227    HD1  HIS  36           1HD      HIS  36   4.728   1.541  -5.334
  228    HD2  HIS  36           2HD      HIS  36   4.340  -2.442  -4.217
  229    HE1  HIS  36           1HE      HIS  36   4.224   0.293  -7.458
  230    H    PHE  37           H        PHE  37   6.047   2.993  -1.824
  231    HA   PHE  37           HA       PHE  37   7.008   2.376   0.880
  232    HB2  PHE  37           1HB      PHE  37   6.685   5.021  -0.551
  233    HB3  PHE  37           2HB      PHE  37   7.225   4.851   1.116
  234    HD1  PHE  37           1HD      PHE  37   8.108   4.338  -2.401
  235    HD2  PHE  37           2HD      PHE  37   9.437   4.073   1.634
  236    HE1  PHE  37           1HE      PHE  37  10.427   4.083  -3.184
  237    HE2  PHE  37           2HE      PHE  37  11.757   3.820   0.857
  238    HZ   PHE  37           HZ       PHE  37  12.255   3.825  -1.555
  239    H    PHE  38           H        PHE  38   5.861   3.086   2.719
  240    HA   PHE  38           HA       PHE  38   3.150   4.081   2.344
  241    HB2  PHE  38           1HB      PHE  38   3.664   1.550   3.914
  242    HB3  PHE  38           2HB      PHE  38   2.106   2.303   3.595
  243    HD1  PHE  38           1HD      PHE  38   5.024   0.823   1.818
  244    HD2  PHE  38           2HD      PHE  38   0.831   1.557   1.824
  245    HE1  PHE  38           1HE      PHE  38   4.784  -0.547  -0.211
  246    HE2  PHE  38           2HE      PHE  38   0.585   0.187  -0.204
  247    HZ   PHE  38           HZ       PHE  38   2.562  -0.868  -1.225
  248    H    HIS  39           H        HIS  39   2.288   5.101   4.156
  249    HA   HIS  39           HA       HIS  39   4.146   6.270   5.926
  250    HB2  HIS  39           1HB      HIS  39   1.143   6.227   5.799
  251    HB3  HIS  39           2HB      HIS  39   1.977   6.997   7.146
  252    HD2  HIS  39           2HD      HIS  39   4.244   8.688   5.632
  253    HE1  HIS  39           1HE      HIS  39   1.086  10.186   3.227
  254    HE2  HIS  39           2HE      HIS  39   3.488  10.480   3.927
  255    H    ARG  40           H        ARG  40   3.867   6.235   8.349
  256    HA   ARG  40           HA       ARG  40   4.183   3.544   9.265
  257    HB2  ARG  40           1HB      ARG  40   4.294   6.247  10.563
  258    HB3  ARG  40           2HB      ARG  40   4.278   4.792  11.551
  259    HG2  ARG  40           1HG      ARG  40   6.256   4.015  10.150
  260    HG3  ARG  40           2HG      ARG  40   6.345   5.679   9.570
  261    HD2  ARG  40           1HD      ARG  40   7.832   5.618  11.372
  262    HD3  ARG  40           2HD      ARG  40   6.370   6.343  12.040
  263    HE   ARG  40           HE       ARG  40   6.329   3.545  12.421
  264   HH11  ARG  40          2HH1      ARG  40   7.889   6.433  13.581
  265   HH12  ARG  40          1HH1      ARG  40   8.197   5.789  15.160
  266   HH21  ARG  40          2HH2      ARG  40   6.728   2.686  14.496
  267   HH22  ARG  40          1HH2      ARG  40   7.537   3.657  15.679
  268    H    SER  41           H        SER  41   1.544   5.699   9.002
  269    HA   SER  41           HA       SER  41  -0.030   4.230  10.991
  270    HB2  SER  41           1HB      SER  41  -0.150   6.660  11.146
  271    HB3  SER  41           2HB      SER  41  -0.650   6.767   9.458
  272    HG   SER  41           HG       SER  41  -2.110   5.339  11.422
  273    H    CYS  42           H        CYS  42  -0.160   5.228   7.583
  274    HA   CYS  42           HA       CYS  42  -2.531   3.965   6.869
  275    HB2  CYS  42           1HB      CYS  42  -0.046   4.667   5.330
  276    HB3  CYS  42           2HB      CYS  42  -1.376   3.818   4.549
  277    H    PHE  43           H        PHE  43   0.735   2.675   7.129
  278    HA   PHE  43           HA       PHE  43   0.101   0.133   5.993
  279    HB2  PHE  43           1HB      PHE  43   2.415   1.266   6.218
  280    HB3  PHE  43           2HB      PHE  43   2.406   0.630   7.860
  281    HD1  PHE  43           1HD      PHE  43   2.476  -1.777   8.262
  282    HD2  PHE  43           2HD      PHE  43   2.706  -0.170   4.328
  283    HE1  PHE  43           1HE      PHE  43   3.311  -3.938   7.432
  284    HE2  PHE  43           2HE      PHE  43   3.539  -2.328   3.491
  285    HZ   PHE  43           HZ       PHE  43   3.842  -4.216   5.043
  286    H    ARG  44           H        ARG  44  -1.494  -0.976   6.987
  287    HA   ARG  44           HA       ARG  44  -0.943  -2.109   9.571
  288    HB2  ARG  44           1HB      ARG  44  -3.439  -1.351  10.206
  289    HB3  ARG  44           2HB      ARG  44  -2.012  -0.434  10.668
  290    HG2  ARG  44           1HG      ARG  44  -3.341   1.217   9.807
  291    HG3  ARG  44           2HG      ARG  44  -2.401   0.767   8.383
  292    HD2  ARG  44           1HD      ARG  44  -4.333  -0.877   7.910
  293    HD3  ARG  44           2HD      ARG  44  -5.244   0.103   9.057
  294    HE   ARG  44           HE       ARG  44  -4.487   0.821   6.377
  295   HH11  ARG  44          2HH1      ARG  44  -5.401   2.010   9.518
  296   HH12  ARG  44          1HH1      ARG  44  -5.982   3.528   8.919
  297   HH21  ARG  44          2HH2      ARG  44  -5.248   2.817   5.575
  298   HH22  ARG  44          1HH2      ARG  44  -5.895   3.986   6.676
  299    H    CYS  45           H        CYS  45  -2.734  -3.650  10.221
  300    HA   CYS  45           HA       CYS  45  -3.165  -5.560   8.310
  301    HB2  CYS  45           1HB      CYS  45  -3.534  -5.751  10.813
  302    HB3  CYS  45           2HB      CYS  45  -5.116  -5.024  10.551
  303    H    HIS  46           H        HIS  46  -5.240  -6.322   7.364
  304    HA   HIS  46           HA       HIS  46  -6.705  -4.038   6.239
  305    HB2  HIS  46           1HB      HIS  46  -5.698  -5.294   4.499
  306    HB3  HIS  46           2HB      HIS  46  -6.189  -6.826   5.215
  307    HD1  HIS  46           1HD      HIS  46  -7.317  -4.170   2.919
  308    HD2  HIS  46           2HD      HIS  46  -8.964  -7.448   4.870
  309    HE1  HIS  46           1HE      HIS  46  -9.519  -4.594   1.780
  310    H    THR  47           H        THR  47  -7.023  -6.347   8.574
  311    HA   THR  47           HA       THR  47  -9.955  -6.437   8.273
  312    HB   THR  47           HB       THR  47  -8.060  -8.458   9.454
  313    HG1  THR  47           1HG      THR  47  -9.677  -9.729   8.034
  314   HG21  THR  47          1HG2      THR  47 -10.061  -9.703  10.217
  315   HG22  THR  47          2HG2      THR  47 -11.054  -8.300   9.819
  316   HG23  THR  47          3HG2      THR  47  -9.831  -8.185  11.084
  317    H    CYS  48           H        CYS  48  -7.260  -5.803  10.402
  318    HA   CYS  48           HA       CYS  48  -9.155  -4.819  12.435
  319    HB2  CYS  48           1HB      CYS  48  -7.351  -5.267  14.108
  320    HB3  CYS  48           2HB      CYS  48  -7.984  -6.719  13.340
  321    H    GLU  49           H        GLU  49  -6.877  -3.954  10.172
  322    HA   GLU  49           HA       GLU  49  -5.708  -2.054   9.720
  323    HB2  GLU  49           1HB      GLU  49  -7.669  -0.833  11.671
  324    HB3  GLU  49           2HB      GLU  49  -6.675   0.056  10.524
  325    HG2  GLU  49           1HG      GLU  49  -7.869  -1.489   8.775
  326    HG3  GLU  49           2HG      GLU  49  -9.082  -1.623  10.047
  327    H    ALA  50           H        ALA  50  -4.830  -3.754  11.937
  328    HA   ALA  50           HA       ALA  50  -3.742  -1.934  13.914
  329    HB1  ALA  50           1HB      ALA  50  -4.469  -4.074  14.707
  330    HB2  ALA  50           2HB      ALA  50  -3.445  -4.908  13.538
  331    HB3  ALA  50           3HB      ALA  50  -2.713  -3.995  14.857
  332    H    THR  51           H        THR  51  -1.841  -0.950  13.762
  333    HA   THR  51           HA       THR  51  -0.233  -0.760  11.610
  334    HB   THR  51           HB       THR  51   0.752  -0.761  14.470
  335    HG1  THR  51           1HG      THR  51   0.264   1.418  14.413
  336   HG21  THR  51          1HG2      THR  51   2.049   0.993  12.516
  337   HG22  THR  51          2HG2      THR  51   2.290  -0.726  12.203
  338   HG23  THR  51          3HG2      THR  51   2.757  -0.039  13.758
  339    H    LEU  52           H        LEU  52   0.723  -2.253  10.403
  340    HA   LEU  52           HA       LEU  52   1.473  -4.817  11.486
  341    HB2  LEU  52           1HB      LEU  52   1.830  -3.644   8.733
  342    HB3  LEU  52           2HB      LEU  52   2.176  -5.315   9.173
  343    HG   LEU  52           HG       LEU  52  -0.552  -4.029   9.287
  344   HD11  LEU  52          1HD1      LEU  52  -1.031  -5.464   7.328
  345   HD12  LEU  52          2HD1      LEU  52   0.685  -5.861   7.239
  346   HD13  LEU  52          3HD1      LEU  52   0.151  -4.198   6.994
  347   HD21  LEU  52          1HD2      LEU  52  -1.300  -5.889  10.262
  348   HD22  LEU  52          2HD2      LEU  52   0.388  -6.250  10.623
  349   HD23  LEU  52          3HD2      LEU  52  -0.371  -6.928   9.182
  350    H    TRP  53           H        TRP  53   3.225  -4.770  12.776
  351    HA   TRP  53           HA       TRP  53   5.469  -3.073  12.337
  352    HB2  TRP  53           1HB      TRP  53   5.547  -5.562  14.024
  353    HB3  TRP  53           2HB      TRP  53   6.401  -4.041  14.264
  354    HD1  TRP  53           HD       TRP  53   3.012  -5.699  14.855
  355    HE1  TRP  53           1HE      TRP  53   1.653  -4.245  16.487
  356    HE3  TRP  53           3HE      TRP  53   6.093  -1.625  15.069
  357    HZ2  TRP  53           2HZ      TRP  53   1.860  -1.706  17.703
  358    HZ3  TRP  53           3HZ      TRP  53   5.439   0.274  16.490
  359    HH2  TRP  53           HH       TRP  53   3.366   0.233  17.779
  360    HA   PRO  54           HA       PRO  54   7.917  -5.411   9.544
  361    HB2  PRO  54           1HB      PRO  54  10.421  -4.854  10.434
  362    HB3  PRO  54           2HB      PRO  54   9.417  -3.672   9.585
  363    HG2  PRO  54           1HG      PRO  54   9.900  -3.986  12.523
  364    HG3  PRO  54           2HG      PRO  54   9.846  -2.504  11.550
  365    HD2  PRO  54           1HD      PRO  54   7.761  -3.327  13.069
  366    HD3  PRO  54           2HD      PRO  54   7.542  -2.441  11.546
  367    H    GLY  55           H        GLY  55   7.286  -6.474  12.509
  368    HA2  GLY  55           1HA      GLY  55   8.877  -8.905  12.117
  369    HA3  GLY  55           2HA      GLY  55   9.004  -8.079  13.663
  370    H    GLY  56           H        GLY  56   6.089  -8.436  11.699
  371    HA2  GLY  56           1HA      GLY  56   5.001 -10.663  13.012
  372    HA3  GLY  56           2HA      GLY  56   4.494  -9.221  13.880
  373    H    TYR  57           H        TYR  57   4.885  -9.993  10.422
  374    HA   TYR  57           HA       TYR  57   2.048  -9.816   9.964
  375    HB2  TYR  57           1HB      TYR  57   1.963  -7.848   8.699
  376    HB3  TYR  57           2HB      TYR  57   2.977  -7.408  10.068
  377    HD1  TYR  57           2HD      TYR  57   5.557  -7.687   9.689
  378    HD2  TYR  57           1HD      TYR  57   2.699  -7.379   6.553
  379    HE1  TYR  57           2HE      TYR  57   7.335  -6.972   8.147
  380    HE2  TYR  57           1HE      TYR  57   4.468  -6.664   5.001
  381    HH   TYR  57           HH       TYR  57   6.791  -6.675   4.728
  382    H    GLU  58           H        GLU  58   1.578  -9.977   7.550
  383    HA   GLU  58           HA       GLU  58   3.669 -11.064   5.896
  384    HB2  GLU  58           1HB      GLU  58   1.661 -12.822   7.234
  385    HB3  GLU  58           2HB      GLU  58   2.142 -13.202   5.586
  386    HG2  GLU  58           1HG      GLU  58   4.553 -13.007   6.512
  387    HG3  GLU  58           2HG      GLU  58   3.778 -13.216   8.081
  388    H    GLN  59           H        GLN  59   3.051 -11.301   3.716
  389    HA   GLN  59           HA       GLN  59   0.571  -9.879   3.055
  390    HB2  GLN  59           1HB      GLN  59   2.594  -8.867   2.167
  391    HB3  GLN  59           2HB      GLN  59   3.056 -10.387   1.411
  392    HG2  GLN  59           1HG      GLN  59   0.788 -10.160   0.172
  393    HG3  GLN  59           2HG      GLN  59   0.912  -8.463   0.635
  394   HE21  GLN  59          1HE2      GLN  59   0.875  -9.289  -2.006
  395   HE22  GLN  59          2HE2      GLN  59   2.414  -8.964  -2.720
  396    H    HIS  60           H        HIS  60  -1.101 -11.076   2.465
  397    HA   HIS  60           HA       HIS  60  -0.804 -13.826   1.702
  398    HB2  HIS  60           1HB      HIS  60  -2.731 -12.811   3.042
  399    HB3  HIS  60           2HB      HIS  60  -3.335 -12.199   1.505
  400    HD1  HIS  60           1HD      HIS  60  -4.550 -13.825  -0.002
  401    HD2  HIS  60           2HD      HIS  60  -2.775 -15.664   3.274
  402    HE1  HIS  60           1HE      HIS  60  -5.427 -16.182   0.003
  403    HA   PRO  61           HA       PRO  61  -0.287 -12.959  -2.631
  404    HB2  PRO  61           1HB      PRO  61  -0.272 -15.550  -3.440
  405    HB3  PRO  61           2HB      PRO  61   1.117 -14.778  -2.666
  406    HG2  PRO  61           1HG      PRO  61  -0.963 -16.570  -1.473
  407    HG3  PRO  61           2HG      PRO  61   0.792 -16.571  -1.221
  408    HD2  PRO  61           1HD      PRO  61  -0.933 -15.464   0.548
  409    HD3  PRO  61           2HD      PRO  61   0.703 -14.828   0.284
  410    H    GLY  62           H        GLY  62  -2.687 -15.311  -1.463
  411    HA2  GLY  62           1HA      GLY  62  -4.292 -15.814  -3.529
  412    HA3  GLY  62           2HA      GLY  62  -4.962 -15.368  -1.967
  413    H    ASP  63           H        ASP  63  -4.487 -12.739  -1.740
  414    HA   ASP  63           HA       ASP  63  -6.010 -11.620  -3.992
  415    HB2  ASP  63           1HB      ASP  63  -5.948 -11.059  -1.064
  416    HB3  ASP  63           2HB      ASP  63  -6.308  -9.722  -2.153
  417    H    GLY  64           H        GLY  64  -3.417 -10.765  -1.701
  418    HA2  GLY  64           1HA      GLY  64  -1.318  -9.934  -2.679
  419    HA3  GLY  64           2HA      GLY  64  -2.304  -9.014  -3.806
  420    H    HIS  65           H        HIS  65  -2.735  -9.386  -0.311
  421    HA   HIS  65           HA       HIS  65  -2.147  -6.518  -0.005
  422    HB2  HIS  65           1HB      HIS  65  -4.448  -8.077   1.180
  423    HB3  HIS  65           2HB      HIS  65  -3.971  -6.477   1.739
  424    HD1  HIS  65           1HD      HIS  65  -5.285  -4.663   0.715
  425    HD2  HIS  65           2HD      HIS  65  -4.990  -7.952  -1.805
  426    HE1  HIS  65           1HE      HIS  65  -6.631  -4.069  -1.325
  427    H    PHE  66           H        PHE  66  -2.286  -6.163   2.625
  428    HA   PHE  66           HA       PHE  66  -0.401  -8.135   3.740
  429    HB2  PHE  66           1HB      PHE  66  -0.487  -5.137   4.107
  430    HB3  PHE  66           2HB      PHE  66   0.507  -6.209   5.089
  431    HD1  PHE  66           2HD      PHE  66   0.047  -4.714   1.787
  432    HD2  PHE  66           1HD      PHE  66   2.464  -7.281   4.170
  433    HE1  PHE  66           2HE      PHE  66   1.832  -4.596   0.098
  434    HE2  PHE  66           1HE      PHE  66   4.253  -7.167   2.485
  435    HZ   PHE  66           HZ       PHE  66   3.938  -5.824   0.445
  436    H    TYR  67           H        TYR  67  -1.099  -9.180   5.474
  437    HA   TYR  67           HA       TYR  67  -3.077  -7.871   7.217
  438    HB2  TYR  67           1HB      TYR  67  -3.110 -10.816   6.552
  439    HB3  TYR  67           2HB      TYR  67  -4.327  -9.900   7.434
  440    HD1  TYR  67           2HD      TYR  67  -2.745 -10.234   4.085
  441    HD2  TYR  67           1HD      TYR  67  -6.139  -8.946   6.304
  442    HE1  TYR  67           2HE      TYR  67  -3.961  -9.839   1.984
  443    HE2  TYR  67           1HE      TYR  67  -7.366  -8.549   4.209
  444    HH   TYR  67           HH       TYR  67  -6.819  -8.076   1.817
  445    H    CYS  68           H        CYS  68  -3.209  -8.907   9.393
  446    HA   CYS  68           HA       CYS  68  -0.580  -9.150  10.492
  447    HB2  CYS  68           1HB      CYS  68  -1.711  -9.344  12.645
  448    HB3  CYS  68           2HB      CYS  68  -2.413  -8.031  11.705
  449    H    LEU  69           H        LEU  69  -0.120 -10.951  12.111
  450    HA   LEU  69           HA       LEU  69  -0.275 -13.453  10.701
  451    HB2  LEU  69           1HB      LEU  69   0.856 -12.905  13.438
  452    HB3  LEU  69           2HB      LEU  69   1.174 -14.310  12.422
  453    HG   LEU  69           HG       LEU  69   2.077 -11.475  11.920
  454   HD11  LEU  69          1HD1      LEU  69   3.314 -12.695  13.664
  455   HD12  LEU  69          2HD1      LEU  69   4.302 -12.364  12.242
  456   HD13  LEU  69          3HD1      LEU  69   3.648 -13.981  12.505
  457   HD21  LEU  69          1HD2      LEU  69   3.135 -12.263   9.932
  458   HD22  LEU  69          2HD2      LEU  69   1.436 -12.728   9.853
  459   HD23  LEU  69          3HD2      LEU  69   2.661 -13.927  10.270
  460    H    GLN  70           H        GLN  70  -2.649 -12.076  12.136
  461    HA   GLN  70           HA       GLN  70  -3.568 -14.507  13.523
  462    HB2  GLN  70           1HB      GLN  70  -3.095 -12.417  14.968
  463    HB3  GLN  70           2HB      GLN  70  -4.552 -11.757  14.236
  464    HG2  GLN  70           1HG      GLN  70  -5.846 -13.632  15.097
  465    HG3  GLN  70           2HG      GLN  70  -4.388 -14.315  15.814
  466   HE21  GLN  70          1HE2      GLN  70  -4.608 -14.125  17.930
  467   HE22  GLN  70          2HE2      GLN  70  -5.047 -12.684  18.775
  468    H    HIS  71           H        HIS  71  -4.097 -12.200  11.085
  469    HA   HIS  71           HA       HIS  71  -6.839 -13.203  10.680
  470    HB2  HIS  71           1HB      HIS  71  -5.645 -10.491  10.142
  471    HB3  HIS  71           2HB      HIS  71  -7.115 -11.026   9.333
  472    HD2  HIS  71           2HD      HIS  71  -7.497 -12.404  12.735
  473    HE1  HIS  71           1HE      HIS  71  -8.984  -8.442  13.031
  474    HE2  HIS  71           2HE      HIS  71  -8.777 -10.677  14.173
  475    H    LEU  72           H        LEU  72  -3.685 -12.867   9.390
  476    HA   LEU  72           HA       LEU  72  -3.992 -12.848   6.675
  477    HB2  LEU  72           1HB      LEU  72  -1.842 -12.929   7.923
  478    HB3  LEU  72           2HB      LEU  72  -2.101 -14.654   8.172
  479    HG   LEU  72           HG       LEU  72  -2.246 -14.613   5.513
  480   HD11  LEU  72          1HD1      LEU  72  -1.343 -12.856   4.476
  481   HD12  LEU  72          2HD1      LEU  72  -0.031 -12.726   5.646
  482   HD13  LEU  72          3HD1      LEU  72  -1.596 -11.991   5.992
  483   HD21  LEU  72          1HD2      LEU  72  -0.612 -15.733   7.226
  484   HD22  LEU  72          2HD2      LEU  72   0.493 -14.470   6.683
  485   HD23  LEU  72          3HD2      LEU  72  -0.179 -15.613   5.520
  486    HA   PRO  73           HA       PRO  73  -6.571 -16.462   6.091
  487    HB2  PRO  73           1HB      PRO  73  -6.936 -16.071   3.429
  488    HB3  PRO  73           2HB      PRO  73  -7.821 -15.166   4.663
  489    HG2  PRO  73           1HG      PRO  73  -5.413 -14.355   3.081
  490    HG3  PRO  73           2HG      PRO  73  -6.857 -13.409   3.484
  491    HD2  PRO  73           1HD      PRO  73  -4.521 -13.145   4.828
  492    HD3  PRO  73           2HD      PRO  73  -6.101 -12.924   5.606
  493    H    GLN  74           H        GLN  74  -6.565 -18.120   4.111
  494    HA   GLN  74           HA       GLN  74  -3.965 -18.662   3.011
  495    HB2  GLN  74           1HB      GLN  74  -4.954 -20.100   5.416
  496    HB3  GLN  74           2HB      GLN  74  -4.183 -21.067   4.166
  497    HG2  GLN  74           1HG      GLN  74  -2.990 -18.756   5.675
  498    HG3  GLN  74           2HG      GLN  74  -2.543 -20.457   5.790
  499   HE21  GLN  74          1HE2      GLN  74  -2.379 -17.570   3.858
  500   HE22  GLN  74          2HE2      GLN  74  -1.131 -18.110   2.793
  501    H    THR  75           H        THR  75  -4.311 -19.473   1.060
  502    HA   THR  75           HA       THR  75  -6.898 -20.680   0.452
  503    HB   THR  75           HB       THR  75  -6.293 -18.995  -1.109
  504    HG1  THR  75           1HG      THR  75  -6.734 -20.194  -2.811
  505   HG21  THR  75          1HG2      THR  75  -3.968 -19.905  -2.392
  506   HG22  THR  75          2HG2      THR  75  -3.629 -19.983  -0.663
  507   HG23  THR  75          3HG2      THR  75  -4.147 -18.464  -1.393
  508    H    ASP  76           H        ASP  76  -7.095 -22.809   0.587
  509    HA   ASP  76           HA       ASP  76  -6.425 -25.008   0.875
  510    HB2  ASP  76           1HB      ASP  76  -5.193 -24.680  -1.842
  511    HB3  ASP  76           2HB      ASP  76  -6.147 -26.020  -1.211
  512    H    SER  77           H        SER  77  -4.577 -23.473   2.188
  513    HA   SER  77           HA       SER  77  -1.995 -24.664   1.416
  514    HB2  SER  77           1HB      SER  77  -2.058 -22.176   1.427
  515    HB3  SER  77           2HB      SER  77  -2.474 -22.220   3.140
  516    HG   SER  77           HG       SER  77  -0.288 -23.731   2.606
  517    H    GLY  78           H        GLY  78  -3.777 -26.269   2.768
  518    HA2  GLY  78           1HA      GLY  78  -2.245 -27.112   4.980
  519    HA3  GLY  78           2HA      GLY  78  -3.641 -26.217   5.562
  520    HA   PRO  79           HA       PRO  79  -5.792 -30.065   5.473
  521    HB2  PRO  79           1HB      PRO  79  -8.306 -29.090   5.785
  522    HB3  PRO  79           2HB      PRO  79  -7.136 -29.169   7.107
  523    HG2  PRO  79           1HG      PRO  79  -7.896 -26.839   5.388
  524    HG3  PRO  79           2HG      PRO  79  -7.631 -26.897   7.141
  525    HD2  PRO  79           1HD      PRO  79  -5.764 -25.967   5.415
  526    HD3  PRO  79           2HD      PRO  79  -5.339 -26.800   6.924
  527    H    SER  80           H        SER  80  -5.293 -30.483   3.223
  528    HA   SER  80           HA       SER  80  -6.421 -29.467   0.973
  529    HB2  SER  80           1HB      SER  80  -6.206 -31.751  -0.026
  530    HB3  SER  80           2HB      SER  80  -4.766 -31.227   0.848
  531    HG   SER  80           HG       SER  80  -5.019 -32.846   2.153
  532    H    SER  81           H        SER  81  -8.445 -29.062   0.416
  533    HA   SER  81           HA       SER  81 -10.618 -30.586   1.628
  534    HB2  SER  81           1HB      SER  81 -10.496 -27.990   1.414
  535    HB3  SER  81           2HB      SER  81 -11.016 -28.272  -0.247
  536    HG   SER  81           HG       SER  81 -12.637 -29.713   1.102
  537    H    GLY  82           H        GLY  82 -11.907 -31.974   0.553
  538    HA2  GLY  82           1HA      GLY  82 -11.269 -32.441  -2.286
  539    HA3  GLY  82           2HA      GLY  82 -11.913 -33.647  -1.182
  Start of MODEL   19
    1    H1   GLY   1           H        GLY   1 -11.363  44.246 -22.293
    2    HA2  GLY   1           1HA      GLY   1  -9.436  44.903 -20.370
    3    HA3  GLY   1           2HA      GLY   1 -10.591  43.813 -19.618
    4    H    SER   2           H        SER   2  -7.663  43.751 -20.776
    5    HA   SER   2           HA       SER   2  -7.979  41.084 -21.984
    6    HB2  SER   2           1HB      SER   2  -6.255  41.518 -23.568
    7    HB3  SER   2           2HB      SER   2  -7.331  42.914 -23.633
    8    HG   SER   2           HG       SER   2  -5.636  43.587 -21.841
    9    H    SER   3           H        SER   3  -7.132  39.602 -20.696
   10    HA   SER   3           HA       SER   3  -4.468  39.805 -19.693
   11    HB2  SER   3           1HB      SER   3  -5.766  41.197 -18.038
   12    HB3  SER   3           2HB      SER   3  -6.655  39.737 -17.604
   13    HG   SER   3           HG       SER   3  -3.875  40.222 -17.330
   14    H    GLY   4           H        GLY   4  -3.834  37.852 -18.459
   15    HA2  GLY   4           1HA      GLY   4  -5.645  35.593 -18.536
   16    HA3  GLY   4           2HA      GLY   4  -4.327  35.507 -19.694
   17    H    SER   5           H        SER   5  -5.073  35.787 -16.252
   18    HA   SER   5           HA       SER   5  -2.357  34.918 -15.589
   19    HB2  SER   5           1HB      SER   5  -3.159  36.829 -14.329
   20    HB3  SER   5           2HB      SER   5  -4.608  35.948 -13.846
   21    HG   SER   5           HG       SER   5  -2.441  36.072 -12.491
   22    H    SER   6           H        SER   6  -2.411  32.747 -16.121
   23    HA   SER   6           HA       SER   6  -4.068  31.084 -14.351
   24    HB2  SER   6           1HB      SER   6  -4.915  31.180 -16.763
   25    HB3  SER   6           2HB      SER   6  -3.452  30.296 -17.198
   26    HG   SER   6           HG       SER   6  -5.698  29.285 -16.333
   27    H    GLY   7           H        GLY   7  -3.189  28.966 -13.909
   28    HA2  GLY   7           1HA      GLY   7  -0.248  28.925 -14.181
   29    HA3  GLY   7           2HA      GLY   7  -1.118  28.275 -12.800
   30    H    GLN   8           H        GLN   8   0.641  26.620 -13.855
   31    HA   GLN   8           HA       GLN   8  -0.798  24.883 -15.732
   32    HB2  GLN   8           1HB      GLN   8   1.495  25.533 -16.356
   33    HB3  GLN   8           2HB      GLN   8   2.099  24.812 -14.870
   34    HG2  GLN   8           1HG      GLN   8   1.712  22.654 -15.604
   35    HG3  GLN   8           2HG      GLN   8   0.536  23.169 -16.812
   36   HE21  GLN   8          1HE2      GLN   8   2.433  21.444 -17.579
   37   HE22  GLN   8          2HE2      GLN   8   3.601  22.218 -18.589
   38    H    HIS   9           H        HIS   9   0.814  24.886 -12.589
   39    HA   HIS   9           HA       HIS   9   0.529  23.566 -10.752
   40    HB2  HIS   9           1HB      HIS   9  -1.698  22.166 -12.234
   41    HB3  HIS   9           2HB      HIS   9  -1.463  22.273 -10.492
   42    HD1  HIS   9           1HD      HIS   9  -1.916  24.657  -9.405
   43    HD2  HIS   9           2HD      HIS   9  -3.146  24.215 -13.349
   44    HE1  HIS   9           1HE      HIS   9  -3.490  26.570  -9.836
   45    H    GLN  10           H        GLN  10   2.497  22.888 -12.521
   46    HA   GLN  10           HA       GLN  10   2.363  19.954 -12.685
   47    HB2  GLN  10           1HB      GLN  10   4.163  20.107 -14.339
   48    HB3  GLN  10           2HB      GLN  10   2.767  21.058 -14.828
   49    HG2  GLN  10           1HG      GLN  10   3.876  23.092 -14.072
   50    HG3  GLN  10           2HG      GLN  10   5.273  22.143 -13.565
   51   HE21  GLN  10          1HE2      GLN  10   5.763  20.476 -15.553
   52   HE22  GLN  10          2HE2      GLN  10   6.086  21.315 -17.029
   53    H    GLU  11           H        GLU  11   3.633  18.759 -11.417
   54    HA   GLU  11           HA       GLU  11   6.001  19.995 -10.202
   55    HB2  GLU  11           1HB      GLU  11   3.849  19.879  -8.706
   56    HB3  GLU  11           2HB      GLU  11   4.280  18.181  -8.556
   57    HG2  GLU  11           1HG      GLU  11   6.229  18.638  -7.408
   58    HG3  GLU  11           2HG      GLU  11   6.319  20.291  -8.012
   59    H    ALA  12           H        ALA  12   7.623  18.505  -9.519
   60    HA   ALA  12           HA       ALA  12   7.597  16.045 -11.092
   61    HB1  ALA  12           1HB      ALA  12   9.731  16.519 -11.456
   62    HB2  ALA  12           2HB      ALA  12   9.578  17.955 -10.443
   63    HB3  ALA  12           3HB      ALA  12  10.068  16.420  -9.727
   64    H    GLY  13           H        GLY  13   7.026  14.194 -10.169
   65    HA2  GLY  13           1HA      GLY  13   7.324  13.932  -7.247
   66    HA3  GLY  13           2HA      GLY  13   6.156  13.054  -8.224
   67    H    ALA  14           H        ALA  14   9.131  12.899  -6.696
   68    HA   ALA  14           HA       ALA  14  10.444  11.034  -8.418
   69    HB1  ALA  14           1HB      ALA  14  10.923  12.106  -5.684
   70    HB2  ALA  14           2HB      ALA  14  11.753  10.627  -6.170
   71    HB3  ALA  14           3HB      ALA  14  11.974  12.109  -7.101
   72    H    GLY  15           H        GLY  15   8.486  10.762  -5.476
   73    HA2  GLY  15           1HA      GLY  15   6.959   8.829  -5.396
   74    HA3  GLY  15           2HA      GLY  15   8.293   7.860  -6.004
   75    H    ASP  16           H        ASP  16   8.399  10.330  -3.477
   76    HA   ASP  16           HA       ASP  16   9.209   8.222  -1.584
   77    HB2  ASP  16           1HB      ASP  16  10.254  10.367  -0.412
   78    HB3  ASP  16           2HB      ASP  16  11.117   9.491  -1.673
   79    H    LEU  17           H        LEU  17   6.495   8.950  -2.057
   80    HA   LEU  17           HA       LEU  17   5.823  10.087   0.575
   81    HB2  LEU  17           1HB      LEU  17   4.093  10.435  -1.852
   82    HB3  LEU  17           2HB      LEU  17   4.003  11.283  -0.310
   83    HG   LEU  17           HG       LEU  17   6.276  11.610  -2.262
   84   HD11  LEU  17          1HD1      LEU  17   4.412  12.416  -3.437
   85   HD12  LEU  17          2HD1      LEU  17   5.136  13.842  -2.695
   86   HD13  LEU  17          3HD1      LEU  17   3.693  13.116  -1.987
   87   HD21  LEU  17          1HD2      LEU  17   5.437  12.987   0.270
   88   HD22  LEU  17          2HD2      LEU  17   6.477  13.777  -0.916
   89   HD23  LEU  17          3HD2      LEU  17   7.000  12.281  -0.141
   90    H    CYS  18           H        CYS  18   4.320   9.013   1.751
   91    HA   CYS  18           HA       CYS  18   3.836   6.369   1.516
   92    HB2  CYS  18           1HB      CYS  18   3.161   7.423   3.521
   93    HB3  CYS  18           2HB      CYS  18   2.087   8.531   2.673
   94    H    ALA  19           H        ALA  19   1.849   5.150   0.988
   95    HA   ALA  19           HA       ALA  19   0.835   6.005  -1.617
   96    HB1  ALA  19           1HB      ALA  19   1.840   3.761  -1.392
   97    HB2  ALA  19           2HB      ALA  19   0.559   3.326  -0.261
   98    HB3  ALA  19           3HB      ALA  19   0.163   3.708  -1.936
   99    H    LEU  20           H        LEU  20  -0.328   4.963   1.560
  100    HA   LEU  20           HA       LEU  20  -3.056   4.919   1.062
  101    HB2  LEU  20           1HB      LEU  20  -1.350   5.300   3.443
  102    HB3  LEU  20           2HB      LEU  20  -3.024   5.830   3.591
  103    HG   LEU  20           HG       LEU  20  -3.477   3.392   2.634
  104   HD11  LEU  20          1HD1      LEU  20  -0.705   3.322   3.719
  105   HD12  LEU  20          2HD1      LEU  20  -1.401   2.465   2.345
  106   HD13  LEU  20          3HD1      LEU  20  -1.768   1.941   3.988
  107   HD21  LEU  20          1HD2      LEU  20  -3.137   4.486   5.354
  108   HD22  LEU  20          2HD2      LEU  20  -3.229   2.730   5.224
  109   HD23  LEU  20          3HD2      LEU  20  -4.540   3.731   4.598
  110    H    CYS  21           H        CYS  21  -1.292   7.619   2.594
  111    HA   CYS  21           HA       CYS  21  -3.403   9.433   1.664
  112    HB2  CYS  21           1HB      CYS  21  -2.460  11.029   3.312
  113    HB3  CYS  21           2HB      CYS  21  -2.984   9.520   4.052
  114    H    GLY  22           H        GLY  22   0.146   9.205   1.857
  115    HA2  GLY  22           1HA      GLY  22   1.668   9.805   0.186
  116    HA3  GLY  22           2HA      GLY  22   0.355  10.555  -0.709
  117    H    GLU  23           H        GLU  23   1.665  11.052   2.568
  118    HA   GLU  23           HA       GLU  23   1.592  13.929   2.115
  119    HB2  GLU  23           1HB      GLU  23   2.030  12.227   4.561
  120    HB3  GLU  23           2HB      GLU  23   2.295  13.965   4.577
  121    HG2  GLU  23           1HG      GLU  23  -0.308  12.803   3.664
  122    HG3  GLU  23           2HG      GLU  23   0.035  13.059   5.374
  123    H    HIS  24           H        HIS  24   3.967  11.870   3.788
  124    HA   HIS  24           HA       HIS  24   6.123  12.475   2.072
  125    HB2  HIS  24           1HB      HIS  24   5.604  14.706   3.342
  126    HB3  HIS  24           2HB      HIS  24   6.423  13.914   4.685
  127    HD1  HIS  24           1HD      HIS  24   7.037  15.525   1.399
  128    HD2  HIS  24           2HD      HIS  24   9.194  13.468   4.293
  129    HE1  HIS  24           1HE      HIS  24   9.457  15.925   0.845
  130    H    LEU  25           H        LEU  25   7.588  10.923   2.351
  131    HA   LEU  25           HA       LEU  25   7.501   9.369   4.837
  132    HB2  LEU  25           1HB      LEU  25   8.735   8.673   2.176
  133    HB3  LEU  25           2HB      LEU  25   8.614   7.608   3.574
  134    HG   LEU  25           HG       LEU  25   6.161   8.723   2.254
  135   HD11  LEU  25          1HD1      LEU  25   6.959   7.679   0.393
  136   HD12  LEU  25          2HD1      LEU  25   6.211   6.301   1.200
  137   HD13  LEU  25          3HD1      LEU  25   7.953   6.549   1.313
  138   HD21  LEU  25          1HD2      LEU  25   5.873   7.716   4.439
  139   HD22  LEU  25          2HD2      LEU  25   6.717   6.262   3.908
  140   HD23  LEU  25          3HD2      LEU  25   5.158   6.685   3.200
  141    H    TYR  26           H        TYR  26   9.359   8.880   6.000
  142    HA   TYR  26           HA       TYR  26  11.729  10.495   5.320
  143    HB2  TYR  26           1HB      TYR  26  10.442  11.284   7.331
  144    HB3  TYR  26           2HB      TYR  26  10.824   9.751   8.107
  145    HD1  TYR  26           1HD      TYR  26  12.622  12.497   6.307
  146    HD2  TYR  26           2HD      TYR  26  12.616   9.744   9.551
  147    HE1  TYR  26           1HE      TYR  26  14.751  13.438   7.101
  148    HE2  TYR  26           2HE      TYR  26  14.745  10.677  10.355
  149    HH   TYR  26           HH       TYR  26  16.792  12.269   8.710
  150    H    VAL  27           H        VAL  27  13.720   9.640   6.588
  151    HA   VAL  27           HA       VAL  27  14.382   7.121   5.600
  152    HB   VAL  27           HB       VAL  27  15.667   8.514   7.952
  153   HG11  VAL  27          1HG1      VAL  27  17.169   6.804   6.044
  154   HG12  VAL  27          2HG1      VAL  27  17.438   7.091   7.765
  155   HG13  VAL  27          3HG1      VAL  27  16.148   6.007   7.241
  156   HG21  VAL  27          1HG2      VAL  27  16.465   8.705   5.056
  157   HG22  VAL  27          2HG2      VAL  27  15.439   9.895   5.857
  158   HG23  VAL  27          3HG2      VAL  27  17.091   9.635   6.416
  159    H    LEU  28           H        LEU  28  13.339   8.083   8.849
  160    HA   LEU  28           HA       LEU  28  13.141   5.243   9.580
  161    HB2  LEU  28           1HB      LEU  28  13.307   7.749  11.234
  162    HB3  LEU  28           2HB      LEU  28  12.872   6.184  11.919
  163    HG   LEU  28           HG       LEU  28  15.464   6.645  10.463
  164   HD11  LEU  28          1HD1      LEU  28  14.832   8.006  12.714
  165   HD12  LEU  28          2HD1      LEU  28  16.465   7.498  12.283
  166   HD13  LEU  28          3HD1      LEU  28  15.505   6.525  13.398
  167   HD21  LEU  28          1HD2      LEU  28  14.171   4.357  11.424
  168   HD22  LEU  28          2HD2      LEU  28  15.459   4.699  12.580
  169   HD23  LEU  28          3HD2      LEU  28  15.840   4.494  10.870
  170    H    GLU  29           H        GLU  29  11.229   6.984   7.977
  171    HA   GLU  29           HA       GLU  29   8.834   6.259   9.513
  172    HB2  GLU  29           1HB      GLU  29   9.086   8.825   7.939
  173    HB3  GLU  29           2HB      GLU  29   7.724   8.316   8.927
  174    HG2  GLU  29           1HG      GLU  29   9.190   8.421  10.919
  175    HG3  GLU  29           2HG      GLU  29  10.474   9.060   9.894
  176    H    ARG  30           H        ARG  30  10.545   5.578   6.916
  177    HA   ARG  30           HA       ARG  30   8.227   5.329   5.117
  178    HB2  ARG  30           1HB      ARG  30   9.678   5.392   3.273
  179    HB3  ARG  30           2HB      ARG  30  10.318   6.611   4.367
  180    HG2  ARG  30           1HG      ARG  30  12.044   5.089   5.109
  181    HG3  ARG  30           2HG      ARG  30  11.372   3.803   4.105
  182    HD2  ARG  30           1HD      ARG  30  11.777   5.242   2.112
  183    HD3  ARG  30           2HD      ARG  30  12.594   6.394   3.167
  184    HE   ARG  30           HE       ARG  30  13.954   4.161   3.685
  185   HH11  ARG  30          2HH1      ARG  30  12.952   5.572   0.664
  186   HH12  ARG  30          1HH1      ARG  30  14.298   4.941  -0.226
  187   HH21  ARG  30          2HH2      ARG  30  15.730   3.325   2.524
  188   HH22  ARG  30          1HH2      ARG  30  15.877   3.662   0.832
  189    H    LEU  31           H        LEU  31   7.473   3.364   4.643
  190    HA   LEU  31           HA       LEU  31   9.023   1.040   5.563
  191    HB2  LEU  31           1HB      LEU  31   6.124   1.665   5.449
  192    HB3  LEU  31           2HB      LEU  31   6.608  -0.011   5.203
  193    HG   LEU  31           HG       LEU  31   7.705  -0.009   7.397
  194   HD11  LEU  31          1HD1      LEU  31   6.524   2.320   8.531
  195   HD12  LEU  31          2HD1      LEU  31   7.484   2.796   7.130
  196   HD13  LEU  31          3HD1      LEU  31   8.228   1.875   8.437
  197   HD21  LEU  31          1HD2      LEU  31   4.809   0.789   7.264
  198   HD22  LEU  31          2HD2      LEU  31   5.590   0.289   8.765
  199   HD23  LEU  31          3HD2      LEU  31   5.496  -0.830   7.404
  200    H    CYS  32           H        CYS  32  10.216   0.436   3.828
  201    HA   CYS  32           HA       CYS  32   9.304   0.528   1.147
  202    HB2  CYS  32           1HB      CYS  32  11.732   0.413   2.109
  203    HB3  CYS  32           2HB      CYS  32  11.482  -1.328   2.048
  204    HG   CYS  32           HG       CYS  32  11.362   0.809  -0.623
  205    H    VAL  33           H        VAL  33   7.684  -0.667   0.401
  206    HA   VAL  33           HA       VAL  33   7.639  -3.532   1.078
  207    HB   VAL  33           HB       VAL  33   5.199  -1.772   0.799
  208   HG11  VAL  33          1HG1      VAL  33   4.073  -3.871   1.698
  209   HG12  VAL  33          2HG1      VAL  33   4.611  -3.910   0.018
  210   HG13  VAL  33          3HG1      VAL  33   5.558  -4.718   1.268
  211   HG21  VAL  33          1HG2      VAL  33   5.148  -1.501   3.021
  212   HG22  VAL  33          2HG2      VAL  33   5.631  -3.169   3.329
  213   HG23  VAL  33          3HG2      VAL  33   6.854  -1.948   2.976
  214    H    ASN  34           H        ASN  34   8.251  -4.485  -0.765
  215    HA   ASN  34           HA       ASN  34   8.349  -5.085  -2.958
  216    HB2  ASN  34           1HB      ASN  34   5.477  -4.133  -2.879
  217    HB3  ASN  34           2HB      ASN  34   6.184  -5.087  -4.180
  218   HD21  ASN  34          1HD2      ASN  34   4.416  -6.549  -3.618
  219   HD22  ASN  34          2HD2      ASN  34   4.662  -7.698  -2.351
  220    H    GLY  35           H        GLY  35   9.279  -2.463  -2.333
  221    HA2  GLY  35           1HA      GLY  35  10.284  -0.937  -3.846
  222    HA3  GLY  35           2HA      GLY  35   8.990  -1.260  -4.990
  223    H    HIS  36           H        HIS  36   6.809  -0.895  -3.208
  224    HA   HIS  36           HA       HIS  36   6.612   1.960  -3.313
  225    HB2  HIS  36           1HB      HIS  36   4.653   0.128  -1.941
  226    HB3  HIS  36           2HB      HIS  36   4.342   1.681  -2.711
  227    HD1  HIS  36           1HD      HIS  36   5.289   1.414  -5.474
  228    HD2  HIS  36           2HD      HIS  36   3.540  -1.782  -3.477
  229    HE1  HIS  36           1HE      HIS  36   4.462  -0.134  -7.276
  230    H    PHE  37           H        PHE  37   5.504   3.033  -1.289
  231    HA   PHE  37           HA       PHE  37   6.878   2.196   1.164
  232    HB2  PHE  37           1HB      PHE  37   6.957   4.951  -0.072
  233    HB3  PHE  37           2HB      PHE  37   7.390   4.634   1.605
  234    HD1  PHE  37           2HD      PHE  37   9.405   3.383   2.154
  235    HD2  PHE  37           1HD      PHE  37   8.393   4.294  -1.878
  236    HE1  PHE  37           2HE      PHE  37  11.700   2.834   1.457
  237    HE2  PHE  37           1HE      PHE  37  10.686   3.746  -2.582
  238    HZ   PHE  37           HZ       PHE  37  12.343   3.015  -0.913
  239    H    PHE  38           H        PHE  38   5.917   2.954   3.111
  240    HA   PHE  38           HA       PHE  38   3.348   4.310   2.913
  241    HB2  PHE  38           1HB      PHE  38   3.620   1.595   4.220
  242    HB3  PHE  38           2HB      PHE  38   2.166   2.587   4.186
  243    HD1  PHE  38           1HD      PHE  38   4.560   0.780   2.004
  244    HD2  PHE  38           2HD      PHE  38   0.652   2.414   2.425
  245    HE1  PHE  38           1HE      PHE  38   3.889  -0.288  -0.109
  246    HE2  PHE  38           2HE      PHE  38  -0.025   1.348   0.313
  247    HZ   PHE  38           HZ       PHE  38   1.594  -0.005  -0.956
  248    H    HIS  39           H        HIS  39   2.509   4.978   5.014
  249    HA   HIS  39           HA       HIS  39   4.637   5.861   6.735
  250    HB2  HIS  39           1HB      HIS  39   1.655   6.280   6.719
  251    HB3  HIS  39           2HB      HIS  39   2.661   6.856   8.044
  252    HD2  HIS  39           2HD      HIS  39   5.060   8.305   6.542
  253    HE1  HIS  39           1HE      HIS  39   2.087  10.276   4.247
  254    HE2  HIS  39           2HE      HIS  39   4.516  10.238   4.912
  255    H    ARG  40           H        ARG  40   5.079   5.237   8.809
  256    HA   ARG  40           HA       ARG  40   4.714   2.621   9.583
  257    HB2  ARG  40           1HB      ARG  40   5.381   5.119  11.094
  258    HB3  ARG  40           2HB      ARG  40   5.123   3.618  11.973
  259    HG2  ARG  40           1HG      ARG  40   6.867   2.565  10.527
  260    HG3  ARG  40           2HG      ARG  40   7.199   4.169   9.869
  261    HD2  ARG  40           1HD      ARG  40   7.937   4.981  11.958
  262    HD3  ARG  40           2HD      ARG  40   7.271   3.593  12.817
  263    HE   ARG  40           HE       ARG  40   9.330   2.958  10.895
  264   HH11  ARG  40          2HH1      ARG  40   8.598   3.784  14.196
  265   HH12  ARG  40          1HH1      ARG  40  10.061   3.103  14.828
  266   HH21  ARG  40          2HH2      ARG  40  11.259   2.057  11.715
  267   HH22  ARG  40          1HH2      ARG  40  11.574   2.122  13.416
  268    H    SER  41           H        SER  41   2.567   5.322   9.974
  269    HA   SER  41           HA       SER  41   0.874   3.942  11.882
  270    HB2  SER  41           1HB      SER  41   1.090   6.334  12.148
  271    HB3  SER  41           2HB      SER  41   0.588   6.609  10.480
  272    HG   SER  41           HG       SER  41  -1.244   6.899  11.588
  273    H    CYS  42           H        CYS  42   0.442   5.281   8.603
  274    HA   CYS  42           HA       CYS  42  -2.060   4.340   8.025
  275    HB2  CYS  42           1HB      CYS  42   0.368   4.727   6.297
  276    HB3  CYS  42           2HB      CYS  42  -1.136   4.125   5.609
  277    H    PHE  43           H        PHE  43   0.994   2.605   7.426
  278    HA   PHE  43           HA       PHE  43   0.012   0.275   6.359
  279    HB2  PHE  43           1HB      PHE  43   2.457   1.012   6.860
  280    HB3  PHE  43           2HB      PHE  43   2.220   0.177   8.391
  281    HD1  PHE  43           2HD      PHE  43   1.255  -0.590   4.868
  282    HD2  PHE  43           1HD      PHE  43   3.302  -1.842   8.385
  283    HE1  PHE  43           2HE      PHE  43   1.807  -2.728   3.782
  284    HE2  PHE  43           1HE      PHE  43   3.858  -3.981   7.303
  285    HZ   PHE  43           HZ       PHE  43   3.110  -4.427   5.000
  286    H    ARG  44           H        ARG  44  -1.884  -0.491   7.196
  287    HA   ARG  44           HA       ARG  44  -1.697  -1.710   9.860
  288    HB2  ARG  44           1HB      ARG  44  -4.007  -0.068   8.813
  289    HB3  ARG  44           2HB      ARG  44  -4.098  -1.090  10.241
  290    HG2  ARG  44           1HG      ARG  44  -2.439   0.243  11.362
  291    HG3  ARG  44           2HG      ARG  44  -2.183   1.207   9.907
  292    HD2  ARG  44           1HD      ARG  44  -4.704   1.726  10.080
  293    HD3  ARG  44           2HD      ARG  44  -4.553   1.147  11.739
  294    HE   ARG  44           HE       ARG  44  -2.649   3.180  10.956
  295   HH11  ARG  44          2HH1      ARG  44  -5.731   2.473  12.412
  296   HH12  ARG  44          1HH1      ARG  44  -5.811   3.971  13.280
  297   HH21  ARG  44          2HH2      ARG  44  -2.743   5.155  12.093
  298   HH22  ARG  44          1HH2      ARG  44  -4.111   5.496  13.096
  299    H    CYS  45           H        CYS  45  -3.463  -3.353  10.201
  300    HA   CYS  45           HA       CYS  45  -3.376  -5.297   8.197
  301    HB2  CYS  45           1HB      CYS  45  -3.824  -5.711  10.626
  302    HB3  CYS  45           2HB      CYS  45  -5.448  -5.075  10.388
  303    H    HIS  46           H        HIS  46  -5.251  -6.278   7.079
  304    HA   HIS  46           HA       HIS  46  -6.904  -4.169   5.894
  305    HB2  HIS  46           1HB      HIS  46  -5.623  -5.439   4.291
  306    HB3  HIS  46           2HB      HIS  46  -6.224  -6.959   4.947
  307    HD1  HIS  46           1HD      HIS  46  -7.043  -4.272   2.557
  308    HD2  HIS  46           2HD      HIS  46  -8.959  -7.517   4.306
  309    HE1  HIS  46           1HE      HIS  46  -9.122  -4.642   1.191
  310    H    THR  47           H        THR  47  -7.174  -6.263   8.353
  311    HA   THR  47           HA       THR  47 -10.056  -6.676   7.889
  312    HB   THR  47           HB       THR  47  -8.070  -8.507   9.225
  313    HG1  THR  47           1HG      THR  47  -8.341  -9.526   7.400
  314   HG21  THR  47          1HG2      THR  47 -11.084  -8.674   9.361
  315   HG22  THR  47          2HG2      THR  47 -10.016  -8.276  10.707
  316   HG23  THR  47          3HG2      THR  47  -9.949  -9.877   9.971
  317    H    CYS  48           H        CYS  48  -7.528  -6.162  10.319
  318    HA   CYS  48           HA       CYS  48  -9.585  -5.113  12.147
  319    HB2  CYS  48           1HB      CYS  48  -7.971  -5.536  13.961
  320    HB3  CYS  48           2HB      CYS  48  -8.352  -7.007  13.072
  321    H    GLU  49           H        GLU  49  -7.232  -4.155  10.021
  322    HA   GLU  49           HA       GLU  49  -6.037  -2.243   9.679
  323    HB2  GLU  49           1HB      GLU  49  -8.320  -1.107  11.302
  324    HB3  GLU  49           2HB      GLU  49  -7.189  -0.150  10.357
  325    HG2  GLU  49           1HG      GLU  49  -8.032  -0.916   8.335
  326    HG3  GLU  49           2HG      GLU  49  -8.794  -2.322   9.075
  327    H    ALA  50           H        ALA  50  -4.806  -3.654  11.564
  328    HA   ALA  50           HA       ALA  50  -4.260  -1.825  13.797
  329    HB1  ALA  50           1HB      ALA  50  -2.917  -3.946  14.570
  330    HB2  ALA  50           2HB      ALA  50  -4.666  -3.854  14.779
  331    HB3  ALA  50           3HB      ALA  50  -3.986  -4.767  13.432
  332    H    THR  51           H        THR  51  -2.348  -0.819  14.006
  333    HA   THR  51           HA       THR  51  -0.633  -0.323  11.962
  334    HB   THR  51           HB       THR  51   0.193  -0.498  14.866
  335    HG1  THR  51           1HG      THR  51  -1.669   0.970  13.896
  336   HG21  THR  51          1HG2      THR  51   2.203   0.163  14.169
  337   HG22  THR  51          2HG2      THR  51   1.468   1.619  13.498
  338   HG23  THR  51          3HG2      THR  51   1.646   0.179  12.496
  339    H    LEU  52           H        LEU  52   0.174  -1.901  10.691
  340    HA   LEU  52           HA       LEU  52   1.146  -4.388  11.676
  341    HB2  LEU  52           1HB      LEU  52   1.608  -3.064   9.007
  342    HB3  LEU  52           2HB      LEU  52   1.926  -4.755   9.389
  343    HG   LEU  52           HG       LEU  52  -0.806  -3.476   9.419
  344   HD11  LEU  52          1HD1      LEU  52  -0.137  -3.472   7.165
  345   HD12  LEU  52          2HD1      LEU  52  -1.112  -4.928   7.362
  346   HD13  LEU  52          3HD1      LEU  52   0.646  -5.046   7.309
  347   HD21  LEU  52          1HD2      LEU  52  -1.679  -5.565   9.868
  348   HD22  LEU  52          2HD2      LEU  52  -0.215  -5.565  10.852
  349   HD23  LEU  52          3HD2      LEU  52  -0.236  -6.407   9.302
  350    H    TRP  53           H        TRP  53   2.766  -4.100  13.162
  351    HA   TRP  53           HA       TRP  53   4.924  -2.326  12.921
  352    HB2  TRP  53           1HB      TRP  53   5.016  -4.969  14.377
  353    HB3  TRP  53           2HB      TRP  53   5.920  -3.502  14.743
  354    HD1  TRP  53           HD       TRP  53   2.616  -5.207  15.396
  355    HE1  TRP  53           1HE      TRP  53   1.237  -3.791  17.044
  356    HE3  TRP  53           3HE      TRP  53   5.486  -0.976  15.431
  357    HZ2  TRP  53           2HZ      TRP  53   1.350  -1.220  18.205
  358    HZ3  TRP  53           3HZ      TRP  53   4.780   0.916  16.837
  359    HH2  TRP  53           HH       TRP  53   2.754   0.795  18.194
  360    HA   PRO  54           HA       PRO  54   7.659  -4.181  10.032
  361    HB2  PRO  54           1HB      PRO  54  10.074  -3.527  11.088
  362    HB3  PRO  54           2HB      PRO  54   9.013  -2.345  10.312
  363    HG2  PRO  54           1HG      PRO  54   9.404  -2.915  13.225
  364    HG3  PRO  54           2HG      PRO  54   9.270  -1.352  12.399
  365    HD2  PRO  54           1HD      PRO  54   7.200  -2.478  13.732
  366    HD3  PRO  54           2HD      PRO  54   6.970  -1.463  12.293
  367    H    GLY  55           H        GLY  55   6.897  -5.671  12.704
  368    HA2  GLY  55           1HA      GLY  55   8.673  -7.914  12.178
  369    HA3  GLY  55           2HA      GLY  55   8.777  -7.225  13.792
  370    H    GLY  56           H        GLY  56   5.786  -7.362  11.975
  371    HA2  GLY  56           1HA      GLY  56   4.868  -9.802  13.165
  372    HA3  GLY  56           2HA      GLY  56   4.216  -8.386  13.976
  373    H    TYR  57           H        TYR  57   4.853  -9.104  10.547
  374    HA   TYR  57           HA       TYR  57   2.039  -9.211   9.940
  375    HB2  TYR  57           1HB      TYR  57   1.773  -7.226   8.788
  376    HB3  TYR  57           2HB      TYR  57   2.828  -6.709  10.098
  377    HD1  TYR  57           2HD      TYR  57   5.257  -6.369   9.659
  378    HD2  TYR  57           1HD      TYR  57   2.492  -7.150   6.521
  379    HE1  TYR  57           2HE      TYR  57   6.891  -5.535   8.021
  380    HE2  TYR  57           1HE      TYR  57   4.118  -6.319   4.873
  381    HH   TYR  57           HH       TYR  57   6.501  -5.975   4.651
  382    H    GLU  58           H        GLU  58   1.654  -9.592   7.612
  383    HA   GLU  58           HA       GLU  58   3.900 -10.295   5.955
  384    HB2  GLU  58           1HB      GLU  58   2.254 -12.383   7.327
  385    HB3  GLU  58           2HB      GLU  58   2.859 -12.695   5.705
  386    HG2  GLU  58           1HG      GLU  58   4.468 -12.123   8.178
  387    HG3  GLU  58           2HG      GLU  58   4.394 -13.628   7.264
  388    H    GLN  59           H        GLN  59   3.222 -11.046   3.808
  389    HA   GLN  59           HA       GLN  59   0.563  -9.985   3.127
  390    HB2  GLN  59           1HB      GLN  59   2.191  -8.682   2.022
  391    HB3  GLN  59           2HB      GLN  59   3.148 -10.093   1.590
  392    HG2  GLN  59           1HG      GLN  59   0.389  -9.912   0.519
  393    HG3  GLN  59           2HG      GLN  59   1.613  -8.838  -0.157
  394   HE21  GLN  59          1HE2      GLN  59   1.326  -9.964  -2.146
  395   HE22  GLN  59          2HE2      GLN  59   2.095 -11.489  -2.407
  396    H    HIS  60           H        HIS  60  -0.873 -11.203   2.010
  397    HA   HIS  60           HA       HIS  60  -0.241 -14.033   1.721
  398    HB2  HIS  60           1HB      HIS  60  -2.376 -13.085   2.821
  399    HB3  HIS  60           2HB      HIS  60  -2.922 -12.779   1.175
  400    HD1  HIS  60           1HD      HIS  60  -3.677 -14.783  -0.209
  401    HD2  HIS  60           2HD      HIS  60  -2.189 -15.822   3.528
  402    HE1  HIS  60           1HE      HIS  60  -4.273 -17.207   0.101
  403    HA   PRO  61           HA       PRO  61   0.475 -13.545  -2.631
  404    HB2  PRO  61           1HB      PRO  61   0.655 -16.191  -3.212
  405    HB3  PRO  61           2HB      PRO  61   1.953 -15.291  -2.419
  406    HG2  PRO  61           1HG      PRO  61  -0.125 -17.076  -1.213
  407    HG3  PRO  61           2HG      PRO  61   1.607 -16.971  -0.849
  408    HD2  PRO  61           1HD      PRO  61  -0.280 -15.805   0.703
  409    HD3  PRO  61           2HD      PRO  61   1.342 -15.115   0.492
  410    H    GLY  62           H        GLY  62  -2.026 -15.631  -1.281
  411    HA2  GLY  62           1HA      GLY  62  -3.406 -16.344  -3.577
  412    HA3  GLY  62           2HA      GLY  62  -4.153 -16.101  -2.005
  413    H    ASP  63           H        ASP  63  -4.161 -13.554  -1.484
  414    HA   ASP  63           HA       ASP  63  -5.809 -12.424  -3.597
  415    HB2  ASP  63           1HB      ASP  63  -5.236 -11.242  -0.877
  416    HB3  ASP  63           2HB      ASP  63  -6.567 -10.846  -1.961
  417    H    GLY  64           H        GLY  64  -3.115 -11.281  -1.548
  418    HA2  GLY  64           1HA      GLY  64  -1.162 -10.339  -2.726
  419    HA3  GLY  64           2HA      GLY  64  -2.305  -9.551  -3.804
  420    H    HIS  65           H        HIS  65  -2.962  -9.727  -0.400
  421    HA   HIS  65           HA       HIS  65  -2.318  -6.860  -0.166
  422    HB2  HIS  65           1HB      HIS  65  -4.611  -8.416   1.040
  423    HB3  HIS  65           2HB      HIS  65  -4.187  -6.775   1.519
  424    HD1  HIS  65           1HD      HIS  65  -4.534  -4.898  -0.305
  425    HD2  HIS  65           2HD      HIS  65  -6.077  -8.629  -1.284
  426    HE1  HIS  65           1HE      HIS  65  -6.096  -4.494  -2.234
  427    H    PHE  66           H        PHE  66  -2.296  -6.262   2.316
  428    HA   PHE  66           HA       PHE  66  -0.459  -8.174   3.592
  429    HB2  PHE  66           1HB      PHE  66  -0.661  -5.171   3.742
  430    HB3  PHE  66           2HB      PHE  66   0.256  -6.103   4.921
  431    HD1  PHE  66           2HD      PHE  66   0.052  -5.078   1.403
  432    HD2  PHE  66           1HD      PHE  66   2.358  -7.088   4.362
  433    HE1  PHE  66           2HE      PHE  66   1.991  -5.073  -0.111
  434    HE2  PHE  66           1HE      PHE  66   4.302  -7.085   2.853
  435    HZ   PHE  66           HZ       PHE  66   4.120  -6.078   0.613
  436    H    TYR  67           H        TYR  67  -1.092  -9.153   5.392
  437    HA   TYR  67           HA       TYR  67  -3.194  -7.895   7.024
  438    HB2  TYR  67           1HB      TYR  67  -3.005 -10.862   6.483
  439    HB3  TYR  67           2HB      TYR  67  -4.280 -10.017   7.353
  440    HD1  TYR  67           2HD      TYR  67  -2.830 -10.663   4.031
  441    HD2  TYR  67           1HD      TYR  67  -6.050  -8.900   6.182
  442    HE1  TYR  67           2HE      TYR  67  -4.093 -10.426   1.934
  443    HE2  TYR  67           1HE      TYR  67  -7.323  -8.659   4.091
  444    HH   TYR  67           HH       TYR  67  -6.113  -9.966   1.043
  445    H    CYS  68           H        CYS  68  -3.293  -8.791   9.254
  446    HA   CYS  68           HA       CYS  68  -0.675  -8.804  10.404
  447    HB2  CYS  68           1HB      CYS  68  -1.817  -8.908  12.543
  448    HB3  CYS  68           2HB      CYS  68  -2.629  -7.742  11.502
  449    H    LEU  69           H        LEU  69  -0.180 -10.477  12.173
  450    HA   LEU  69           HA       LEU  69  -0.110 -13.058  10.903
  451    HB2  LEU  69           1HB      LEU  69   0.842 -12.361  13.670
  452    HB3  LEU  69           2HB      LEU  69   1.356 -13.711  12.661
  453    HG   LEU  69           HG       LEU  69   2.005 -10.792  12.282
  454   HD11  LEU  69          1HD1      LEU  69   3.346 -11.882  13.969
  455   HD12  LEU  69          2HD1      LEU  69   4.319 -11.600  12.526
  456   HD13  LEU  69          3HD1      LEU  69   3.700 -13.215  12.869
  457   HD21  LEU  69          1HD2      LEU  69   1.496 -12.119  10.156
  458   HD22  LEU  69          2HD2      LEU  69   2.959 -13.031  10.525
  459   HD23  LEU  69          3HD2      LEU  69   3.050 -11.291  10.250
  460    H    GLN  70           H        GLN  70  -2.632 -11.771  12.145
  461    HA   GLN  70           HA       GLN  70  -3.462 -14.183  13.616
  462    HB2  GLN  70           1HB      GLN  70  -3.242 -12.374  15.213
  463    HB3  GLN  70           2HB      GLN  70  -4.217 -11.316  14.201
  464    HG2  GLN  70           1HG      GLN  70  -6.183 -12.384  14.740
  465    HG3  GLN  70           2HG      GLN  70  -5.368 -13.882  15.189
  466   HE21  GLN  70          1HE2      GLN  70  -6.693 -13.788  17.100
  467   HE22  GLN  70          2HE2      GLN  70  -6.201 -12.810  18.436
  468    H    HIS  71           H        HIS  71  -3.963 -12.123  11.005
  469    HA   HIS  71           HA       HIS  71  -6.646 -13.258  10.564
  470    HB2  HIS  71           1HB      HIS  71  -5.620 -10.480  10.090
  471    HB3  HIS  71           2HB      HIS  71  -6.921 -11.116   9.087
  472    HD2  HIS  71           2HD      HIS  71  -7.864 -12.626  12.241
  473    HE1  HIS  71           1HE      HIS  71  -9.317  -8.658  12.614
  474    HE2  HIS  71           2HE      HIS  71  -9.346 -10.983  13.580
  475    H    LEU  72           H        LEU  72  -3.472 -12.762   9.390
  476    HA   LEU  72           HA       LEU  72  -3.738 -12.886   6.647
  477    HB2  LEU  72           1HB      LEU  72  -1.618 -12.596   7.913
  478    HB3  LEU  72           2HB      LEU  72  -1.648 -14.320   8.278
  479    HG   LEU  72           HG       LEU  72  -1.763 -14.448   5.606
  480   HD11  LEU  72          1HD1      LEU  72  -0.192 -11.940   6.181
  481   HD12  LEU  72          2HD1      LEU  72  -1.725 -12.025   5.314
  482   HD13  LEU  72          3HD1      LEU  72  -0.283 -12.777   4.631
  483   HD21  LEU  72          1HD2      LEU  72   0.563 -14.976   5.642
  484   HD22  LEU  72          2HD2      LEU  72  -0.126 -15.493   7.182
  485   HD23  LEU  72          3HD2      LEU  72   0.819 -14.006   7.093
  486    HA   PRO  73           HA       PRO  73  -5.781 -16.838   6.221
  487    HB2  PRO  73           1HB      PRO  73  -6.033 -16.703   3.521
  488    HB3  PRO  73           2HB      PRO  73  -7.092 -15.823   4.629
  489    HG2  PRO  73           1HG      PRO  73  -4.710 -14.841   3.105
  490    HG3  PRO  73           2HG      PRO  73  -6.280 -14.055   3.355
  491    HD2  PRO  73           1HD      PRO  73  -4.076 -13.398   4.786
  492    HD3  PRO  73           2HD      PRO  73  -5.715 -13.317   5.465
  493    H    GLN  74           H        GLN  74  -5.454 -18.553   4.239
  494    HA   GLN  74           HA       GLN  74  -2.632 -18.882   3.621
  495    HB2  GLN  74           1HB      GLN  74  -4.117 -20.528   5.595
  496    HB3  GLN  74           2HB      GLN  74  -3.064 -21.388   4.479
  497    HG2  GLN  74           1HG      GLN  74  -2.049 -19.027   6.002
  498    HG3  GLN  74           2HG      GLN  74  -2.139 -20.616   6.760
  499   HE21  GLN  74          1HE2      GLN  74   0.173 -18.941   6.055
  500   HE22  GLN  74          2HE2      GLN  74   1.171 -19.927   5.047
  501    H    THR  75           H        THR  75  -2.658 -19.235   1.508
  502    HA   THR  75           HA       THR  75  -3.452 -19.815  -0.575
  503    HB   THR  75           HB       THR  75  -3.652 -22.263  -0.867
  504    HG1  THR  75           1HG      THR  75  -4.453 -22.243   1.604
  505   HG21  THR  75          1HG2      THR  75  -1.415 -22.601  -0.654
  506   HG22  THR  75          2HG2      THR  75  -1.377 -22.022   1.012
  507   HG23  THR  75          3HG2      THR  75  -1.426 -20.870  -0.322
  508    H    ASP  76           H        ASP  76  -5.503 -18.589   0.762
  509    HA   ASP  76           HA       ASP  76  -7.873 -20.212   0.754
  510    HB2  ASP  76           1HB      ASP  76  -8.016 -18.474   2.294
  511    HB3  ASP  76           2HB      ASP  76  -7.291 -17.305   1.195
  512    H    SER  77           H        SER  77  -8.051 -21.052  -1.327
  513    HA   SER  77           HA       SER  77  -7.781 -19.824  -3.746
  514    HB2  SER  77           1HB      SER  77  -9.882 -21.844  -2.928
  515    HB3  SER  77           2HB      SER  77  -9.513 -21.415  -4.599
  516    HG   SER  77           HG       SER  77  -8.145 -23.029  -2.857
  517    H    GLY  78           H        GLY  78  -8.886 -18.399  -4.983
  518    HA2  GLY  78           1HA      GLY  78 -11.500 -17.461  -3.989
  519    HA3  GLY  78           2HA      GLY  78 -10.233 -16.311  -4.391
  520    HA   PRO  79           HA       PRO  79 -12.773 -17.923  -8.179
  521    HB2  PRO  79           1HB      PRO  79 -15.013 -16.393  -8.081
  522    HB3  PRO  79           2HB      PRO  79 -14.916 -18.002  -7.356
  523    HG2  PRO  79           1HG      PRO  79 -14.656 -15.318  -6.055
  524    HG3  PRO  79           2HG      PRO  79 -15.532 -16.754  -5.493
  525    HD2  PRO  79           1HD      PRO  79 -13.093 -16.070  -4.538
  526    HD3  PRO  79           2HD      PRO  79 -13.622 -17.758  -4.683
  527    H    SER  80           H        SER  80 -11.376 -16.911  -9.543
  528    HA   SER  80           HA       SER  80 -11.596 -13.984  -9.794
  529    HB2  SER  80           1HB      SER  80  -9.335 -15.137  -9.219
  530    HB3  SER  80           2HB      SER  80  -9.316 -15.585 -10.925
  531    HG   SER  80           HG       SER  80  -9.868 -13.119 -11.054
  532    H    SER  81           H        SER  81 -12.753 -13.333 -11.470
  533    HA   SER  81           HA       SER  81 -12.652 -14.915 -13.954
  534    HB2  SER  81           1HB      SER  81 -14.862 -14.866 -12.505
  535    HB3  SER  81           2HB      SER  81 -15.082 -13.302 -13.288
  536    HG   SER  81           HG       SER  81 -15.752 -15.564 -14.287
  537    H    GLY  82           H        GLY  82 -11.447 -13.767 -15.328
  538    HA2  GLY  82           1HA      GLY  82 -12.275 -11.033 -15.932
  539    HA3  GLY  82           2HA      GLY  82 -10.612 -11.254 -15.406
  Start of MODEL   20
    1    H1   GLY   1           H        GLY   1  -8.374  25.906 -37.531
    2    HA2  GLY   1           1HA      GLY   1  -7.519  26.303 -35.072
    3    HA3  GLY   1           2HA      GLY   1  -7.071  24.823 -35.907
    4    H    SER   2           H        SER   2  -6.023  28.193 -35.476
    5    HA   SER   2           HA       SER   2  -3.295  27.507 -36.162
    6    HB2  SER   2           1HB      SER   2  -4.775  30.027 -35.553
    7    HB3  SER   2           2HB      SER   2  -3.026  30.016 -35.331
    8    HG   SER   2           HG       SER   2  -4.398  30.242 -37.596
    9    H    SER   3           H        SER   3  -4.983  28.760 -33.287
   10    HA   SER   3           HA       SER   3  -2.789  28.716 -31.554
   11    HB2  SER   3           1HB      SER   3  -5.076  29.794 -31.180
   12    HB3  SER   3           2HB      SER   3  -5.633  28.195 -30.687
   13    HG   SER   3           HG       SER   3  -3.500  28.484 -29.319
   14    H    GLY   4           H        GLY   4  -1.551  26.959 -31.295
   15    HA2  GLY   4           1HA      GLY   4  -2.551  24.291 -31.436
   16    HA3  GLY   4           2HA      GLY   4  -0.934  24.769 -30.941
   17    H    SER   5           H        SER   5  -1.101  23.071 -29.348
   18    HA   SER   5           HA       SER   5  -1.971  24.075 -26.815
   19    HB2  SER   5           1HB      SER   5  -4.130  23.261 -27.528
   20    HB3  SER   5           2HB      SER   5  -3.435  21.719 -28.027
   21    HG   SER   5           HG       SER   5  -3.325  22.671 -25.362
   22    H    SER   6           H        SER   6  -0.521  23.420 -25.380
   23    HA   SER   6           HA       SER   6   1.042  21.000 -25.975
   24    HB2  SER   6           1HB      SER   6   2.293  23.157 -25.820
   25    HB3  SER   6           2HB      SER   6   1.779  23.291 -24.138
   26    HG   SER   6           HG       SER   6   3.581  21.494 -25.318
   27    H    GLY   7           H        GLY   7   0.136  19.317 -24.951
   28    HA2  GLY   7           1HA      GLY   7  -0.101  19.485 -22.038
   29    HA3  GLY   7           2HA      GLY   7  -1.532  19.007 -22.941
   30    H    GLN   8           H        GLN   8   1.629  18.062 -21.852
   31    HA   GLN   8           HA       GLN   8   1.094  15.325 -22.804
   32    HB2  GLN   8           1HB      GLN   8   3.077  16.463 -23.846
   33    HB3  GLN   8           2HB      GLN   8   3.810  16.523 -22.249
   34    HG2  GLN   8           1HG      GLN   8   3.951  14.161 -22.129
   35    HG3  GLN   8           2HG      GLN   8   2.939  13.964 -23.559
   36   HE21  GLN   8          1HE2      GLN   8   4.930  12.584 -23.999
   37   HE22  GLN   8          2HE2      GLN   8   6.203  13.348 -24.883
   38    H    HIS   9           H        HIS   9  -0.026  14.746 -20.922
   39    HA   HIS   9           HA       HIS   9   1.154  15.073 -18.325
   40    HB2  HIS   9           1HB      HIS   9  -1.125  13.230 -19.044
   41    HB3  HIS   9           2HB      HIS   9  -0.774  13.954 -17.478
   42    HD1  HIS   9           1HD      HIS   9  -3.522  14.279 -18.906
   43    HD2  HIS   9           2HD      HIS   9  -0.414  17.032 -19.064
   44    HE1  HIS   9           1HE      HIS   9  -4.603  16.482 -19.454
   45    H    GLN  10           H        GLN  10   3.049  14.010 -18.073
   46    HA   GLN  10           HA       GLN  10   3.109  11.141 -18.721
   47    HB2  GLN  10           1HB      GLN  10   5.258  13.230 -18.543
   48    HB3  GLN  10           2HB      GLN  10   5.655  11.524 -18.386
   49    HG2  GLN  10           1HG      GLN  10   4.161  12.657 -20.733
   50    HG3  GLN  10           2HG      GLN  10   5.916  12.502 -20.680
   51   HE21  GLN  10          1HE2      GLN  10   5.777  11.107 -22.489
   52   HE22  GLN  10          2HE2      GLN  10   5.308   9.456 -22.302
   53    H    GLU  11           H        GLU  11   4.268   9.730 -17.221
   54    HA   GLU  11           HA       GLU  11   3.302   9.548 -14.740
   55    HB2  GLU  11           1HB      GLU  11   4.756   7.839 -15.635
   56    HB3  GLU  11           2HB      GLU  11   6.138   8.924 -15.571
   57    HG2  GLU  11           1HG      GLU  11   6.204   8.862 -13.215
   58    HG3  GLU  11           2HG      GLU  11   4.620   8.094 -13.119
   59    H    ALA  12           H        ALA  12   3.636  10.348 -12.707
   60    HA   ALA  12           HA       ALA  12   4.312  12.955 -12.294
   61    HB1  ALA  12           1HB      ALA  12   3.362  12.234 -10.398
   62    HB2  ALA  12           2HB      ALA  12   4.011  10.603 -10.576
   63    HB3  ALA  12           3HB      ALA  12   5.014  11.882  -9.892
   64    H    GLY  13           H        GLY  13   6.479  10.171 -11.755
   65    HA2  GLY  13           1HA      GLY  13   8.774  10.672 -12.790
   66    HA3  GLY  13           2HA      GLY  13   8.745  12.054 -11.705
   67    H    ALA  14           H        ALA  14   8.460  11.536  -9.361
   68    HA   ALA  14           HA       ALA  14   9.748   8.971  -8.689
   69    HB1  ALA  14           1HB      ALA  14  10.475  10.737  -6.676
   70    HB2  ALA  14           2HB      ALA  14  11.504  10.135  -7.976
   71    HB3  ALA  14           3HB      ALA  14  10.652  11.667  -8.164
   72    H    GLY  15           H        GLY  15   7.591   8.166  -8.301
   73    HA2  GLY  15           1HA      GLY  15   5.772   9.309  -6.495
   74    HA3  GLY  15           2HA      GLY  15   5.836   7.608  -6.934
   75    H    ASP  16           H        ASP  16   6.635   9.984  -4.570
   76    HA   ASP  16           HA       ASP  16   7.602   7.842  -2.794
   77    HB2  ASP  16           1HB      ASP  16   8.520  10.702  -2.565
   78    HB3  ASP  16           2HB      ASP  16   9.226   9.264  -1.833
   79    H    LEU  17           H        LEU  17   4.950   8.360  -2.895
   80    HA   LEU  17           HA       LEU  17   4.473   9.833  -0.390
   81    HB2  LEU  17           1HB      LEU  17   2.457   9.618  -2.605
   82    HB3  LEU  17           2HB      LEU  17   2.432  10.685  -1.203
   83    HG   LEU  17           HG       LEU  17   4.419  10.919  -3.458
   84   HD11  LEU  17          1HD1      LEU  17   2.885  13.056  -3.799
   85   HD12  LEU  17          2HD1      LEU  17   1.664  11.968  -3.140
   86   HD13  LEU  17          3HD1      LEU  17   2.548  11.521  -4.599
   87   HD21  LEU  17          1HD2      LEU  17   4.924  13.062  -2.513
   88   HD22  LEU  17          2HD2      LEU  17   5.065  11.848  -1.241
   89   HD23  LEU  17          3HD2      LEU  17   3.642  12.890  -1.314
   90    H    CYS  18           H        CYS  18   3.252   8.836   1.127
   91    HA   CYS  18           HA       CYS  18   3.051   6.220   1.500
   92    HB2  CYS  18           1HB      CYS  18   2.195   7.949   3.076
   93    HB3  CYS  18           2HB      CYS  18   0.736   8.072   2.099
   94    H    ALA  19           H        ALA  19   2.209   4.497   0.534
   95    HA   ALA  19           HA       ALA  19   0.446   4.849  -1.736
   96    HB1  ALA  19           1HB      ALA  19   1.835   3.213  -2.387
   97    HB2  ALA  19           2HB      ALA  19   2.220   2.742  -0.731
   98    HB3  ALA  19           3HB      ALA  19   0.739   2.159  -1.492
   99    H    LEU  20           H        LEU  20  -0.375   5.161   1.208
  100    HA   LEU  20           HA       LEU  20  -2.696   3.349   1.090
  101    HB2  LEU  20           1HB      LEU  20  -0.924   4.145   3.324
  102    HB3  LEU  20           2HB      LEU  20  -2.643   3.996   3.684
  103    HG   LEU  20           HG       LEU  20  -1.102   1.769   2.383
  104   HD11  LEU  20          1HD1      LEU  20  -0.467   0.883   4.423
  105   HD12  LEU  20          2HD1      LEU  20  -1.605   1.881   5.329
  106   HD13  LEU  20          3HD1      LEU  20  -0.151   2.605   4.641
  107   HD21  LEU  20          1HD2      LEU  20  -3.159   0.930   4.140
  108   HD22  LEU  20          2HD2      LEU  20  -3.085   0.777   2.384
  109   HD23  LEU  20          3HD2      LEU  20  -3.815   2.208   3.116
  110    H    CYS  21           H        CYS  21  -1.578   6.516   2.258
  111    HA   CYS  21           HA       CYS  21  -4.349   7.483   2.153
  112    HB2  CYS  21           1HB      CYS  21  -3.527   9.392   3.489
  113    HB3  CYS  21           2HB      CYS  21  -3.224   7.850   4.282
  114    H    GLY  22           H        GLY  22  -1.054   8.400   1.170
  115    HA2  GLY  22           1HA      GLY  22  -0.672   9.145  -1.106
  116    HA3  GLY  22           2HA      GLY  22  -2.261   9.896  -1.068
  117    H    GLU  23           H        GLU  23   0.334  10.040   1.345
  118    HA   GLU  23           HA       GLU  23   0.473  12.947   0.879
  119    HB2  GLU  23           1HB      GLU  23   0.607  11.428   3.485
  120    HB3  GLU  23           2HB      GLU  23   1.037  13.125   3.327
  121    HG2  GLU  23           1HG      GLU  23  -1.649  12.115   2.473
  122    HG3  GLU  23           2HG      GLU  23  -1.311  12.535   4.152
  123    H    HIS  24           H        HIS  24   2.558  13.860   1.945
  124    HA   HIS  24           HA       HIS  24   4.760  12.799   0.562
  125    HB2  HIS  24           1HB      HIS  24   4.301  15.190   1.595
  126    HB3  HIS  24           2HB      HIS  24   5.184  14.524   2.965
  127    HD1  HIS  24           1HD      HIS  24   5.638  15.885  -0.432
  128    HD2  HIS  24           2HD      HIS  24   7.909  13.853   2.392
  129    HE1  HIS  24           1HE      HIS  24   8.025  16.136  -1.182
  130    H    LEU  25           H        LEU  25   6.609  11.714   1.273
  131    HA   LEU  25           HA       LEU  25   6.256  10.233   3.794
  132    HB2  LEU  25           1HB      LEU  25   7.458   9.461   1.160
  133    HB3  LEU  25           2HB      LEU  25   7.890   8.605   2.639
  134    HG   LEU  25           HG       LEU  25   5.058   8.863   1.642
  135   HD11  LEU  25          1HD1      LEU  25   7.227   7.015   0.859
  136   HD12  LEU  25          2HD1      LEU  25   5.817   7.563  -0.046
  137   HD13  LEU  25          3HD1      LEU  25   5.646   6.300   1.173
  138   HD21  LEU  25          1HD2      LEU  25   5.216   6.598   3.121
  139   HD22  LEU  25          2HD2      LEU  25   4.717   8.168   3.752
  140   HD23  LEU  25          3HD2      LEU  25   6.383   7.625   3.953
  141    H    TYR  26           H        TYR  26   8.059   9.878   5.123
  142    HA   TYR  26           HA       TYR  26  10.211  11.837   4.736
  143    HB2  TYR  26           1HB      TYR  26   8.705  11.751   6.853
  144    HB3  TYR  26           2HB      TYR  26   9.697  10.370   7.306
  145    HD1  TYR  26           1HD      TYR  26  10.287  13.800   5.923
  146    HD2  TYR  26           2HD      TYR  26  11.383  10.855   8.791
  147    HE1  TYR  26           1HE      TYR  26  11.985  15.329   6.834
  148    HE2  TYR  26           2HE      TYR  26  13.083  12.376   9.711
  149    HH   TYR  26           HH       TYR  26  13.156  15.497   9.336
  150    H    VAL  27           H        VAL  27  12.256  10.991   6.124
  151    HA   VAL  27           HA       VAL  27  13.229   8.734   4.621
  152    HB   VAL  27           HB       VAL  27  14.586  10.358   6.777
  153   HG11  VAL  27          1HG1      VAL  27  15.790   8.374   6.712
  154   HG12  VAL  27          2HG1      VAL  27  15.539   8.161   4.978
  155   HG13  VAL  27          3HG1      VAL  27  16.654   9.396   5.564
  156   HG21  VAL  27          1HG2      VAL  27  15.034  10.517   3.808
  157   HG22  VAL  27          2HG2      VAL  27  13.875  11.546   4.649
  158   HG23  VAL  27          3HG2      VAL  27  15.589  11.629   5.059
  159    H    LEU  28           H        LEU  28  12.876   9.466   8.092
  160    HA   LEU  28           HA       LEU  28  13.248   6.647   8.733
  161    HB2  LEU  28           1HB      LEU  28  12.922   9.089  10.468
  162    HB3  LEU  28           2HB      LEU  28  13.119   7.452  11.091
  163    HG   LEU  28           HG       LEU  28  15.316   7.571   9.589
  164   HD11  LEU  28          1HD1      LEU  28  14.836   9.829   8.768
  165   HD12  LEU  28          2HD1      LEU  28  16.329   9.774   9.705
  166   HD13  LEU  28          3HD1      LEU  28  14.860  10.431  10.426
  167   HD21  LEU  28          1HD2      LEU  28  15.045   8.781  12.339
  168   HD22  LEU  28          2HD2      LEU  28  16.538   8.185  11.614
  169   HD23  LEU  28          3HD2      LEU  28  15.224   7.065  11.976
  170    H    GLU  29           H        GLU  29  10.843   7.626   7.323
  171    HA   GLU  29           HA       GLU  29   8.859   6.548   9.200
  172    HB2  GLU  29           1HB      GLU  29   8.376   8.900   7.364
  173    HB3  GLU  29           2HB      GLU  29   7.197   8.164   8.441
  174    HG2  GLU  29           1HG      GLU  29   8.739   8.779  10.342
  175    HG3  GLU  29           2HG      GLU  29   9.638   9.748   9.176
  176    H    ARG  30           H        ARG  30   9.808   7.177   5.870
  177    HA   ARG  30           HA       ARG  30   7.710   5.827   4.586
  178    HB2  ARG  30           1HB      ARG  30   9.060   5.869   2.626
  179    HB3  ARG  30           2HB      ARG  30   9.413   7.346   3.513
  180    HG2  ARG  30           1HG      ARG  30  11.452   6.300   4.404
  181    HG3  ARG  30           2HG      ARG  30  11.104   4.856   3.450
  182    HD2  ARG  30           1HD      ARG  30  11.225   6.190   1.399
  183    HD3  ARG  30           2HD      ARG  30  11.580   7.627   2.357
  184    HE   ARG  30           HE       ARG  30  13.545   5.982   3.110
  185   HH11  ARG  30          2HH1      ARG  30  12.317   6.806  -0.041
  186   HH12  ARG  30          1HH1      ARG  30  13.840   6.583  -0.837
  187   HH21  ARG  30          2HH2      ARG  30  15.556   5.685   2.075
  188   HH22  ARG  30          1HH2      ARG  30  15.682   5.945   0.368
  189    H    LEU  31           H        LEU  31   7.278   3.732   4.247
  190    HA   LEU  31           HA       LEU  31   9.204   1.765   5.280
  191    HB2  LEU  31           1HB      LEU  31   6.238   1.891   5.168
  192    HB3  LEU  31           2HB      LEU  31   7.000   0.305   5.056
  193    HG   LEU  31           HG       LEU  31   8.208   0.947   7.227
  194   HD11  LEU  31          1HD1      LEU  31   6.932   3.367   6.769
  195   HD12  LEU  31          2HD1      LEU  31   7.745   2.864   8.250
  196   HD13  LEU  31          3HD1      LEU  31   6.008   2.620   8.072
  197   HD21  LEU  31          1HD2      LEU  31   6.153   0.352   8.573
  198   HD22  LEU  31          2HD2      LEU  31   6.578  -0.763   7.274
  199   HD23  LEU  31          3HD2      LEU  31   5.258   0.386   7.053
  200    H    CYS  32           H        CYS  32  10.463   1.211   3.581
  201    HA   CYS  32           HA       CYS  32   9.536   0.968   0.913
  202    HB2  CYS  32           1HB      CYS  32  11.740  -0.138   0.510
  203    HB3  CYS  32           2HB      CYS  32  11.867   1.419   1.319
  204    HG   CYS  32           HG       CYS  32  13.673  -0.737   2.224
  205    H    VAL  33           H        VAL  33   7.933  -0.455   0.531
  206    HA   VAL  33           HA       VAL  33   8.447  -3.270   1.231
  207    HB   VAL  33           HB       VAL  33   5.750  -1.907   1.225
  208   HG11  VAL  33          1HG1      VAL  33   5.113  -4.172   2.285
  209   HG12  VAL  33          2HG1      VAL  33   5.317  -4.085   0.534
  210   HG13  VAL  33          3HG1      VAL  33   6.598  -4.763   1.540
  211   HG21  VAL  33          1HG2      VAL  33   6.316  -1.302   3.299
  212   HG22  VAL  33          2HG2      VAL  33   6.169  -3.009   3.717
  213   HG23  VAL  33          3HG2      VAL  33   7.745  -2.336   3.300
  214    H    ASN  34           H        ASN  34   9.052  -4.109  -0.681
  215    HA   ASN  34           HA       ASN  34   8.953  -4.829  -2.836
  216    HB2  ASN  34           1HB      ASN  34   6.076  -4.422  -2.136
  217    HB3  ASN  34           2HB      ASN  34   6.495  -4.752  -3.815
  218   HD21  ASN  34          1HD2      ASN  34   6.103  -6.038  -0.680
  219   HD22  ASN  34          2HD2      ASN  34   6.504  -7.677  -1.053
  220    H    GLY  35           H        GLY  35   9.585  -2.072  -2.336
  221    HA2  GLY  35           1HA      GLY  35  10.245  -0.437  -3.897
  222    HA3  GLY  35           2HA      GLY  35   9.023  -1.037  -5.009
  223    H    HIS  36           H        HIS  36   6.883  -0.990  -3.044
  224    HA   HIS  36           HA       HIS  36   6.208   1.814  -3.289
  225    HB2  HIS  36           1HB      HIS  36   4.608  -0.501  -2.176
  226    HB3  HIS  36           2HB      HIS  36   3.986   1.119  -2.481
  227    HD1  HIS  36           1HD      HIS  36   5.141   1.608  -5.284
  228    HD2  HIS  36           2HD      HIS  36   3.329  -1.938  -4.099
  229    HE1  HIS  36           1HE      HIS  36   4.352   0.514  -7.407
  230    H    PHE  37           H        PHE  37   6.059   3.279  -1.677
  231    HA   PHE  37           HA       PHE  37   7.034   2.441   0.957
  232    HB2  PHE  37           1HB      PHE  37   6.791   5.207  -0.245
  233    HB3  PHE  37           2HB      PHE  37   7.473   4.839   1.336
  234    HD1  PHE  37           1HD      PHE  37   7.944   4.411  -2.298
  235    HD2  PHE  37           2HD      PHE  37   9.702   4.101   1.566
  236    HE1  PHE  37           1HE      PHE  37  10.155   4.098  -3.332
  237    HE2  PHE  37           2HE      PHE  37  11.916   3.789   0.538
  238    HZ   PHE  37           HZ       PHE  37  12.144   3.788  -1.914
  239    H    PHE  38           H        PHE  38   5.996   3.111   2.876
  240    HA   PHE  38           HA       PHE  38   3.339   4.284   2.658
  241    HB2  PHE  38           1HB      PHE  38   3.758   1.633   4.051
  242    HB3  PHE  38           2HB      PHE  38   2.237   2.499   3.858
  243    HD1  PHE  38           1HD      PHE  38   4.948   0.872   1.906
  244    HD2  PHE  38           2HD      PHE  38   0.859   2.044   2.052
  245    HE1  PHE  38           1HE      PHE  38   4.528  -0.344  -0.191
  246    HE2  PHE  38           2HE      PHE  38   0.432   0.830  -0.044
  247    HZ   PHE  38           HZ       PHE  38   2.267  -0.368  -1.168
  248    H    HIS  39           H        HIS  39   2.404   4.753   4.828
  249    HA   HIS  39           HA       HIS  39   4.424   5.926   6.501
  250    HB2  HIS  39           1HB      HIS  39   1.427   5.919   6.474
  251    HB3  HIS  39           2HB      HIS  39   2.282   6.473   7.911
  252    HD2  HIS  39           2HD      HIS  39   4.657   8.000   5.919
  253    HE1  HIS  39           1HE      HIS  39   1.320  10.471   5.049
  254    HE2  HIS  39           2HE      HIS  39   3.820  10.217   4.883
  255    H    ARG  40           H        ARG  40   4.507   5.608   8.844
  256    HA   ARG  40           HA       ARG  40   4.613   2.808   9.482
  257    HB2  ARG  40           1HB      ARG  40   5.463   5.342  10.784
  258    HB3  ARG  40           2HB      ARG  40   5.190   3.953  11.828
  259    HG2  ARG  40           1HG      ARG  40   6.743   2.670  10.292
  260    HG3  ARG  40           2HG      ARG  40   7.165   4.231   9.585
  261    HD2  ARG  40           1HD      ARG  40   8.800   3.961  11.198
  262    HD3  ARG  40           2HD      ARG  40   7.601   4.943  12.038
  263    HE   ARG  40           HE       ARG  40   7.508   2.038  12.369
  264   HH11  ARG  40          2HH1      ARG  40   8.189   5.189  13.682
  265   HH12  ARG  40          1HH1      ARG  40   8.222   4.641  15.326
  266   HH21  ARG  40          2HH2      ARG  40   7.549   1.304  14.528
  267   HH22  ARG  40          1HH2      ARG  40   7.858   2.430  15.805
  268    H    SER  41           H        SER  41   2.184   5.079   9.562
  269    HA   SER  41           HA       SER  41   0.824   3.787  11.829
  270    HB2  SER  41           1HB      SER  41   0.891   6.134  12.186
  271    HB3  SER  41           2HB      SER  41   0.446   6.478  10.514
  272    HG   SER  41           HG       SER  41  -1.329   6.733  11.924
  273    H    CYS  42           H        CYS  42   0.320   4.880   8.490
  274    HA   CYS  42           HA       CYS  42  -2.277   3.870   8.171
  275    HB2  CYS  42           1HB      CYS  42  -0.069   4.424   6.191
  276    HB3  CYS  42           2HB      CYS  42  -1.668   3.877   5.695
  277    H    PHE  43           H        PHE  43   0.878   2.410   7.459
  278    HA   PHE  43           HA       PHE  43   0.019   0.041   6.305
  279    HB2  PHE  43           1HB      PHE  43   2.427   1.003   6.729
  280    HB3  PHE  43           2HB      PHE  43   2.349   0.017   8.186
  281    HD1  PHE  43           1HD      PHE  43   1.073  -2.402   7.427
  282    HD2  PHE  43           2HD      PHE  43   3.768  -0.003   5.169
  283    HE1  PHE  43           1HE      PHE  43   1.737  -4.381   6.124
  284    HE2  PHE  43           2HE      PHE  43   4.436  -1.977   3.862
  285    HZ   PHE  43           HZ       PHE  43   3.419  -4.170   4.338
  286    H    ARG  44           H        ARG  44  -1.897  -0.581   7.405
  287    HA   ARG  44           HA       ARG  44  -1.363  -2.052   9.895
  288    HB2  ARG  44           1HB      ARG  44  -3.921  -0.556   9.311
  289    HB3  ARG  44           2HB      ARG  44  -3.507  -1.406  10.793
  290    HG2  ARG  44           1HG      ARG  44  -1.792   0.203  11.297
  291    HG3  ARG  44           2HG      ARG  44  -2.043   1.006   9.746
  292    HD2  ARG  44           1HD      ARG  44  -4.194   1.766  10.387
  293    HD3  ARG  44           2HD      ARG  44  -4.216   0.719  11.805
  294    HE   ARG  44           HE       ARG  44  -2.073   2.337  12.222
  295   HH11  ARG  44          2HH1      ARG  44  -5.437   2.892  11.517
  296   HH12  ARG  44          1HH1      ARG  44  -5.503   4.396  12.374
  297   HH21  ARG  44          2HH2      ARG  44  -2.147   4.317  13.353
  298   HH22  ARG  44          1HH2      ARG  44  -3.630   5.206  13.416
  299    H    CYS  45           H        CYS  45  -3.308  -3.591  10.342
  300    HA   CYS  45           HA       CYS  45  -3.375  -5.510   8.322
  301    HB2  CYS  45           1HB      CYS  45  -3.843  -5.877  10.771
  302    HB3  CYS  45           2HB      CYS  45  -5.443  -5.193  10.502
  303    H    HIS  46           H        HIS  46  -5.364  -6.374   7.259
  304    HA   HIS  46           HA       HIS  46  -6.868  -4.148   6.083
  305    HB2  HIS  46           1HB      HIS  46  -5.721  -5.467   4.440
  306    HB3  HIS  46           2HB      HIS  46  -6.347  -6.965   5.123
  307    HD1  HIS  46           1HD      HIS  46  -7.274  -4.123   2.898
  308    HD2  HIS  46           2HD      HIS  46  -8.999  -7.582   4.420
  309    HE1  HIS  46           1HE      HIS  46  -9.376  -4.470   1.561
  310    H    THR  47           H        THR  47  -7.226  -6.412   8.452
  311    HA   THR  47           HA       THR  47 -10.148  -6.528   8.068
  312    HB   THR  47           HB       THR  47  -8.281  -8.571   9.256
  313    HG1  THR  47           1HG      THR  47  -9.887  -8.340   7.012
  314   HG21  THR  47          1HG2      THR  47 -11.292  -8.535   9.493
  315   HG22  THR  47          2HG2      THR  47 -10.167  -8.219  10.814
  316   HG23  THR  47          3HG2      THR  47 -10.210  -9.809  10.054
  317    H    CYS  48           H        CYS  48  -7.512  -6.212  10.398
  318    HA   CYS  48           HA       CYS  48  -9.443  -5.139  12.348
  319    HB2  CYS  48           1HB      CYS  48  -7.839  -5.752  14.096
  320    HB3  CYS  48           2HB      CYS  48  -8.286  -7.157  13.134
  321    H    GLU  49           H        GLU  49  -7.124  -4.241  10.170
  322    HA   GLU  49           HA       GLU  49  -5.784  -2.415   9.877
  323    HB2  GLU  49           1HB      GLU  49  -8.064  -1.251  11.476
  324    HB3  GLU  49           2HB      GLU  49  -6.813  -0.267  10.729
  325    HG2  GLU  49           1HG      GLU  49  -7.440  -1.197   8.532
  326    HG3  GLU  49           2HG      GLU  49  -8.748  -2.085   9.312
  327    H    ALA  50           H        ALA  50  -4.750  -3.997  11.828
  328    HA   ALA  50           HA       ALA  50  -4.071  -2.261  14.083
  329    HB1  ALA  50           1HB      ALA  50  -3.157  -5.098  13.723
  330    HB2  ALA  50           2HB      ALA  50  -3.320  -4.170  15.215
  331    HB3  ALA  50           3HB      ALA  50  -4.759  -4.706  14.347
  332    H    THR  51           H        THR  51  -2.123  -1.337  14.343
  333    HA   THR  51           HA       THR  51  -0.396  -0.779  12.332
  334    HB   THR  51           HB       THR  51   0.464  -1.190  15.203
  335    HG1  THR  51           1HG      THR  51  -0.881   0.918  13.878
  336   HG21  THR  51          1HG2      THR  51   2.324  -0.915  13.612
  337   HG22  THR  51          2HG2      THR  51   2.179   0.466  14.700
  338   HG23  THR  51          3HG2      THR  51   1.598   0.587  13.040
  339    H    LEU  52           H        LEU  52   0.232  -2.377  10.955
  340    HA   LEU  52           HA       LEU  52   1.228  -4.903  11.845
  341    HB2  LEU  52           1HB      LEU  52   1.427  -3.580   9.144
  342    HB3  LEU  52           2HB      LEU  52   1.783  -5.271   9.487
  343    HG   LEU  52           HG       LEU  52  -0.930  -3.983   9.780
  344   HD11  LEU  52          1HD1      LEU  52   0.235  -4.405   7.423
  345   HD12  LEU  52          2HD1      LEU  52  -1.487  -4.667   7.693
  346   HD13  LEU  52          3HD1      LEU  52  -0.373  -6.034   7.719
  347   HD21  LEU  52          1HD2      LEU  52  -0.304  -5.993  11.230
  348   HD22  LEU  52          2HD2      LEU  52  -0.286  -6.916   9.727
  349   HD23  LEU  52          3HD2      LEU  52  -1.769  -6.117  10.255
  350    H    TRP  53           H        TRP  53   2.984  -4.604  13.178
  351    HA   TRP  53           HA       TRP  53   5.155  -2.885  12.609
  352    HB2  TRP  53           1HB      TRP  53   5.593  -5.326  14.262
  353    HB3  TRP  53           2HB      TRP  53   6.085  -3.661  14.561
  354    HD1  TRP  53           HD       TRP  53   3.026  -5.970  14.893
  355    HE1  TRP  53           1HE      TRP  53   1.423  -4.946  16.626
  356    HE3  TRP  53           3HE      TRP  53   5.418  -1.521  15.681
  357    HZ2  TRP  53           2HZ      TRP  53   1.201  -2.567  18.128
  358    HZ3  TRP  53           3HZ      TRP  53   4.444   0.074  17.282
  359    HH2  TRP  53           HH       TRP  53   2.379  -0.440  18.478
  360    HA   PRO  54           HA       PRO  54   7.612  -5.133   9.751
  361    HB2  PRO  54           1HB      PRO  54  10.124  -4.553  10.603
  362    HB3  PRO  54           2HB      PRO  54   9.086  -3.371   9.798
  363    HG2  PRO  54           1HG      PRO  54   9.632  -3.734  12.719
  364    HG3  PRO  54           2HG      PRO  54   9.535  -2.235  11.777
  365    HD2  PRO  54           1HD      PRO  54   7.494  -3.120  13.320
  366    HD3  PRO  54           2HD      PRO  54   7.231  -2.208  11.819
  367    H    GLY  55           H        GLY  55   6.968  -6.333  12.612
  368    HA2  GLY  55           1HA      GLY  55   8.608  -8.708  12.169
  369    HA3  GLY  55           2HA      GLY  55   8.770  -7.915  13.729
  370    H    GLY  56           H        GLY  56   5.779  -8.174  11.887
  371    HA2  GLY  56           1HA      GLY  56   4.766 -10.458  13.224
  372    HA3  GLY  56           2HA      GLY  56   4.226  -8.999  14.043
  373    H    TYR  57           H        TYR  57   4.661  -9.806  10.602
  374    HA   TYR  57           HA       TYR  57   1.821  -9.764  10.126
  375    HB2  TYR  57           1HB      TYR  57   1.650  -7.809   8.853
  376    HB3  TYR  57           2HB      TYR  57   2.644  -7.315  10.219
  377    HD1  TYR  57           2HD      TYR  57   5.209  -7.380   9.866
  378    HD2  TYR  57           1HD      TYR  57   2.389  -7.423   6.680
  379    HE1  TYR  57           2HE      TYR  57   6.954  -6.598   8.318
  380    HE2  TYR  57           1HE      TYR  57   4.126  -6.642   5.124
  381    HH   TYR  57           HH       TYR  57   7.292  -5.657   6.249
  382    H    GLU  58           H        GLU  58   1.363  -9.989   7.726
  383    HA   GLU  58           HA       GLU  58   3.542 -11.055   6.140
  384    HB2  GLU  58           1HB      GLU  58   1.477 -12.757   7.425
  385    HB3  GLU  58           2HB      GLU  58   1.871 -13.120   5.751
  386    HG2  GLU  58           1HG      GLU  58   4.083 -12.782   7.711
  387    HG3  GLU  58           2HG      GLU  58   3.146 -14.275   7.719
  388    H    GLN  59           H        GLN  59   2.984 -11.369   3.921
  389    HA   GLN  59           HA       GLN  59   0.544  -9.916   3.144
  390    HB2  GLN  59           1HB      GLN  59   2.583  -8.752   2.493
  391    HB3  GLN  59           2HB      GLN  59   3.173 -10.195   1.678
  392    HG2  GLN  59           1HG      GLN  59   1.001  -9.988   0.281
  393    HG3  GLN  59           2HG      GLN  59   0.991  -8.326   0.869
  394   HE21  GLN  59          1HE2      GLN  59   1.134  -8.541  -1.732
  395   HE22  GLN  59          2HE2      GLN  59   2.727  -8.244  -2.330
  396    H    HIS  60           H        HIS  60  -0.962 -11.418   2.716
  397    HA   HIS  60           HA       HIS  60  -0.485 -14.011   1.764
  398    HB2  HIS  60           1HB      HIS  60  -2.602 -13.043   2.868
  399    HB3  HIS  60           2HB      HIS  60  -3.043 -12.507   1.249
  400    HD1  HIS  60           1HD      HIS  60  -4.018 -14.227  -0.315
  401    HD2  HIS  60           2HD      HIS  60  -2.494 -15.897   3.170
  402    HE1  HIS  60           1HE      HIS  60  -4.760 -16.629  -0.341
  403    HA   PRO  61           HA       PRO  61   0.483 -13.129  -2.476
  404    HB2  PRO  61           1HB      PRO  61   0.517 -15.707  -3.326
  405    HB3  PRO  61           2HB      PRO  61   1.830 -14.988  -2.386
  406    HG2  PRO  61           1HG      PRO  61  -0.421 -16.735  -1.468
  407    HG3  PRO  61           2HG      PRO  61   1.294 -16.793  -1.021
  408    HD2  PRO  61           1HD      PRO  61  -0.589 -15.661   0.563
  409    HD3  PRO  61           2HD      PRO  61   1.084 -15.071   0.497
  410    H    GLY  62           H        GLY  62  -2.060 -15.499  -1.685
  411    HA2  GLY  62           1HA      GLY  62  -3.432 -15.860  -3.942
  412    HA3  GLY  62           2HA      GLY  62  -4.266 -15.504  -2.436
  413    H    ASP  63           H        ASP  63  -4.356 -13.079  -1.917
  414    HA   ASP  63           HA       ASP  63  -5.508 -11.774  -4.233
  415    HB2  ASP  63           1HB      ASP  63  -5.475 -11.212  -1.284
  416    HB3  ASP  63           2HB      ASP  63  -5.961  -9.954  -2.418
  417    H    GLY  64           H        GLY  64  -3.092 -10.879  -1.758
  418    HA2  GLY  64           1HA      GLY  64  -0.921 -10.055  -2.610
  419    HA3  GLY  64           2HA      GLY  64  -1.841  -9.140  -3.795
  420    H    HIS  65           H        HIS  65  -2.652  -9.497  -0.385
  421    HA   HIS  65           HA       HIS  65  -2.086  -6.627  -0.027
  422    HB2  HIS  65           1HB      HIS  65  -4.386  -8.264   1.050
  423    HB3  HIS  65           2HB      HIS  65  -3.993  -6.646   1.624
  424    HD1  HIS  65           1HD      HIS  65  -4.031  -4.753  -0.362
  425    HD2  HIS  65           2HD      HIS  65  -6.083  -8.297  -1.063
  426    HE1  HIS  65           1HE      HIS  65  -5.624  -4.248  -2.241
  427    H    PHE  66           H        PHE  66  -2.333  -6.255   2.577
  428    HA   PHE  66           HA       PHE  66  -0.434  -8.159   3.784
  429    HB2  PHE  66           1HB      PHE  66  -0.681  -5.169   4.128
  430    HB3  PHE  66           2HB      PHE  66   0.275  -6.181   5.205
  431    HD1  PHE  66           1HD      PHE  66   2.333  -7.210   4.449
  432    HD2  PHE  66           2HD      PHE  66   0.031  -4.728   1.868
  433    HE1  PHE  66           1HE      PHE  66   4.246  -7.042   2.910
  434    HE2  PHE  66           2HE      PHE  66   1.940  -4.557   0.325
  435    HZ   PHE  66           HZ       PHE  66   4.050  -5.715   0.845
  436    H    TYR  67           H        TYR  67  -1.131  -9.231   5.504
  437    HA   TYR  67           HA       TYR  67  -3.259  -8.045   7.152
  438    HB2  TYR  67           1HB      TYR  67  -3.134 -10.976   6.433
  439    HB3  TYR  67           2HB      TYR  67  -4.421 -10.139   7.294
  440    HD1  TYR  67           2HD      TYR  67  -2.844 -10.645   4.005
  441    HD2  TYR  67           1HD      TYR  67  -6.107  -8.912   6.114
  442    HE1  TYR  67           2HE      TYR  67  -4.006 -10.255   1.873
  443    HE2  TYR  67           1HE      TYR  67  -7.280  -8.518   3.988
  444    HH   TYR  67           HH       TYR  67  -6.341  -9.944   1.080
  445    H    CYS  68           H        CYS  68  -3.423  -9.036   9.318
  446    HA   CYS  68           HA       CYS  68  -0.829  -9.245  10.506
  447    HB2  CYS  68           1HB      CYS  68  -2.012  -9.389  12.620
  448    HB3  CYS  68           2HB      CYS  68  -2.740  -8.131  11.626
  449    H    LEU  69           H        LEU  69  -0.455 -11.027  12.195
  450    HA   LEU  69           HA       LEU  69  -0.517 -13.545  10.799
  451    HB2  LEU  69           1HB      LEU  69   0.455 -13.022  13.599
  452    HB3  LEU  69           2HB      LEU  69   0.888 -14.366  12.543
  453    HG   LEU  69           HG       LEU  69   1.698 -11.479  12.210
  454   HD11  LEU  69          1HD1      LEU  69   3.436 -13.885  12.687
  455   HD12  LEU  69          2HD1      LEU  69   2.827 -12.866  13.991
  456   HD13  LEU  69          3HD1      LEU  69   3.885 -12.181  12.758
  457   HD21  LEU  69          1HD2      LEU  69   1.216 -12.845  10.091
  458   HD22  LEU  69          2HD2      LEU  69   2.648 -13.776  10.532
  459   HD23  LEU  69          3HD2      LEU  69   2.782 -12.044  10.224
  460    H    GLN  70           H        GLN  70  -2.975 -12.182  12.076
  461    HA   GLN  70           HA       GLN  70  -3.948 -14.604  13.439
  462    HB2  GLN  70           1HB      GLN  70  -3.623 -12.815  15.079
  463    HB3  GLN  70           2HB      GLN  70  -4.630 -11.738  14.120
  464    HG2  GLN  70           1HG      GLN  70  -6.572 -13.042  14.552
  465    HG3  GLN  70           2HG      GLN  70  -5.615 -14.324  15.293
  466   HE21  GLN  70          1HE2      GLN  70  -7.202 -13.966  17.035
  467   HE22  GLN  70          2HE2      GLN  70  -6.854 -12.757  18.219
  468    H    HIS  71           H        HIS  71  -4.334 -12.363  10.940
  469    HA   HIS  71           HA       HIS  71  -7.059 -13.357  10.415
  470    HB2  HIS  71           1HB      HIS  71  -5.882 -10.621  10.055
  471    HB3  HIS  71           2HB      HIS  71  -7.219 -11.147   9.037
  472    HD2  HIS  71           2HD      HIS  71  -8.264 -12.728  12.108
  473    HE1  HIS  71           1HE      HIS  71  -9.438  -8.693  12.690
  474    HE2  HIS  71           2HE      HIS  71  -9.631 -11.058  13.533
  475    H    LEU  72           H        LEU  72  -3.851 -13.019   9.303
  476    HA   LEU  72           HA       LEU  72  -4.069 -12.984   6.556
  477    HB2  LEU  72           1HB      LEU  72  -1.958 -12.925   7.856
  478    HB3  LEU  72           2HB      LEU  72  -2.133 -14.653   8.153
  479    HG   LEU  72           HG       LEU  72  -2.192 -14.708   5.493
  480   HD11  LEU  72          1HD1      LEU  72  -0.641 -13.088   4.555
  481   HD12  LEU  72          2HD1      LEU  72  -0.500 -12.293   6.122
  482   HD13  LEU  72          3HD1      LEU  72  -2.039 -12.276   5.261
  483   HD21  LEU  72          1HD2      LEU  72   0.538 -14.363   6.551
  484   HD22  LEU  72          2HD2      LEU  72  -0.180 -15.712   5.671
  485   HD23  LEU  72          3HD2      LEU  72  -0.478 -15.529   7.400
  486    HA   PRO  73           HA       PRO  73  -6.396 -16.729   5.856
  487    HB2  PRO  73           1HB      PRO  73  -6.520 -16.458   3.158
  488    HB3  PRO  73           2HB      PRO  73  -7.547 -15.538   4.264
  489    HG2  PRO  73           1HG      PRO  73  -5.028 -14.701   2.880
  490    HG3  PRO  73           2HG      PRO  73  -6.535 -13.794   3.106
  491    HD2  PRO  73           1HD      PRO  73  -4.347 -13.391   4.650
  492    HD3  PRO  73           2HD      PRO  73  -6.000 -13.198   5.267
  493    H    GLN  74           H        GLN  74  -6.152 -18.537   4.109
  494    HA   GLN  74           HA       GLN  74  -3.447 -19.005   3.216
  495    HB2  GLN  74           1HB      GLN  74  -4.659 -20.529   5.503
  496    HB3  GLN  74           2HB      GLN  74  -3.464 -21.280   4.453
  497    HG2  GLN  74           1HG      GLN  74  -2.085 -20.487   6.064
  498    HG3  GLN  74           2HG      GLN  74  -2.118 -19.077   5.008
  499   HE21  GLN  74          1HE2      GLN  74  -1.373 -18.482   7.404
  500   HE22  GLN  74          2HE2      GLN  74  -2.628 -17.762   8.348
  501    H    THR  75           H        THR  75  -3.453 -20.177   1.400
  502    HA   THR  75           HA       THR  75  -5.969 -21.491   0.636
  503    HB   THR  75           HB       THR  75  -5.156 -19.693  -0.868
  504    HG1  THR  75           1HG      THR  75  -5.712 -20.833  -2.640
  505   HG21  THR  75          1HG2      THR  75  -2.897 -19.616  -1.022
  506   HG22  THR  75          2HG2      THR  75  -3.166 -20.721  -2.370
  507   HG23  THR  75          3HG2      THR  75  -2.717 -21.354  -0.787
  508    H    ASP  76           H        ASP  76  -4.204 -22.829   2.390
  509    HA   ASP  76           HA       ASP  76  -3.448 -25.101   0.688
  510    HB2  ASP  76           1HB      ASP  76  -1.390 -25.438   1.831
  511    HB3  ASP  76           2HB      ASP  76  -1.439 -23.729   1.406
  512    H    SER  77           H        SER  77  -4.311 -23.922   3.896
  513    HA   SER  77           HA       SER  77  -5.363 -26.604   4.514
  514    HB2  SER  77           1HB      SER  77  -3.445 -26.286   5.923
  515    HB3  SER  77           2HB      SER  77  -3.967 -24.659   6.362
  516    HG   SER  77           HG       SER  77  -5.493 -26.975   6.937
  517    H    GLY  78           H        GLY  78  -7.471 -26.672   4.941
  518    HA2  GLY  78           1HA      GLY  78  -8.826 -24.527   6.301
  519    HA3  GLY  78           2HA      GLY  78  -9.249 -24.638   4.598
  520    HA   PRO  79           HA       PRO  79 -11.075 -28.242   7.329
  521    HB2  PRO  79           1HB      PRO  79 -12.621 -27.088   9.239
  522    HB3  PRO  79           2HB      PRO  79 -10.937 -27.547   9.515
  523    HG2  PRO  79           1HG      PRO  79 -12.086 -24.859   8.870
  524    HG3  PRO  79           2HG      PRO  79 -10.834 -25.287  10.051
  525    HD2  PRO  79           1HD      PRO  79 -10.251 -24.238   7.623
  526    HD3  PRO  79           2HD      PRO  79  -9.181 -25.390   8.448
  527    H    SER  80           H        SER  80 -12.052 -25.598   5.613
  528    HA   SER  80           HA       SER  80 -14.735 -25.331   5.661
  529    HB2  SER  80           1HB      SER  80 -14.670 -24.946   3.217
  530    HB3  SER  80           2HB      SER  80 -13.331 -24.151   4.046
  531    HG   SER  80           HG       SER  80 -13.271 -26.550   2.540
  532    H    SER  81           H        SER  81 -13.016 -27.953   3.982
  533    HA   SER  81           HA       SER  81 -15.112 -29.300   2.849
  534    HB2  SER  81           1HB      SER  81 -13.750 -31.299   2.928
  535    HB3  SER  81           2HB      SER  81 -12.696 -29.914   2.642
  536    HG   SER  81           HG       SER  81 -13.159 -31.139   5.162
  537    H    GLY  82           H        GLY  82 -13.900 -29.692   6.174
  538    HA2  GLY  82           1HA      GLY  82 -15.104 -30.216   8.087
  539    HA3  GLY  82           2HA      GLY  82 -16.555 -30.337   7.103